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nanoparticlesims/growth_Melting_Silver_ICO_3269/freezeSims/run_58/freeze.log

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main_MD> Reading input file
read_input> Process type: freezing
Read_input> Process caloric with a T-change of 25.000000000000000 [K] and a rate of 9.9999999999999992E+022 [K/ns]
read_input> Input for metadynamics has been read
read_input> Metadynamics has not been chosen.
read_input> Reading initial positions fromtoFreeze_58.xyz
read_input> Finish reading initial positions
read_input> Validating positions
read_input> Initializing random number generator
read_input> Checking program
read_rgl> START READING FILE ../pot.pot
read_rgl>> END READING FILE ../pot.pot
READ_RGL>> atomic speciesAgAg imet1 4 imet2 4
READ_RGL>> atomic radius 1.4450000999999999 1.4450000999999999
read_rgl> PARAMETERS SELECTION
FOR IMET1 :: Ag 4
ECOH :: 2.9500000000000002 A :: 0.10308871000000000 QSI :: 1.1895434899999999
p :: 10.850000000000000 q :: 3.1800000000000002
ATOMIC RADIUS :: 1.4450000999999999
choice_pot> values:
frac = 0.12062503764379931 arete = 4.0870774781009569
choice_pot> mass is== 108.00000000000000 for elem1=
read_input> ntipo1 = 58 ntipo2 = 0
read_input> Finish reading input
main_MD> Allocating global variables
main_MD> Number of outputs that will be created: 2050
main_MD> Size of nv and nvoiz: 58 5800
main_MD> Size of nv and nvoiz: 58 5800
main_MD> Number of time-steps (npas) = 50000
main_MD> Number of CVs (num_cv) = 1
main_MD> Max allowed number of atoms = 2900
main_MD> Max number of atoms = 58
main_MD> Consider changing parameter nsiz in module_parameters.f90 for performance
main_MD> collvar_wanted = F
main_MD> INPUT AND POTENTIAL FILE READING IS DONE
main_MD> THERMALIZATION IS STARTING
init> 3.8225718752855922E-002 -3.4480172564407989E-002 7.6675466892298077E-003 initial drift of cluster / NP1 for coalescence
init> 0.29954889801815587 0.28270839461529701 0.29577820402154537 scaling for velocity /for coalescence NP1
init.f90 > facguy = 3.9213944341953662E-003
preparo> IN BIGVOI : LIMIT 1.2247448652052084 1.2247448652052084 1.2247448652052084
preparo> END t=0 TIME STEP
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.79272 -1.08438 -1.22829
force_rgl> df(natom) -2.62794 3.14048 -0.61357
preparo> THERMALIZATION PROCESS AT 1327.7085434175158
preparo> TOTAL ENERGY, KINETIC EN., POT. ENERGY, DELTA
5000 -122.67865895308989 10.733377257932737 -133.41203621102264 6.9091896864052153E-004
preparo> END THERMALISATION ON NPAST DEFINE IN PARACLUSTER MODULE
main_MD> Time-loop is starting for freezing
main_MD> Now the computation of EXECUTION TIME starts
main_MD> Running from loop 1 to 41
FREEZING PROCESS: loop number 1 T-loop= 1309.0000000000000
main_MD> interactions number 1 at Temperature= 1309.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.65591 1.93230 -0.84393
force_rgl> df(natom) -3.85319 -8.43836 -4.94041
5.0000 -133.62512 -122.61783 11.00729 3.24874 -122.42196 1383.28751
10.0000 -134.37318 -124.93288 9.44030 3.20180 -123.12531 1350.33810
15.0000 -133.23848 -123.37971 9.85877 3.12078 -124.33918 1266.46652
20.0000 -133.94148 -123.13443 10.80704 3.18439 -123.38615 1361.97226
25.0000 -135.41886 -124.12783 11.29103 3.21792 -122.88376 1420.33552
30.0000 -133.17317 -124.43378 8.73939 3.13679 -124.09929 1297.68636
35.0000 -132.71299 -123.45248 9.26051 3.14712 -123.94457 1285.66086
40.0000 -132.42572 -122.46584 9.95988 3.20407 -123.09118 1362.93884
45.0000 -134.32360 -125.04501 9.27859 3.07175 -125.07387 1274.69659
50.0000 -133.77347 -123.79803 9.97543 3.14120 -124.03329 1272.73947
55.0000 -132.09811 -122.68196 9.41616 3.23431 -122.63809 1424.51929
60.0000 -134.58028 -123.78421 10.79607 3.18226 -123.41795 1334.19467
65.0000 -133.60989 -123.69421 9.91568 3.16316 -123.70414 1307.50572
70.0000 -133.87921 -124.78303 9.09618 3.05728 -125.29065 1243.68975
75.0000 -132.80472 -124.65329 8.15142 3.08087 -124.93714 1250.67915
80.0000 -133.51483 -124.68462 8.83021 3.14180 -124.02428 1287.17217
85.0000 -133.07195 -123.74055 9.33139 3.10136 -124.63020 1246.75166
90.0000 -132.55461 -122.72056 9.83405 3.15127 -123.88231 1289.78617
95.0000 -132.68524 -124.03965 8.64559 3.19167 -123.27700 1323.73433
100.0000 -135.70643 -127.12635 8.58008 3.02285 -125.80657 1182.79434
105.0000 -135.70703 -125.86138 9.84565 2.93329 -127.14854 1175.94911
110.0000 -135.35540 -125.25730 10.09809 3.06149 -125.22756 1226.66270
115.0000 -133.52889 -122.41395 11.11494 3.18554 -123.36890 1347.21889
120.0000 -132.95649 -122.49706 10.45944 3.33680 -121.10249 1431.69441
125.0000 -134.35512 -121.67663 12.67849 3.23541 -122.62168 1342.83558
130.0000 -131.98225 -122.35289 9.62936 3.30762 -121.53966 1406.65423
135.0000 -133.61207 -124.12211 9.48996 3.18177 -123.42530 1281.06160
140.0000 -135.40894 -125.56335 9.84558 3.05479 -125.32801 1259.73724
145.0000 -135.05607 -125.92859 9.12748 2.98562 -126.36442 1191.55508
150.0000 -132.55822 -122.45631 10.10191 3.07243 -125.06369 1287.49415
155.0000 -131.63834 -121.59428 10.04406 3.23828 -122.57866 1405.82396
160.0000 -134.19999 -123.64465 10.55535 3.25146 -122.38119 1398.22976
165.0000 -134.47560 -123.00732 11.46829 3.15128 -123.88218 1302.65369
170.0000 -132.86113 -123.58678 9.27435 3.11526 -124.42199 1272.93225
175.0000 -134.63164 -124.38035 10.25129 3.14196 -124.02191 1317.41618
180.0000 -133.46653 -123.08745 10.37908 3.20103 -123.13677 1352.36264
185.0000 -131.54431 -124.50605 7.03826 3.15308 -123.85521 1274.77952
190.0000 -132.90618 -122.77060 10.13558 3.16545 -123.66984 1268.84183
195.0000 -131.57274 -122.72815 8.84459 3.22591 -122.76397 1337.33506
200.0000 -134.56767 -125.46544 9.10223 3.14193 -124.02234 1309.95185
205.0000 -135.28400 -125.72866 9.55534 3.04993 -125.40085 1269.99531
210.0000 -135.37280 -126.25971 9.11309 2.96606 -126.65743 1173.22876
215.0000 -132.12291 -122.25481 9.86809 3.12056 -124.34251 1292.54410
220.0000 -133.93797 -122.20366 11.73431 3.28543 -121.87211 1404.93457
225.0000 -132.69866 -121.76060 10.93806 3.33292 -121.16058 1416.16193
230.0000 -133.11063 -120.27943 12.83120 3.26986 -122.10548 1362.90335
235.0000 -134.51376 -123.10287 11.41089 3.24901 -122.41783 1342.16820
240.0000 -131.40905 -122.88001 8.52905 3.25066 -122.39315 1365.45534
245.0000 -132.63301 -122.40143 10.23158 3.27717 -121.99596 1416.07790
250.0000 -132.30702 -122.73602 9.57100 3.24484 -122.48037 1376.85987
FREEZING PROCESS: loop number 2 T-loop= 1284.0000000000000
main_MD> interactions number 2 at Temperature= 1284.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.27713 8.09485 4.95201
force_rgl> df(natom) 0.72501 3.11491 -0.61838
255.0000 -134.17598 -124.62885 9.54714 3.14906 -123.91554 1290.45260
260.0000 -134.77536 -125.57702 9.19835 3.08490 -124.87684 1275.17509
265.0000 -136.23324 -127.00208 9.23116 3.02135 -125.82905 1242.12478
270.0000 -134.81723 -125.86295 8.95427 2.98147 -126.42654 1182.52781
275.0000 -134.20237 -125.10173 9.10064 3.05042 -125.39347 1267.76546
280.0000 -134.53758 -124.48306 10.05452 3.16391 -123.69291 1293.16279
285.0000 -134.01008 -124.77708 9.23299 2.99315 -126.25158 1184.82717
290.0000 -133.84436 -124.29860 9.54575 3.03962 -125.55528 1241.48609
295.0000 -133.65045 -124.43562 9.21483 3.17492 -123.52801 1313.42090
300.0000 -135.12376 -124.28681 10.83695 3.11546 -124.41896 1278.63420
305.0000 -132.65386 -122.09461 10.55925 3.19316 -123.25472 1361.45555
310.0000 -134.74539 -123.15316 11.59223 3.29660 -121.70473 1431.05854
315.0000 -131.26483 -121.93840 9.32643 3.26237 -122.21761 1400.57381
320.0000 -133.79922 -121.40542 12.39381 3.22791 -122.73403 1300.78022
325.0000 -134.24007 -122.91471 11.32536 3.24895 -122.41881 1367.23459
330.0000 -132.98124 -122.82687 10.15437 3.27149 -122.08106 1404.71990
335.0000 -134.45044 -124.74358 9.70686 3.18806 -123.33112 1319.30088
340.0000 -134.65337 -126.28907 8.36430 3.02784 -125.73178 1195.74861
345.0000 -136.30618 -127.01269 9.29349 2.93212 -127.16598 1176.33936
350.0000 -135.31205 -124.87375 10.43830 3.07636 -125.00478 1245.91875
355.0000 -132.56891 -123.46608 9.10284 3.13435 -124.13594 1296.79425
360.0000 -133.15470 -122.42471 10.72999 3.33257 -121.16581 1459.48540
365.0000 -132.73030 -121.70563 11.02467 3.23522 -122.62454 1404.67748
370.0000 -132.30424 -120.27549 12.02876 3.33300 -121.15933 1473.22396
375.0000 -132.46370 -122.33176 10.13194 3.33412 -121.14257 1426.72022
380.0000 -135.64945 -125.47772 10.17174 3.12625 -124.25728 1290.10101
385.0000 -136.88649 -128.45554 8.43095 2.93821 -127.07477 1144.17119
390.0000 -136.16351 -125.72917 10.43434 2.91521 -127.41942 1135.21621
395.0000 -136.40685 -127.54819 8.85865 2.95451 -126.83061 1185.66502
400.0000 -136.10761 -128.14913 7.95849 2.90885 -127.51470 1096.21566
405.0000 -133.58142 -126.43713 7.14429 2.96607 -126.65729 1149.16109
410.0000 -135.64371 -126.03145 9.61226 3.00296 -126.10457 1190.33652
415.0000 -136.32229 -126.69525 9.62704 3.06954 -125.10698 1276.54624
420.0000 -133.73651 -124.96270 8.77382 3.00749 -126.03673 1179.53747
425.0000 -136.18213 -126.30271 9.87942 3.11479 -124.42894 1278.64012
430.0000 -133.41491 -124.48932 8.92558 2.98361 -126.39456 1166.61255
435.0000 -130.24628 -120.41252 9.83376 3.28057 -121.94490 1388.79837
440.0000 -132.06478 -122.67080 9.39398 3.29744 -121.69213 1326.75517
445.0000 -135.85773 -127.65754 8.20019 3.10372 -124.59479 1285.87550
450.0000 -136.32508 -126.91191 9.41317 2.94978 -126.90147 1160.90637
455.0000 -134.61417 -126.46401 8.15016 3.00296 -126.10455 1175.55866
460.0000 -135.71870 -126.81851 8.90020 2.96835 -126.62325 1137.75591
465.0000 -132.84228 -126.30879 6.53349 2.97732 -126.48876 1169.52404
470.0000 -137.24378 -128.79345 8.45033 2.92404 -127.28706 1140.41253
475.0000 -136.46485 -128.19942 8.26543 2.87906 -127.96113 1101.32879
480.0000 -133.67464 -123.60234 10.07230 3.01321 -125.95108 1211.75853
485.0000 -133.76831 -121.65220 12.11611 3.21176 -122.97606 1393.17389
490.0000 -134.40510 -125.53850 8.86660 3.12637 -124.25539 1307.81723
495.0000 -133.18916 -123.43089 9.75827 3.08920 -124.81241 1251.98678
500.0000 -134.19676 -125.80620 8.39056 3.04128 -125.53038 1243.73813
FREEZING PROCESS: loop number 3 T-loop= 1259.0000000000000
main_MD> interactions number 3 at Temperature= 1259.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.36823 0.88590 -1.27898
force_rgl> df(natom) 1.92700 -3.45142 -0.48399
505.0000 -133.33258 -124.29879 9.03379 3.08350 -124.89784 1212.14892
510.0000 -135.11865 -126.41659 8.70207 3.03073 -125.68855 1234.58865
515.0000 -133.89546 -124.92365 8.97180 3.02154 -125.82622 1200.92844
520.0000 -134.93292 -124.77503 10.15788 3.15286 -123.85857 1332.57152
525.0000 -133.39279 -124.39001 9.00278 3.05857 -125.27139 1211.12855
530.0000 -133.20296 -124.77631 8.42665 3.07091 -125.08640 1225.32665
535.0000 -134.54989 -124.77737 9.77252 3.18685 -123.34926 1308.40946
540.0000 -135.35460 -125.34819 10.00642 3.04626 -125.45582 1218.52332
545.0000 -133.53970 -124.67562 8.86408 3.14355 -123.99806 1300.36358
550.0000 -133.59491 -123.79273 9.80218 3.16096 -123.73712 1313.94150
555.0000 -134.64048 -125.38004 9.26045 3.11127 -124.48169 1262.92166
560.0000 -134.24565 -123.65191 10.59374 3.12579 -124.26408 1297.81067
565.0000 -132.26482 -123.43629 8.82853 3.09173 -124.77453 1256.18107
570.0000 -132.46891 -121.58655 10.88236 3.25512 -122.32628 1368.21232
575.0000 -133.05017 -123.28712 9.76305 3.21348 -122.95018 1357.68582
580.0000 -134.77465 -124.90240 9.87225 3.16806 -123.63074 1348.27668
585.0000 -132.22150 -124.09089 8.13061 3.05858 -125.27115 1260.58177
590.0000 -133.32661 -123.90027 9.42635 3.06067 -125.23995 1247.84087
595.0000 -134.83181 -124.77552 10.05629 3.12381 -124.29379 1299.63657
600.0000 -134.90019 -124.29181 10.60838 3.12179 -124.32412 1317.61907
605.0000 -133.62294 -123.97127 9.65166 3.15501 -123.82637 1297.71409
610.0000 -135.32492 -125.55404 9.77088 3.04025 -125.54588 1213.05431
615.0000 -136.08116 -126.37340 9.70776 3.02134 -125.82919 1200.94008
620.0000 -132.18895 -123.39031 8.79864 3.14643 -123.95491 1332.99906
625.0000 -133.92085 -123.10281 10.81804 3.17801 -123.48174 1357.79859
630.0000 -134.45439 -125.39018 9.06422 3.21216 -122.97002 1321.44329
635.0000 -134.95355 -125.03431 9.91924 3.09018 -124.79766 1212.80893
640.0000 -133.31545 -123.42222 9.89323 3.12286 -124.30799 1263.70446
645.0000 -136.01643 -124.53896 11.47747 3.17734 -123.49166 1364.70039
650.0000 -131.76419 -122.78637 8.97782 3.15630 -123.80702 1306.21657
655.0000 -134.13940 -123.93063 10.20877 3.16174 -123.72552 1315.58783
660.0000 -134.92162 -128.18120 6.74042 3.06571 -125.16431 1274.89275
665.0000 -134.74462 -126.29145 8.45317 2.89083 -127.78467 1132.60560
670.0000 -134.31513 -125.84636 8.46876 3.04400 -125.48971 1235.10552
675.0000 -134.61448 -127.07297 7.54152 3.00343 -126.09762 1210.16916
680.0000 -135.52166 -125.84392 9.67774 2.96476 -126.67692 1160.62217
685.0000 -135.83281 -126.17217 9.66064 3.01149 -125.97680 1155.45399
690.0000 -136.08038 -126.77866 9.30172 2.96565 -126.66367 1176.77764
695.0000 -134.64243 -126.71284 7.92960 2.95955 -126.75505 1140.49027
700.0000 -135.20344 -126.74396 8.45947 3.02852 -125.72162 1162.78210
705.0000 -135.72555 -126.80653 8.91902 2.93634 -127.10282 1187.99732
710.0000 -135.49043 -126.88452 8.60591 2.98226 -126.41479 1193.97445
715.0000 -134.97745 -124.70302 10.27443 3.03016 -125.69697 1209.59735
720.0000 -133.86871 -124.64842 9.22029 3.13030 -124.19661 1325.53618
725.0000 -134.35613 -124.05768 10.29845 3.11035 -124.49552 1308.16716
730.0000 -135.10783 -126.59798 8.50985 3.15391 -123.84286 1282.61626
735.0000 -133.74663 -124.75229 8.99434 3.05828 -125.27571 1235.16801
740.0000 -133.33100 -123.89970 9.43129 3.20709 -123.04603 1374.83493
745.0000 -134.19720 -122.80414 11.39306 3.27770 -121.98796 1406.07723
750.0000 -135.52564 -125.07307 10.45258 3.09036 -124.79503 1243.10404
FREEZING PROCESS: loop number 4 T-loop= 1234.0000000000000
main_MD> interactions number 4 at Temperature= 1234.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.07521 -2.13146 2.42926
force_rgl> df(natom) 0.29542 -1.38599 1.47317
755.0000 -133.47179 -125.78538 7.68640 3.01252 -125.96131 1154.49236
760.0000 -134.27427 -124.96410 9.31017 3.07612 -125.00838 1214.51998
765.0000 -135.29725 -125.64844 9.64881 3.11446 -124.43396 1280.89568
770.0000 -135.29336 -126.22532 9.06804 2.94403 -126.98762 1162.85975
775.0000 -135.12886 -125.73690 9.39196 3.02338 -125.79855 1225.74718
780.0000 -137.13133 -128.26186 8.86948 2.97659 -126.49972 1168.79320
785.0000 -134.66114 -126.69647 7.96467 2.86604 -128.15620 1083.06948
790.0000 -133.80574 -125.28108 8.52466 2.97837 -126.47297 1208.23727
795.0000 -134.53591 -124.97089 9.56502 3.05981 -125.25282 1252.97839
800.0000 -136.12310 -126.30602 9.81708 3.09495 -124.72625 1300.10631
805.0000 -134.26370 -124.95105 9.31265 2.99616 -126.20652 1206.81865
810.0000 -134.78497 -126.23100 8.55397 3.00578 -126.06241 1174.67861
815.0000 -134.88552 -126.48872 8.39679 3.05729 -125.29046 1219.88807
820.0000 -133.37785 -125.29711 8.08074 3.06768 -125.13487 1238.75697
825.0000 -136.26554 -127.48031 8.78523 3.01132 -125.97938 1199.20053
830.0000 -135.56117 -127.31315 8.24801 2.96745 -126.63660 1184.28926
835.0000 -135.84643 -126.43172 9.41471 2.90141 -127.62612 1138.56532
840.0000 -134.32186 -125.45789 8.86397 3.02435 -125.78404 1209.89087
845.0000 -134.16072 -126.32880 7.83192 2.99183 -126.27129 1182.07800
850.0000 -135.07445 -125.17536 9.89909 3.04028 -125.54533 1227.30191
855.0000 -133.33481 -122.86657 10.46824 3.08438 -124.88467 1254.66969
860.0000 -133.78563 -124.47729 9.30834 3.12767 -124.23601 1300.80651
865.0000 -132.47378 -123.78412 8.68966 3.13532 -124.12138 1274.53692
870.0000 -133.90807 -127.15433 6.75374 3.12236 -124.31557 1254.20284
875.0000 -134.85385 -124.47153 10.38232 2.97897 -126.46398 1185.43022
880.0000 -132.51905 -124.06794 8.45110 3.18443 -123.38551 1352.73932
885.0000 -132.46894 -123.71925 8.74969 3.14705 -123.94552 1283.96535
890.0000 -134.31035 -124.09418 10.21617 3.12174 -124.32478 1291.07209
895.0000 -135.73266 -126.22387 9.50879 3.09223 -124.76704 1256.29345
900.0000 -134.53448 -126.18662 8.34786 3.00297 -126.10449 1199.59209
905.0000 -134.05138 -125.68311 8.36827 3.06397 -125.19049 1276.24364
910.0000 -132.57101 -124.92652 7.64450 3.12285 -124.30824 1266.45894
915.0000 -135.77653 -126.00567 9.77086 3.04682 -125.44746 1208.07495
920.0000 -134.82748 -125.22069 9.60679 3.11453 -124.43284 1303.82116
925.0000 -135.37552 -124.55285 10.82268 3.06387 -125.19187 1220.85326
930.0000 -134.91015 -126.14816 8.76199 3.07228 -125.06594 1268.78121
935.0000 -133.38511 -124.02838 9.35672 3.04937 -125.40920 1243.93778
940.0000 -133.46439 -124.85344 8.61095 3.05899 -125.26512 1192.16699
945.0000 -132.77851 -125.06514 7.71337 3.13940 -124.06019 1278.96215
950.0000 -135.55360 -125.58553 9.96807 3.08388 -124.89218 1290.41634
955.0000 -133.55470 -123.77414 9.78056 3.08684 -124.84775 1264.89076
960.0000 -134.20578 -124.20756 9.99822 3.17721 -123.49369 1337.31550
965.0000 -134.83054 -125.92613 8.90441 3.12256 -124.31256 1272.46086
970.0000 -131.22034 -122.67558 8.54475 3.07989 -124.95189 1244.09419
975.0000 -133.11228 -123.92655 9.18573 3.19061 -123.29290 1293.27628
980.0000 -134.11829 -123.35529 10.76299 3.11169 -124.47548 1243.47663
985.0000 -135.29509 -125.47159 9.82350 3.11578 -124.41406 1278.88052
990.0000 -135.16262 -126.98955 8.17307 3.03365 -125.64472 1219.60866
995.0000 -132.67032 -124.04746 8.62286 3.00117 -126.13137 1230.70909
1000.0000 -131.95019 -122.53168 9.41851 3.18514 -123.37489 1328.76292
FREEZING PROCESS: loop number 5 T-loop= 1209.0000000000000
main_MD> interactions number 5 at Temperature= 1209.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.09704 0.29910 0.25082
force_rgl> df(natom) -2.45618 -1.34321 -2.24738
1005.0000 -135.25789 -125.75223 9.50566 3.14224 -124.01772 1253.74527
1010.0000 -134.39987 -125.52512 8.87475 2.98268 -126.40847 1208.27432
1015.0000 -133.67245 -125.92157 7.75088 2.99436 -126.23340 1195.02224
1020.0000 -135.49643 -126.65205 8.84439 3.02830 -125.72485 1169.98338
1025.0000 -137.63158 -127.81365 9.81793 2.92201 -127.31759 1144.75304
1030.0000 -134.04592 -125.24773 8.79819 3.00762 -126.03480 1179.30625
1035.0000 -134.68609 -125.83696 8.84912 2.97835 -126.47338 1151.02897
1040.0000 -135.05878 -125.73972 9.31906 2.97424 -126.53490 1176.45281
1045.0000 -133.40367 -126.17876 7.22491 3.05365 -125.34505 1205.74529
1050.0000 -133.68683 -123.82063 9.86620 3.06256 -125.21163 1231.78661
1055.0000 -132.93607 -123.59607 9.34000 3.22109 -122.83624 1340.34914
1060.0000 -134.00296 -124.66781 9.33514 3.05792 -125.28112 1258.89072
1065.0000 -137.44186 -127.89876 9.54310 2.98156 -126.42531 1199.52099
1070.0000 -134.96479 -126.65221 8.31257 2.97153 -126.57550 1160.26494
1075.0000 -136.06512 -128.05350 8.01162 2.93344 -127.14621 1140.42304
1080.0000 -134.99914 -125.76557 9.23358 2.92356 -127.29428 1156.02462
1085.0000 -134.90778 -127.14449 7.76328 2.97110 -126.58194 1167.07717
1090.0000 -134.82173 -125.64943 9.17230 2.96238 -126.71259 1146.55971
1095.0000 -132.39660 -122.95618 9.44042 3.10745 -124.53902 1300.32893
1100.0000 -132.57623 -122.41195 10.16428 3.28706 -121.84770 1419.23114
1105.0000 -133.39567 -123.73461 9.66106 3.16682 -123.64939 1300.27635
1110.0000 -135.20960 -124.98345 10.22616 3.11460 -124.43184 1274.40661
1115.0000 -135.63679 -125.03977 10.59702 3.07698 -124.99544 1254.04012
1120.0000 -131.79105 -121.83125 9.95980 3.16278 -123.70989 1313.97708
1125.0000 -134.41745 -125.23968 9.17777 3.15984 -123.75401 1310.94934
1130.0000 -134.49898 -126.52188 7.97709 2.98560 -126.36477 1147.45284
1135.0000 -133.12769 -124.88589 8.24180 3.10111 -124.63394 1262.72443
1140.0000 -133.59540 -123.44686 10.14854 3.08241 -124.91408 1256.11620
1145.0000 -134.56362 -124.62557 9.93805 3.14009 -124.04984 1311.47636
1150.0000 -134.24710 -123.71782 10.52929 3.11907 -124.36488 1281.51676
1155.0000 -133.12183 -124.98794 8.13389 3.05934 -125.25985 1245.65940
1160.0000 -134.94088 -125.25014 9.69074 3.14491 -123.97760 1264.89265
1165.0000 -134.22940 -124.51013 9.71927 3.10071 -124.63989 1311.26077
1170.0000 -137.13196 -127.29166 9.84031 3.00002 -126.14857 1200.39206
1175.0000 -134.69044 -126.42458 8.26586 2.88165 -127.92230 1129.99506
1180.0000 -137.50827 -128.86856 8.63971 2.87596 -128.00750 1117.60719
1185.0000 -135.73413 -125.95342 9.78071 2.88997 -127.79754 1124.32064
1190.0000 -133.26609 -124.81531 8.45078 3.08553 -124.86744 1217.83748
1195.0000 -136.86928 -128.24784 8.62143 2.96748 -126.63625 1194.62029
1200.0000 -134.37913 -127.21497 7.16416 2.87306 -128.05096 1117.98939
1205.0000 -134.84687 -126.00778 8.83909 2.91770 -127.38213 1104.15708
1210.0000 -134.26656 -125.80592 8.46064 3.03683 -125.59703 1211.98687
1215.0000 -132.57144 -123.39281 9.17863 3.11336 -124.45045 1312.38581
1220.0000 -136.00110 -126.32162 9.67948 3.14560 -123.96725 1293.95172
1225.0000 -133.84809 -125.41569 8.43240 3.05492 -125.32608 1231.44023
1230.0000 -132.73689 -123.08045 9.65644 3.17106 -123.58581 1303.69314
1235.0000 -133.14994 -124.81095 8.33899 3.16075 -123.74027 1313.57152
1240.0000 -135.28518 -126.26653 9.01864 3.08475 -124.87910 1285.93398
1245.0000 -134.55000 -127.54184 7.00817 2.97982 -126.45130 1199.91724
1250.0000 -135.59631 -126.73234 8.86398 2.93605 -127.10711 1135.85531
FREEZING PROCESS: loop number 6 T-loop= 1184.0000000000000
main_MD> interactions number 6 at Temperature= 1184.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.56482 -2.53375 1.93561
force_rgl> df(natom) 0.96969 0.44852 -0.90877
1255.0000 -137.03456 -128.95009 8.08448 2.91217 -127.46492 1129.23914
1260.0000 -136.57498 -127.61390 8.96107 2.76217 -129.71252 1049.65484
1265.0000 -134.72793 -125.16479 9.56314 2.94222 -127.01473 1161.81030
1270.0000 -133.32796 -123.73101 9.59696 3.10504 -124.57498 1287.13464
1275.0000 -135.19307 -125.15403 10.03904 3.06651 -125.15243 1249.29586
1280.0000 -134.64946 -125.10741 9.54205 3.03788 -125.58134 1169.87914
1285.0000 -136.07889 -126.41736 9.66153 3.17427 -123.53780 1332.45376
1290.0000 -133.35525 -123.86922 9.48603 2.99425 -126.23508 1192.53788
1295.0000 -134.28286 -123.84831 10.43454 3.11650 -124.40335 1291.94027
1300.0000 -134.29617 -124.59427 9.70189 3.09834 -124.67539 1244.86978
1305.0000 -134.84277 -125.87351 8.96926 3.09224 -124.76684 1263.83951
1310.0000 -135.70341 -127.65121 8.05220 3.03080 -125.68740 1203.69711
1315.0000 -136.24850 -127.65165 8.59686 2.89739 -127.68643 1066.19728
1320.0000 -135.56688 -127.30521 8.26167 2.84654 -128.44829 1107.50827
1325.0000 -136.44458 -128.09259 8.35198 2.92669 -127.24733 1132.12865
1330.0000 -135.09367 -126.31552 8.77815 2.87670 -127.99649 1101.67582
1335.0000 -136.17635 -128.03354 8.14280 2.96674 -126.64726 1167.73911
1340.0000 -138.36110 -129.71450 8.64660 2.78462 -129.37612 1050.10712
1345.0000 -136.91193 -130.24128 6.67065 2.74911 -129.90827 1013.56854
1350.0000 -136.08965 -128.93079 7.15886 2.72087 -130.33136 994.59294
1355.0000 -135.20248 -126.74248 8.46000 2.90289 -127.60403 1133.70788
1360.0000 -134.14693 -125.38558 8.76134 2.96031 -126.74368 1155.85143
1365.0000 -133.76559 -125.76521 8.00038 3.04244 -125.51308 1253.34028
1370.0000 -135.13330 -125.70225 9.43106 3.01540 -125.91818 1227.74299
1375.0000 -135.23508 -124.39883 10.83625 3.01032 -125.99436 1193.01076
1380.0000 -134.27672 -126.30048 7.97625 3.06425 -125.18622 1243.14551
1385.0000 -134.38681 -123.18216 11.20465 3.03130 -125.67992 1237.34189
1390.0000 -134.63770 -125.00943 9.62827 3.17835 -123.47656 1250.40676
1395.0000 -137.06356 -126.65350 10.41006 2.99875 -126.16765 1162.27247
1400.0000 -135.11851 -124.74861 10.36989 3.00546 -126.06712 1176.25307
1405.0000 -135.50753 -127.47260 8.03492 2.96200 -126.71838 1147.74207
1410.0000 -135.23487 -126.68858 8.54629 2.90808 -127.52621 1123.78481
1415.0000 -135.92851 -127.75080 8.17771 2.89784 -127.67966 1157.19082
1420.0000 -135.49384 -126.43743 9.05641 2.95308 -126.85199 1182.64492
1425.0000 -135.85475 -126.33034 9.52441 2.98265 -126.40896 1184.35017
1430.0000 -136.30247 -127.91002 8.39245 2.93926 -127.05902 1142.58205
1435.0000 -133.41971 -124.52711 8.89261 3.00258 -126.11033 1215.66535
1440.0000 -134.83736 -125.36925 9.46811 3.11945 -124.35912 1282.47922
1445.0000 -134.57293 -126.50681 8.06612 3.10419 -124.58782 1209.00778
1450.0000 -135.83398 -128.12438 7.70960 2.96875 -126.61714 1127.00863
1455.0000 -136.89594 -127.73821 9.15773 2.86719 -128.13894 1059.32955
1460.0000 -135.05386 -125.84086 9.21299 2.98135 -126.42837 1208.42930
1465.0000 -134.08506 -124.97277 9.11229 3.01848 -125.87199 1191.12845
1470.0000 -135.54425 -125.15550 10.38874 3.11272 -124.45996 1323.82805
1475.0000 -136.52394 -127.61812 8.90582 2.94023 -127.04452 1145.61578
1480.0000 -134.63579 -127.35681 7.27898 2.98941 -126.30764 1189.27173
1485.0000 -134.16057 -125.94654 8.21402 2.93802 -127.07769 1132.84565
1490.0000 -134.35640 -125.00994 9.34646 3.13495 -124.12685 1267.68486
1495.0000 -134.21930 -126.11417 8.10514 3.06128 -125.23080 1228.55835
1500.0000 -133.32135 -124.32883 8.99252 3.03610 -125.60805 1214.06786
FREEZING PROCESS: loop number 7 T-loop= 1159.0000000000000
main_MD> interactions number 7 at Temperature= 1159.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -2.42904 -3.05301 -2.50631
force_rgl> df(natom) -2.72732 -2.11524 -1.57347
1505.0000 -137.75554 -128.93135 8.82419 2.96622 -126.65505 1175.72516
1510.0000 -136.64381 -127.19086 9.45295 2.93184 -127.17019 1143.08411
1515.0000 -136.07972 -128.53280 7.54692 2.88331 -127.89734 1107.17491
1520.0000 -136.52131 -126.64245 9.87886 2.91720 -127.38953 1184.04874
1525.0000 -135.41234 -127.66935 7.74300 2.89745 -127.68556 1132.60272
1530.0000 -136.04288 -125.28145 10.76143 3.01990 -125.85079 1220.39925
1535.0000 -134.36718 -125.64996 8.71721 3.04717 -125.44218 1266.06464
1540.0000 -134.50701 -126.61993 7.88708 2.98598 -126.35903 1154.59373
1545.0000 -135.30609 -127.88623 7.41987 2.98578 -126.36207 1169.88984
1550.0000 -137.01772 -128.63196 8.38576 2.85987 -128.24867 1073.99634
1555.0000 -136.94971 -128.16829 8.78142 2.84720 -128.43840 1046.00753
1560.0000 -134.30758 -125.93427 8.37331 2.98232 -126.41379 1191.31287
1565.0000 -134.11877 -124.59557 9.52320 2.98444 -126.38203 1171.83002
1570.0000 -135.87053 -125.25596 10.61457 3.14578 -123.96469 1301.01180
1575.0000 -135.41433 -126.29122 9.12311 3.02197 -125.81976 1207.54860
1580.0000 -134.98346 -125.39825 9.58521 2.98916 -126.31143 1159.10674
1585.0000 -133.60402 -124.58712 9.01690 3.04236 -125.51424 1229.40051
1590.0000 -133.84032 -125.50928 8.33104 3.01725 -125.89045 1176.24934
1595.0000 -138.07773 -127.20861 10.86912 3.01238 -125.96352 1209.67934
1600.0000 -135.79956 -128.25418 7.54538 2.82164 -128.82139 1061.19834
1605.0000 -135.08226 -126.94249 8.13977 2.91326 -127.44858 1145.26911
1610.0000 -136.27829 -127.61852 8.65977 2.90945 -127.50576 1134.50404
1615.0000 -136.89208 -128.08374 8.80834 2.91899 -127.36277 1154.25607
1620.0000 -135.29839 -126.77441 8.52398 2.91312 -127.45080 1132.38748
1625.0000 -134.79938 -127.19661 7.60277 2.93168 -127.17257 1118.08561
1630.0000 -135.04279 -125.51668 9.52611 3.05289 -125.35652 1201.70704
1635.0000 -136.01809 -128.34583 7.67226 2.86540 -128.16573 1130.83822
1640.0000 -135.79369 -126.94429 8.84940 2.92095 -127.33346 1116.22266
1645.0000 -138.16720 -129.16531 9.00189 2.89072 -127.78642 1114.87039
1650.0000 -137.05385 -127.84446 9.20940 2.82113 -128.82910 1087.14606
1655.0000 -135.82268 -127.35026 8.47242 2.89497 -127.72267 1121.24971
1660.0000 -135.56897 -128.15939 7.40957 2.88530 -127.86761 1105.97137
1665.0000 -136.39158 -127.17523 9.21634 2.85258 -128.35781 1103.35513
1670.0000 -135.43259 -128.71701 6.71558 2.93854 -127.06988 1127.72538
1675.0000 -136.84234 -128.75763 8.08471 2.83326 -128.64737 1063.06220
1680.0000 -136.24602 -127.83655 8.40947 2.88078 -127.93533 1133.94644
1685.0000 -136.89682 -128.15249 8.74433 2.90258 -127.60859 1114.21921
1690.0000 -135.66473 -128.37260 7.29213 2.87033 -128.09191 1128.67235
1695.0000 -136.22597 -126.33964 9.88633 2.95825 -126.77447 1185.17370
1700.0000 -134.83235 -126.60414 8.22821 2.91240 -127.46144 1094.27212
1705.0000 -134.53038 -127.10754 7.42284 2.99850 -126.17149 1180.04836
1710.0000 -135.58485 -126.87318 8.71167 2.98737 -126.33814 1182.64300
1715.0000 -136.29155 -128.76051 7.53105 2.90918 -127.50981 1106.97142
1720.0000 -135.68946 -127.06061 8.62886 2.81854 -128.86788 1054.62674
1725.0000 -134.23679 -125.81694 8.41985 2.98077 -126.43705 1142.27247
1730.0000 -136.16824 -127.98421 8.18402 2.95850 -126.77079 1160.73436
1735.0000 -134.99935 -126.22217 8.77718 2.91621 -127.40445 1150.56550
1740.0000 -134.08929 -125.20794 8.88135 3.04136 -125.52922 1251.12870
1745.0000 -135.09511 -127.75719 7.33792 2.95088 -126.88493 1172.40619
1750.0000 -135.74064 -127.46932 8.27132 2.97820 -126.47551 1182.23316
FREEZING PROCESS: loop number 8 T-loop= 1134.0000000000000
main_MD> interactions number 8 at Temperature= 1134.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.31301 1.85647 2.19102
force_rgl> df(natom) -1.74036 -2.13209 -1.33727
1755.0000 -136.27782 -127.76724 8.51058 2.87739 -127.98613 1103.09918
1760.0000 -133.73170 -125.92528 7.80642 2.91906 -127.36165 1113.95537
1765.0000 -136.69008 -129.13722 7.55286 2.94402 -126.98779 1147.93452
1770.0000 -138.05438 -128.13788 9.91651 2.87676 -127.99555 1100.37942
1775.0000 -137.93274 -129.11878 8.81396 2.87445 -128.03011 1117.81997
1780.0000 -136.07823 -127.76761 8.31062 2.83738 -128.58564 1090.05403
1785.0000 -137.63449 -130.88931 6.74518 2.79089 -129.28225 1048.38244
1790.0000 -137.34798 -128.84565 8.50233 2.74984 -129.89730 997.67371
1795.0000 -136.20136 -127.91671 8.28465 2.91729 -127.38822 1146.60846
1800.0000 -135.53235 -127.73209 7.80026 2.89448 -127.73001 1142.70716
1805.0000 -136.37834 -127.56496 8.81338 2.88409 -127.88565 1105.81641
1810.0000 -136.68659 -127.87469 8.81190 2.95939 -126.75746 1145.32985
1815.0000 -136.36477 -127.43480 8.92997 2.85165 -128.37173 1075.88476
1820.0000 -135.69202 -127.52922 8.16280 2.90831 -127.52274 1142.88237
1825.0000 -136.44163 -127.38112 9.06051 2.90092 -127.63353 1148.01638
1830.0000 -136.38260 -128.20564 8.17696 2.85550 -128.31405 1118.63812
1835.0000 -135.67217 -126.60699 9.06518 2.95995 -126.74897 1201.20018
1840.0000 -136.80462 -128.99914 7.80548 2.89635 -127.70199 1106.81924
1845.0000 -135.89460 -127.06039 8.83421 2.87333 -128.04686 1111.41561
1850.0000 -136.69987 -128.59805 8.10182 2.90831 -127.52280 1161.46189
1855.0000 -136.54659 -126.73624 9.81036 2.88157 -127.92340 1111.43760
1860.0000 -136.65411 -129.52126 7.13286 2.86654 -128.14865 1066.73253
1865.0000 -138.39713 -129.58151 8.81562 2.77900 -129.46040 1033.02758
1870.0000 -137.23398 -129.23084 8.00314 2.77226 -129.56125 1039.60582
1875.0000 -137.95264 -129.35311 8.59953 2.84755 -128.43327 1121.36013
1880.0000 -136.31351 -126.65788 9.65563 2.86565 -128.16196 1132.44723
1885.0000 -133.40695 -125.50611 7.90084 3.02051 -125.84168 1203.26757
1890.0000 -136.13402 -127.14348 8.99054 2.99887 -126.16580 1176.88256
1895.0000 -134.41308 -123.66221 10.75087 3.02403 -125.78887 1200.79484
1900.0000 -133.07015 -124.16915 8.90099 3.12939 -124.21017 1290.17346
1905.0000 -136.44895 -127.14310 9.30585 2.97875 -126.46736 1181.75509
1910.0000 -135.65993 -127.53483 8.12511 2.91832 -127.37279 1151.85826
1915.0000 -136.17633 -127.82882 8.34751 2.91317 -127.45001 1142.11615
1920.0000 -135.06136 -126.50158 8.55977 2.92944 -127.20615 1077.78420
1925.0000 -134.90119 -126.81335 8.08784 3.02325 -125.80064 1172.66565
1930.0000 -136.96777 -129.34387 7.62390 2.92885 -127.21508 1141.08064
1935.0000 -136.95770 -129.48484 7.47285 2.80972 -129.00006 1067.33294
1940.0000 -135.77978 -126.09211 9.68767 2.93136 -127.17738 1137.44831
1945.0000 -135.06217 -126.14581 8.91636 3.02219 -125.81644 1199.45808
1950.0000 -136.86395 -128.77266 8.09129 2.88105 -127.93129 1131.33215
1955.0000 -137.03161 -127.58380 9.44781 2.82348 -128.79392 1077.65442
1960.0000 -136.77508 -127.68291 9.09217 2.90432 -127.58251 1134.05210
1965.0000 -135.41957 -127.65659 7.76298 2.90799 -127.52755 1123.71091
1970.0000 -136.31376 -127.40485 8.90891 2.95301 -126.85297 1119.44838
1975.0000 -135.96779 -127.45622 8.51156 2.93521 -127.11971 1171.40576
1980.0000 -136.69601 -126.65553 10.04049 2.90496 -127.57293 1116.42558
1985.0000 -135.67276 -127.74978 7.92297 2.97225 -126.56475 1207.85774
1990.0000 -135.50137 -126.11013 9.39124 2.90108 -127.63116 1121.25002
1995.0000 -135.69544 -126.11785 9.57759 2.97793 -126.47965 1178.69661
2000.0000 -137.01137 -127.15719 9.85418 2.94778 -126.93136 1146.25740
FREEZING PROCESS: loop number 9 T-loop= 1109.0000000000000
main_MD> interactions number 9 at Temperature= 1109.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -2.42169 -0.45356 -0.05211
force_rgl> df(natom) 2.97826 2.28560 4.65766
2005.0000 -136.75920 -127.50675 9.25245 2.93702 -127.09262 1180.80997
2010.0000 -135.43538 -128.83273 6.60265 2.90718 -127.53970 1044.48388
2015.0000 -136.17913 -127.76330 8.41583 2.94572 -126.96220 1159.60746
2020.0000 -136.36522 -128.63477 7.73045 2.84398 -128.48672 1095.88726
2025.0000 -137.37314 -128.41805 8.95509 2.77191 -129.56654 1015.73944
2030.0000 -136.80166 -127.84466 8.95701 2.79728 -129.18647 1061.15230
2035.0000 -136.59858 -129.47099 7.12760 2.86022 -128.24332 1118.31224
2040.0000 -136.71538 -127.53035 9.18503 2.86039 -128.24078 1105.10180
2045.0000 -136.51211 -127.05995 9.45216 2.93380 -127.14083 1160.41069
2050.0000 -135.22289 -127.32095 7.90194 2.93712 -127.09108 1150.70988
2055.0000 -137.44143 -129.73536 7.70607 2.83278 -128.65458 1106.39235
2060.0000 -137.31291 -130.22782 7.08509 2.80630 -129.05129 1102.63035
2065.0000 -138.41545 -131.44196 6.97349 2.71303 -130.44880 1004.26793
2070.0000 -137.34624 -128.64985 8.69638 2.75372 -129.83916 1026.05004
2075.0000 -136.52299 -128.15580 8.36719 2.92344 -127.29607 1126.24243
2080.0000 -135.51011 -126.63589 8.87422 2.89592 -127.70849 1109.99061
2085.0000 -136.09038 -125.98222 10.10816 3.02068 -125.83914 1204.77906
2090.0000 -137.21554 -127.83891 9.37663 2.95923 -126.75981 1168.38602
2095.0000 -136.98943 -129.19171 7.79771 2.86934 -128.10669 1106.05209
2100.0000 -137.72840 -129.01505 8.71335 2.79573 -129.20959 1048.25862
2105.0000 -136.61352 -128.68209 7.93143 2.83213 -128.66429 1059.50326
2110.0000 -139.09748 -130.14097 8.95651 2.74940 -129.90380 1016.78960
2115.0000 -137.62492 -128.31560 9.30932 2.89027 -127.79304 1126.55422
2120.0000 -136.82659 -129.67258 7.15401 2.75899 -129.76013 1037.31453
2125.0000 -137.61875 -129.71047 7.90828 2.70664 -130.54451 1010.07546
2130.0000 -137.56836 -129.13732 8.43104 2.76781 -129.62803 1046.96404
2135.0000 -136.19405 -126.54915 9.64490 2.89183 -127.76975 1127.38636
2140.0000 -137.88738 -131.78961 6.09777 2.81981 -128.84889 1039.77863
2145.0000 -138.07657 -130.44232 7.63425 2.69399 -130.73403 971.73321
2150.0000 -136.55953 -128.63894 7.92059 2.77971 -129.44965 1037.17954
2155.0000 -136.18245 -126.92995 9.25250 2.81728 -128.88680 1056.41936
2160.0000 -135.28589 -125.47468 9.81122 2.99008 -126.29762 1180.28188
2165.0000 -136.84409 -128.62007 8.22402 2.92952 -127.20503 1164.18204
2170.0000 -136.34941 -127.11475 9.23466 2.92038 -127.34191 1093.99745
2175.0000 -135.34548 -126.01828 9.32719 2.99287 -126.25574 1200.95719
2180.0000 -134.24081 -125.86929 8.37152 3.04712 -125.44291 1208.73168
2185.0000 -134.63613 -126.98149 7.65463 3.00251 -126.11131 1167.36206
2190.0000 -136.29397 -128.36676 7.92721 2.92933 -127.20786 1127.49543
2195.0000 -136.53234 -129.72792 6.80442 2.81469 -128.92551 1032.01532
2200.0000 -136.50260 -127.03353 9.46907 2.81743 -128.88453 1089.30355
2205.0000 -137.50884 -130.16137 7.34747 2.83885 -128.56364 1058.51597
2210.0000 -137.72356 -131.06667 6.65689 2.71762 -130.38005 998.37735
2215.0000 -135.68425 -128.17265 7.51160 2.73209 -130.16319 1006.49380
2220.0000 -138.13223 -130.90914 7.22309 2.76009 -129.74369 1031.49601
2225.0000 -136.07376 -127.99006 8.08370 2.80703 -129.04037 1082.89710
2230.0000 -137.55271 -129.90575 7.64696 2.74491 -129.97108 1035.98987
2235.0000 -137.85209 -128.86079 8.99130 2.80527 -129.06672 1071.20824
2240.0000 -137.06120 -128.72822 8.33298 2.80506 -129.06993 1059.13159
2245.0000 -136.43521 -128.67628 7.75892 2.78632 -129.35066 1031.81062
2250.0000 -136.87346 -128.43208 8.44138 2.85503 -128.32113 1083.64254
FREEZING PROCESS: loop number 10 T-loop= 1084.0000000000000
main_MD> interactions number 10 at Temperature= 1084.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 5.82918 -5.46431 -2.09327
force_rgl> df(natom) -1.69131 1.07428 1.80603
2255.0000 -135.95127 -127.09379 8.85748 2.93560 -127.11384 1147.79383
2260.0000 -133.02784 -125.61657 7.41127 3.02323 -125.80093 1194.18272
2265.0000 -137.90057 -129.16040 8.74017 2.85435 -128.33136 1111.70524
2270.0000 -137.39567 -128.41938 8.97629 2.85307 -128.35054 1092.15939
2275.0000 -137.44927 -128.83205 8.61722 2.81969 -128.85058 1073.49571
2280.0000 -136.20894 -127.49489 8.71405 2.95640 -126.80230 1175.78249
2285.0000 -132.17019 -124.88500 7.28520 2.98359 -126.39481 1160.44286
2290.0000 -136.14930 -128.03545 8.11385 2.91705 -127.39178 1110.38330
2295.0000 -135.92185 -127.73700 8.18485 2.81201 -128.96580 1067.51655
2300.0000 -136.61530 -129.01750 7.59780 2.89138 -127.77653 1149.78078
2305.0000 -136.23905 -128.11440 8.12465 2.86211 -128.21498 1105.74691
2310.0000 -133.98886 -126.22162 7.76725 2.93044 -127.19122 1137.25339
2315.0000 -134.73633 -126.02801 8.70832 2.92592 -127.25893 1097.90413
2320.0000 -135.52269 -128.30253 7.22016 2.95121 -126.87994 1150.85716
2325.0000 -137.15869 -127.96342 9.19527 2.86860 -128.11773 1082.35104
2330.0000 -137.57869 -128.42557 9.15313 2.84087 -128.53324 1088.23091
2335.0000 -136.41097 -129.47562 6.93535 2.80430 -129.08128 1057.98595
2340.0000 -136.95127 -128.81362 8.13765 2.72484 -130.27181 977.96719
2345.0000 -137.11015 -129.33393 7.77622 2.84058 -128.53760 1071.91352
2350.0000 -134.61533 -126.60861 8.00672 2.86657 -128.14828 1082.26146
2355.0000 -136.09764 -127.23332 8.86433 2.99805 -126.17814 1169.55555
2360.0000 -135.22676 -127.95211 7.27465 2.87128 -128.07762 1099.90197
2365.0000 -137.88878 -129.39747 8.49132 2.82076 -128.83467 1062.61540
2370.0000 -138.14941 -130.44834 7.70108 2.72106 -130.32849 1033.81881
2375.0000 -136.31121 -129.36794 6.94327 2.75124 -129.87625 1043.41696
2380.0000 -136.73678 -128.11648 8.62030 2.80786 -129.02790 1045.42604
2385.0000 -136.37997 -129.34678 7.03319 2.86952 -128.10395 1091.49723
2390.0000 -138.09789 -130.92645 7.17144 2.71462 -130.42494 982.96036
2395.0000 -137.21039 -128.50956 8.70083 2.75259 -129.85601 1006.92509
2400.0000 -136.41940 -127.84413 8.57528 2.88028 -127.94281 1122.34021
2405.0000 -135.89495 -127.54258 8.35236 2.88616 -127.85464 1125.60592
2410.0000 -138.59529 -129.34483 9.25046 2.86527 -128.16772 1086.82965
2415.0000 -136.55382 -127.43738 9.11644 2.84880 -128.41455 1120.01276
2420.0000 -136.39830 -127.13895 9.25935 2.94534 -126.96801 1136.18347
2425.0000 -136.50122 -128.65489 7.84633 2.90692 -127.54357 1134.24418
2430.0000 -135.17354 -127.04092 8.13262 2.85423 -128.33308 1086.42510
2435.0000 -137.20339 -130.34259 6.86080 2.81359 -128.94198 1077.44371
2440.0000 -137.82392 -130.74453 7.07939 2.68889 -130.81054 945.15612
2445.0000 -138.58463 -130.94254 7.64209 2.69682 -130.69173 972.45573
2450.0000 -135.94688 -128.38451 7.56237 2.78914 -129.30846 1047.65779
2455.0000 -134.75905 -128.20567 6.55338 2.81223 -128.96238 1031.90288
2460.0000 -137.27285 -128.61915 8.65370 2.83260 -128.65719 1026.16158
2465.0000 -135.59954 -127.95044 7.64910 2.85790 -128.27807 1107.79612
2470.0000 -134.78201 -126.64702 8.13499 2.88711 -127.84044 1117.16974
2475.0000 -135.65088 -126.65256 8.99832 3.01058 -125.99035 1222.04978
2480.0000 -137.10182 -129.80843 7.29339 2.87377 -128.04029 1114.87828
2485.0000 -137.21419 -129.00791 8.20627 2.72948 -130.20235 1013.66295
2490.0000 -136.13191 -128.24228 7.88963 2.85982 -128.24933 1115.65822
2495.0000 -133.89369 -124.99105 8.90264 2.92528 -127.26850 1139.30648
2500.0000 -136.82827 -129.44333 7.38494 2.95872 -126.76746 1151.43760
FREEZING PROCESS: loop number 11 T-loop= 1059.0000000000000
main_MD> interactions number 11 at Temperature= 1059.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 4.31472 -1.39933 1.73077
force_rgl> df(natom) 1.62506 2.52745 2.05394
2505.0000 -137.00694 -128.35038 8.65657 2.75363 -129.84046 1021.18340
2510.0000 -136.39920 -127.20490 9.19430 2.91512 -127.42071 1141.27339
2515.0000 -134.17775 -125.70873 8.46902 3.00579 -126.06216 1197.28074
2520.0000 -135.24286 -125.05167 10.19119 2.96871 -126.61781 1123.07565
2525.0000 -136.61584 -128.21394 8.40190 2.94711 -126.94137 1161.30816
2530.0000 -135.83143 -127.79026 8.04118 2.85102 -128.38116 1063.97039
2535.0000 -137.63487 -127.52235 10.11252 2.86490 -128.17320 1122.26604
2540.0000 -137.01942 -129.96776 7.05166 2.84950 -128.40395 1096.55457
2545.0000 -138.29036 -130.37512 7.91524 2.76586 -129.65718 1028.24331
2550.0000 -136.56308 -128.69615 7.86693 2.84105 -128.53063 1065.10920
2555.0000 -137.43846 -129.60714 7.83131 2.81645 -128.89923 1089.61508
2560.0000 -136.48431 -127.74551 8.73880 2.85944 -128.25512 1111.32075
2565.0000 -132.04197 -124.30456 7.73742 2.98549 -126.36635 1194.26413
2570.0000 -136.38030 -128.04326 8.33705 2.96195 -126.71914 1180.23419
2575.0000 -136.25848 -127.12158 9.13690 2.90083 -127.63480 1142.44939
2580.0000 -136.93027 -129.31077 7.61950 2.80487 -129.07276 1015.95954
2585.0000 -136.82734 -128.01576 8.81158 2.80773 -129.02990 1082.53255
2590.0000 -137.62304 -129.62397 7.99907 2.80010 -129.14423 1080.60105
2595.0000 -137.18001 -128.95996 8.22004 2.79350 -129.24313 1045.94304
2600.0000 -135.03219 -127.63474 7.39745 2.81228 -128.96167 1070.44375
2605.0000 -137.29431 -130.27431 7.02000 2.78213 -129.41339 1017.80964
2610.0000 -136.96612 -130.15554 6.81058 2.74474 -129.97369 1040.17854
2615.0000 -138.50232 -128.84917 9.65314 2.81989 -128.84772 1066.01445
2620.0000 -137.66644 -131.19213 6.47431 2.73519 -130.11672 996.62520
2625.0000 -137.04466 -129.92787 7.11679 2.72149 -130.32203 979.41151
2630.0000 -138.49175 -131.50350 6.98825 2.70189 -130.61572 975.02462
2635.0000 -136.79372 -129.01316 7.78056 2.80543 -129.06434 1055.31799
2640.0000 -135.66880 -128.24685 7.42195 2.80942 -129.00461 1105.37890
2645.0000 -137.28666 -130.48585 6.80082 2.76935 -129.60496 1020.16967
2650.0000 -138.44032 -130.36634 8.07397 2.78618 -129.35278 1060.37590
2655.0000 -137.29440 -130.45622 6.83818 2.70958 -130.50053 975.40774
2660.0000 -137.09939 -128.92559 8.17380 2.78047 -129.43830 1023.07155
2665.0000 -138.01724 -129.83510 8.18214 2.76993 -129.59627 1038.95928
2670.0000 -136.99973 -129.49850 7.50124 2.78296 -129.40099 1062.20178
2675.0000 -134.93243 -126.64844 8.28399 2.83925 -128.55760 1057.94062
2680.0000 -139.08244 -131.09540 7.98705 2.82594 -128.75706 1038.27293
2685.0000 -137.15857 -130.11586 7.04271 2.68614 -130.85178 965.87621
2690.0000 -136.63826 -129.59470 7.04356 2.75308 -129.84876 1011.89887
2695.0000 -136.99662 -128.18107 8.81554 2.78435 -129.38019 1066.73170
2700.0000 -136.65788 -128.30244 8.35544 2.83235 -128.66094 1099.11901
2705.0000 -139.48358 -129.57887 9.90471 2.83009 -128.69481 1086.21383
2710.0000 -137.49824 -130.61787 6.88037 2.69995 -130.64485 942.72722
2715.0000 -137.36076 -130.57810 6.78266 2.66978 -131.09681 944.63299
2720.0000 -136.26504 -128.33377 7.93126 2.72213 -130.31242 1009.34901
2725.0000 -134.04238 -126.84591 7.19647 2.92944 -127.20612 1130.19769
2730.0000 -137.53882 -129.40620 8.13262 2.90269 -127.60699 1101.87067
2735.0000 -136.60403 -129.84523 6.75880 2.79648 -129.19848 1046.47852
2740.0000 -136.52924 -126.80286 9.72638 2.86909 -128.11046 1112.39528
2745.0000 -138.60703 -128.69603 9.91100 2.89662 -127.69789 1134.68955
2750.0000 -137.76670 -129.04974 8.71696 2.78375 -129.38918 1079.35303
FREEZING PROCESS: loop number 12 T-loop= 1034.0000000000000
main_MD> interactions number 12 at Temperature= 1034.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.69831 -1.48347 4.42892
force_rgl> df(natom) 2.05552 -0.23526 2.56484
2755.0000 -137.14750 -129.70252 7.44498 2.82869 -128.71585 1101.82925
2760.0000 -136.89663 -129.34511 7.55152 2.69044 -130.78725 939.31105
2765.0000 -136.03165 -128.25204 7.77961 2.82412 -128.78427 1047.50798
2770.0000 -137.93828 -129.33302 8.60526 2.78114 -129.42820 1069.81985
2775.0000 -137.50688 -129.70328 7.80360 2.77372 -129.53946 1064.46073
2780.0000 -136.95974 -129.59429 7.36545 2.78745 -129.33366 1053.75232
2785.0000 -135.89611 -128.87976 7.01635 2.76810 -129.62369 1027.83463
2790.0000 -136.33601 -128.13777 8.19824 2.87069 -128.08643 1112.37912
2795.0000 -136.19864 -128.99361 7.20503 2.86219 -128.21391 1132.61279
2800.0000 -136.93796 -128.89949 8.03847 2.83475 -128.62500 1088.76525
2805.0000 -137.74212 -127.87496 9.86716 2.84406 -128.48548 1092.10124
2810.0000 -137.71073 -129.43257 8.27816 2.81617 -128.90333 1064.74763
2815.0000 -137.14405 -129.98235 7.16170 2.84537 -128.46585 1087.95126
2820.0000 -138.00055 -130.67267 7.32787 2.75335 -129.84469 994.42743
2825.0000 -138.48635 -130.86365 7.62270 2.69201 -130.76375 969.30154
2830.0000 -137.60012 -131.16223 6.43789 2.70240 -130.60807 980.63656
2835.0000 -136.65261 -128.83590 7.81671 2.71071 -130.48365 974.00484
2840.0000 -137.30019 -127.93851 9.36167 2.87467 -128.02680 1101.09933
2845.0000 -136.83146 -128.06558 8.76588 2.93823 -127.07448 1129.65629
2850.0000 -136.70090 -128.25854 8.44237 2.90898 -127.51269 1117.51520
2855.0000 -135.75889 -127.93577 7.82311 2.88410 -127.88559 1105.68983
2860.0000 -137.06862 -129.83128 7.23734 2.74762 -129.93047 1024.15493
2865.0000 -138.27775 -130.47391 7.80384 2.74241 -130.00860 1027.47651
2870.0000 -137.95110 -128.40104 9.55006 2.77689 -129.49191 1040.80175
2875.0000 -137.39173 -129.70377 7.68796 2.84167 -128.52127 1101.05035
2880.0000 -137.64991 -129.71679 7.93312 2.74688 -129.94165 1002.50241
2885.0000 -137.76737 -130.28283 7.48454 2.71289 -130.45085 986.16534
2890.0000 -137.45901 -130.27115 7.18786 2.71823 -130.37087 1001.60918
2895.0000 -136.04535 -128.46885 7.57650 2.77797 -129.47572 1028.38527
2900.0000 -138.08150 -129.36773 8.71377 2.80263 -129.10633 1057.36515
2905.0000 -138.29497 -129.54362 8.75135 2.80768 -129.03066 1019.66363
2910.0000 -137.45849 -129.78590 7.67259 2.80391 -129.08703 1035.50540
2915.0000 -138.80648 -130.69187 8.11462 2.72576 -130.25812 1001.19085
2920.0000 -137.87572 -130.76223 7.11349 2.69391 -130.73524 985.11915
2925.0000 -138.54894 -130.27703 8.27190 2.72909 -130.20821 1000.21508
2930.0000 -135.78864 -129.27964 6.50900 2.71725 -130.38558 966.25442
2935.0000 -137.29890 -128.92922 8.36968 2.80836 -129.02037 1070.48134
2940.0000 -138.06971 -130.14574 7.92397 2.74133 -130.02475 1033.56539
2945.0000 -136.88584 -129.09936 7.78648 2.74357 -129.99116 1019.54480
2950.0000 -137.38979 -130.50844 6.88135 2.79565 -129.21084 1074.05945
2955.0000 -136.35560 -129.30116 7.05443 2.73550 -130.11215 1004.30646
2960.0000 -136.54426 -128.87576 7.66850 2.78076 -129.43393 1043.46132
2965.0000 -138.20296 -129.68484 8.51813 2.83235 -128.66093 1087.50720
2970.0000 -137.86806 -130.60996 7.25810 2.67156 -131.07023 953.51982
2975.0000 -137.83964 -129.79339 8.04625 2.72592 -130.25569 1004.99006
2980.0000 -137.15876 -129.85219 7.30657 2.80666 -129.04591 1061.77615
2985.0000 -137.70608 -130.16989 7.53619 2.71502 -130.41898 993.98814
2990.0000 -137.23171 -129.21811 8.01360 2.78828 -129.32129 1071.71560
2995.0000 -136.68332 -128.27879 8.40454 2.84685 -128.44366 1094.09901
3000.0000 -137.67044 -128.79653 8.87391 2.80355 -129.09256 1062.95912
FREEZING PROCESS: loop number 13 T-loop= 1009.0000000000000
main_MD> interactions number 13 at Temperature= 1009.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.41707 1.24526 0.54803
force_rgl> df(natom) 0.36460 -0.50220 2.78282
3005.0000 -137.58731 -129.45409 8.13322 2.81020 -128.99278 1039.28900
3010.0000 -135.99101 -127.30288 8.68813 2.81220 -128.96284 1043.87879
3015.0000 -136.75159 -127.97597 8.77561 2.89458 -127.72845 1139.12988
3020.0000 -135.62656 -127.02066 8.60590 2.87715 -127.98970 1121.55684
3025.0000 -137.20316 -129.76649 7.43667 2.86288 -128.20356 1129.54394
3030.0000 -138.66318 -131.31099 7.35220 2.69428 -130.72969 969.99631
3035.0000 -137.93633 -130.46783 7.46849 2.70627 -130.55014 965.90505
3040.0000 -138.47109 -131.64817 6.82293 2.66226 -131.20948 970.02230
3045.0000 -138.26900 -131.18391 7.08509 2.63791 -131.57435 963.57935
3050.0000 -136.54997 -130.25947 6.29051 2.73479 -130.12276 970.00402
3055.0000 -136.74173 -129.23437 7.50736 2.73708 -130.08849 975.93143
3060.0000 -137.61387 -130.84173 6.77215 2.75897 -129.76045 1024.39516
3065.0000 -138.81860 -130.90429 7.91432 2.66450 -131.17599 910.93411
3070.0000 -137.06887 -130.94059 6.12828 2.65045 -131.38647 942.64501
3075.0000 -138.34267 -132.00009 6.34258 2.61546 -131.91075 904.81506
3080.0000 -136.25639 -128.90919 7.34720 2.71979 -130.34754 938.46213
3085.0000 -137.89900 -130.29985 7.59914 2.75863 -129.76560 988.67103
3090.0000 -138.35615 -130.83062 7.52553 2.75098 -129.88015 1033.07299
3095.0000 -137.85390 -129.40600 8.44789 2.75733 -129.78503 1004.88423
3100.0000 -136.58856 -129.73327 6.85528 2.73259 -130.15580 1023.89385
3105.0000 -137.76715 -131.47931 6.28784 2.70575 -130.55786 988.19621
3110.0000 -136.09077 -129.43124 6.65954 2.75953 -129.75202 1001.36006
3115.0000 -137.55713 -129.87476 7.68236 2.74484 -129.97218 981.33167
3120.0000 -137.26640 -129.28804 7.97836 2.78203 -129.41495 1061.14562
3125.0000 -137.41319 -129.05857 8.35462 2.81514 -128.91879 1046.98692
3130.0000 -136.59144 -129.52729 7.06415 2.84674 -128.44541 1077.80858
3135.0000 -137.50872 -129.99388 7.51484 2.78536 -129.36497 1019.39245
3140.0000 -139.50668 -132.73252 6.77416 2.64693 -131.43920 916.64958
3145.0000 -139.03264 -131.44919 7.58345 2.62613 -131.75088 936.52497
3150.0000 -137.93015 -130.61952 7.31064 2.63804 -131.57247 926.95406
3155.0000 -136.22199 -127.58227 8.63972 2.79080 -129.28347 1028.61398
3160.0000 -136.39146 -128.31051 8.08095 2.89537 -127.71667 1121.47477
3165.0000 -138.02105 -130.08769 7.93336 2.83027 -128.69219 1067.35569
3170.0000 -138.96767 -132.36693 6.60074 2.65912 -131.25657 933.78831
3175.0000 -138.74557 -132.11014 6.63543 2.59629 -132.19799 906.61821
3180.0000 -139.74112 -132.19969 7.54143 2.61949 -131.85045 945.33485
3185.0000 -137.59042 -131.23619 6.35422 2.65017 -131.39064 982.37696
3190.0000 -140.15968 -132.81597 7.34371 2.56182 -132.71445 909.00119
3195.0000 -137.59852 -131.37422 6.22431 2.63614 -131.60097 944.44077
3200.0000 -135.72273 -128.09151 7.63121 2.77939 -129.45453 1058.70537
3205.0000 -135.05377 -127.82928 7.22449 2.89468 -127.72695 1112.84385
3210.0000 -138.34919 -130.76585 7.58334 2.78990 -129.29705 1058.64239
3215.0000 -139.09265 -130.48822 8.60443 2.65974 -131.24727 988.90458
3220.0000 -139.05846 -131.50393 7.55452 2.63109 -131.67654 952.33410
3225.0000 -139.69321 -131.74182 7.95140 2.69318 -130.74627 981.01058
3230.0000 -137.70995 -129.31723 8.39272 2.65528 -131.31406 958.24185
3235.0000 -137.20357 -130.06359 7.13998 2.78546 -129.36349 1065.08101
3240.0000 -137.88459 -130.25885 7.62574 2.71839 -130.36853 959.93175
3245.0000 -138.86572 -130.99148 7.87424 2.71959 -130.35052 1029.32705
3250.0000 -136.12406 -129.29748 6.82658 2.77091 -129.58163 1044.59469
FREEZING PROCESS: loop number 14 T-loop= 984.00000000000000
main_MD> interactions number 14 at Temperature= 984.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 3.82649 -1.09508 -0.06300
force_rgl> df(natom) -1.63447 -1.11036 2.03940
3255.0000 -137.73350 -129.68292 8.05058 2.73017 -130.19206 1015.45215
3260.0000 -137.56348 -129.39025 8.17323 2.73803 -130.07429 979.38860
3265.0000 -139.58400 -131.44986 8.13414 2.69459 -130.72515 967.76928
3270.0000 -138.04883 -130.82604 7.22280 2.67896 -130.95928 967.65807
3275.0000 -138.37513 -130.03091 8.34422 2.68952 -130.80101 955.24484
3280.0000 -138.67804 -130.86592 7.81212 2.70786 -130.52634 983.83054
3285.0000 -137.97271 -130.48479 7.48792 2.75533 -129.81494 1023.16894
3290.0000 -137.70429 -129.23371 8.47058 2.74068 -130.03453 982.23432
3295.0000 -138.60415 -131.16373 7.44042 2.73167 -130.16955 968.73261
3300.0000 -138.14032 -132.15682 5.98350 2.63886 -131.56011 938.43870
3305.0000 -137.75685 -129.84910 7.90774 2.72183 -130.31701 1012.52851
3310.0000 -138.63068 -131.34070 7.28998 2.75516 -129.81757 1050.78727
3315.0000 -138.05168 -131.79728 6.25440 2.66091 -131.22981 961.61724
3320.0000 -136.96593 -129.31036 7.65557 2.70903 -130.50878 985.93272
3325.0000 -138.06542 -130.31100 7.75441 2.76853 -129.61723 1022.95883
3330.0000 -138.03740 -130.84215 7.19524 2.70854 -130.51614 984.05461
3335.0000 -137.84096 -130.96311 6.87785 2.67928 -130.95445 920.55386
3340.0000 -138.22751 -130.88449 7.34302 2.74603 -129.95429 1048.92950
3345.0000 -138.28159 -130.43616 7.84542 2.65654 -131.29531 951.78375
3350.0000 -138.88273 -131.72865 7.15408 2.67312 -131.04674 960.03205
3355.0000 -136.81258 -129.90320 6.90938 2.69411 -130.73225 1003.56654
3360.0000 -137.46347 -130.56680 6.89667 2.68752 -130.83099 958.45064
3365.0000 -139.17784 -131.20289 7.97495 2.70048 -130.63682 966.85373
3370.0000 -137.87546 -131.81666 6.05880 2.55283 -132.84916 894.85947
3375.0000 -137.97340 -128.16536 9.80804 2.72436 -130.27901 1011.34576
3380.0000 -138.08220 -129.77472 8.30748 2.77618 -129.50255 1026.57212
3385.0000 -138.83297 -131.33273 7.50023 2.70795 -130.52487 972.27309
3390.0000 -136.88153 -130.38668 6.49484 2.74487 -129.97167 1012.92854
3395.0000 -137.40679 -130.79457 6.61222 2.67439 -131.02783 933.03291
3400.0000 -135.39794 -128.85016 6.54778 2.74521 -129.96664 984.99509
3405.0000 -138.13494 -129.88291 8.25203 2.76977 -129.59857 1013.15919
3410.0000 -139.11464 -131.60305 7.51159 2.65127 -131.37416 966.61442
3415.0000 -137.89965 -130.86160 7.03805 2.68415 -130.88160 972.91514
3420.0000 -137.83881 -130.01064 7.82817 2.74177 -130.01820 985.35983
3425.0000 -138.36199 -129.99350 8.36849 2.74097 -130.03013 1036.76470
3430.0000 -139.06610 -132.15566 6.91044 2.69449 -130.72660 985.97408
3435.0000 -138.85339 -131.85104 7.00235 2.60978 -131.99592 929.33152
3440.0000 -138.43718 -132.36950 6.06769 2.66240 -131.20738 930.24691
3445.0000 -138.61563 -131.81568 6.79995 2.61502 -131.91732 891.81558
3450.0000 -136.78713 -129.99972 6.78741 2.69871 -130.66338 968.55222
3455.0000 -139.34125 -132.66010 6.68116 2.65348 -131.34104 946.34356
3460.0000 -139.71248 -132.15860 7.55388 2.58034 -132.43695 912.14799
3465.0000 -137.18994 -130.50475 6.68519 2.65835 -131.26815 959.87419
3470.0000 -138.28875 -130.08097 8.20778 2.70977 -130.49769 988.56705
3475.0000 -136.92421 -129.38003 7.54417 2.71283 -130.45178 986.27998
3480.0000 -138.15454 -132.18441 5.97012 2.65537 -131.31271 936.65525
3485.0000 -138.39025 -131.17565 7.21459 2.68311 -130.89705 992.79643
3490.0000 -138.02511 -131.60508 6.42003 2.67294 -131.04945 967.87377
3495.0000 -140.08299 -132.40195 7.68104 2.63981 -131.54598 954.21296
3500.0000 -139.59482 -131.78466 7.81016 2.59903 -132.15692 912.63832
FREEZING PROCESS: loop number 15 T-loop= 959.00000000000000
main_MD> interactions number 15 at Temperature= 959.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.51927 3.49767 -1.70399
force_rgl> df(natom) -2.24187 1.13808 0.26061
3505.0000 -139.00580 -132.33325 6.67256 2.60290 -132.09893 912.15737
3510.0000 -140.15267 -133.67437 6.47830 2.51159 -133.46718 853.47378
3515.0000 -138.53093 -131.94044 6.59050 2.49302 -133.74541 837.01200
3520.0000 -138.19484 -131.80538 6.38945 2.61749 -131.88036 923.04736
3525.0000 -138.11470 -132.42039 5.69430 2.68127 -130.92468 979.95255
3530.0000 -138.26853 -131.16676 7.10177 2.65535 -131.31310 950.87214
3535.0000 -137.66127 -130.63631 7.02496 2.63339 -131.64216 914.72273
3540.0000 -138.02262 -131.29607 6.72655 2.66305 -131.19766 944.29163
3545.0000 -136.45458 -130.04949 6.40509 2.69507 -130.71793 976.77948
3550.0000 -140.79555 -132.93025 7.86530 2.67123 -131.07518 979.55210
3555.0000 -138.44889 -132.10299 6.34590 2.59603 -132.20183 938.69448
3560.0000 -138.89193 -131.95092 6.94101 2.64441 -131.47693 936.89249
3565.0000 -137.39830 -130.53477 6.86353 2.67054 -131.08547 935.84716
3570.0000 -136.51088 -129.15383 7.35706 2.74539 -129.96396 1005.06119
3575.0000 -137.63505 -129.88684 7.74822 2.74529 -129.96547 969.91645
3580.0000 -138.62909 -131.61601 7.01308 2.72529 -130.26516 942.95767
3585.0000 -137.15491 -129.98845 7.16646 2.70659 -130.54535 961.87797
3590.0000 -139.33769 -131.94455 7.39314 2.68244 -130.90709 985.18041
3595.0000 -138.61671 -130.16522 8.45149 2.69090 -130.78033 996.19309
3600.0000 -138.54830 -129.62272 8.92558 2.73416 -130.13227 1010.71328
3605.0000 -139.18377 -133.03759 6.14618 2.65457 -131.32472 969.54969
3610.0000 -137.88340 -130.41319 7.47021 2.62987 -131.69484 897.81618
3615.0000 -138.53685 -131.09484 7.44202 2.67920 -130.95570 945.39664
3620.0000 -137.82971 -130.59380 7.23592 2.70084 -130.63151 981.24950
3625.0000 -137.95739 -130.58809 7.36930 2.70112 -130.62730 961.08188
3630.0000 -138.48943 -130.92499 7.56444 2.68838 -130.81821 973.15109
3635.0000 -139.22385 -132.06973 7.15412 2.62654 -131.74474 921.67181
3640.0000 -138.45104 -132.03981 6.41123 2.59999 -132.14258 910.40896
3645.0000 -138.57910 -131.85672 6.72238 2.63126 -131.67406 939.13418
3650.0000 -137.77945 -128.80358 8.97587 2.73680 -130.09264 1016.31795
3655.0000 -137.67270 -129.81011 7.86259 2.77448 -129.52814 1055.14764
3660.0000 -138.09257 -129.76269 8.32988 2.71636 -130.39890 999.43278
3665.0000 -137.72234 -131.53194 6.19039 2.68269 -130.90343 976.26955
3670.0000 -138.51439 -132.32172 6.19267 2.66471 -131.17287 946.75452
3675.0000 -137.50191 -131.95241 5.54949 2.60696 -132.03807 916.89789
3680.0000 -138.27847 -132.96572 5.31275 2.59019 -132.28941 897.97089
3685.0000 -138.55838 -132.06030 6.49809 2.56642 -132.64550 911.60766
3690.0000 -139.53465 -130.86583 8.66882 2.58810 -132.32074 945.38430
3695.0000 -139.82746 -133.03227 6.79519 2.61119 -131.97476 932.13899
3700.0000 -137.34863 -130.08159 7.26704 2.60364 -132.08781 899.01576
3705.0000 -138.94974 -131.53146 7.41829 2.65808 -131.27219 928.31425
3710.0000 -137.42535 -130.44016 6.98519 2.61090 -131.97905 949.57274
3715.0000 -137.47447 -130.16108 7.31339 2.66507 -131.16742 974.92574
3720.0000 -137.37131 -129.83357 7.53774 2.75908 -129.75877 1032.28311
3725.0000 -139.19976 -131.04208 8.15768 2.71505 -130.41852 999.59914
3730.0000 -139.28861 -133.02109 6.26752 2.65918 -131.25574 921.05886
3735.0000 -139.38220 -132.52465 6.85755 2.65245 -131.35655 911.33172
3740.0000 -136.68724 -130.18197 6.50527 2.69247 -130.75683 978.67300
3745.0000 -136.24937 -129.31143 6.93794 2.74834 -129.91970 994.94997
3750.0000 -137.36731 -130.22504 7.14227 2.75596 -129.80558 1019.30916
FREEZING PROCESS: loop number 16 T-loop= 934.00000000000000
main_MD> interactions number 16 at Temperature= 934.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.98385 0.81912 0.74059
force_rgl> df(natom) -1.28097 1.13515 -0.64724
3755.0000 -138.82830 -132.39828 6.43003 2.64961 -131.39911 904.55871
3760.0000 -138.91097 -132.56789 6.34307 2.57904 -132.45653 910.37561
3765.0000 -138.09741 -131.31377 6.78364 2.64375 -131.48694 947.55223
3770.0000 -136.47831 -130.63230 5.84601 2.70420 -130.58110 996.22688
3775.0000 -136.93447 -129.60020 7.33427 2.70804 -130.52359 992.18304
3780.0000 -136.87020 -129.58040 7.28980 2.74917 -129.90731 1041.04917
3785.0000 -137.88907 -130.43817 7.45090 2.73288 -130.15140 1024.06129
3790.0000 -138.35290 -131.28265 7.07025 2.65429 -131.32896 933.42301
3795.0000 -139.29066 -133.02777 6.26289 2.63104 -131.67737 936.88351
3800.0000 -136.90020 -130.19986 6.70034 2.74158 -130.02099 982.70283
3805.0000 -137.75068 -130.61794 7.13275 2.71300 -130.44926 942.54113
3810.0000 -138.89867 -132.15402 6.74465 2.69389 -130.73561 946.06146
3815.0000 -138.84386 -132.26961 6.57425 2.58963 -132.29786 916.41840
3820.0000 -138.91889 -131.44782 7.47107 2.51841 -133.36492 855.10837
3825.0000 -139.19643 -132.70872 6.48772 2.64356 -131.48976 963.01578
3830.0000 -138.15400 -132.07675 6.07725 2.56735 -132.63159 909.52782
3835.0000 -139.75219 -131.17286 8.57933 2.61463 -131.92323 918.00789
3840.0000 -137.91714 -131.09043 6.82672 2.70670 -130.54362 1005.24981
3845.0000 -138.81790 -131.47767 7.34023 2.66920 -131.10555 973.20819
3850.0000 -138.91499 -132.78948 6.12552 2.61919 -131.85483 919.83485
3855.0000 -140.05394 -133.60792 6.44602 2.55913 -132.75475 857.84813
3860.0000 -139.17684 -132.31176 6.86508 2.53149 -133.16889 826.55416
3865.0000 -136.80310 -131.03871 5.76439 2.60379 -132.08557 933.25779
3870.0000 -138.11569 -130.80744 7.30826 2.73829 -130.07035 1041.41621
3875.0000 -136.47506 -128.89355 7.58150 2.74652 -129.94696 1006.59673
3880.0000 -136.66794 -129.24356 7.42438 2.80313 -129.09877 1072.79708
3885.0000 -138.11314 -130.88317 7.22997 2.70284 -130.60147 997.14045
3890.0000 -139.41219 -132.15141 7.26078 2.66418 -131.18082 971.27581
3895.0000 -138.40985 -132.30779 6.10206 2.53273 -133.15044 848.01493
3900.0000 -139.41446 -132.48444 6.93002 2.56306 -132.69586 874.55637
3905.0000 -137.43280 -132.16911 5.26369 2.57086 -132.57906 881.99642
3910.0000 -136.88895 -128.96942 7.91953 2.73775 -130.07836 985.67063
3915.0000 -139.06174 -131.54966 7.51208 2.74035 -130.03940 1014.77724
3920.0000 -140.84031 -134.49622 6.34409 2.50845 -133.51411 856.31813
3925.0000 -139.82447 -132.92766 6.89681 2.45355 -134.33684 815.82481
3930.0000 -140.59665 -133.46021 7.13644 2.50799 -133.52112 831.65277
3935.0000 -140.54044 -133.46489 7.07555 2.52419 -133.27838 853.17047
3940.0000 -138.68273 -132.37352 6.30921 2.54735 -132.93135 884.18835
3945.0000 -139.52599 -132.24616 7.27983 2.57103 -132.57647 888.43142
3950.0000 -137.28016 -130.61850 6.66166 2.64520 -131.46508 972.17666
3955.0000 -136.48579 -128.71309 7.77270 2.74569 -129.95945 1030.83821
3960.0000 -138.64339 -129.85006 8.79333 2.78419 -129.38254 1062.92821
3965.0000 -138.06990 -131.38384 6.68607 2.61818 -131.86997 929.76178
3970.0000 -138.16906 -131.60866 6.56040 2.62585 -131.75509 912.26035
3975.0000 -139.18382 -132.20505 6.97877 2.64330 -131.49370 944.14902
3980.0000 -137.94421 -131.15265 6.79157 2.64130 -131.52358 917.88088
3985.0000 -139.20040 -130.95255 8.24785 2.67621 -131.00058 965.77671
3990.0000 -137.39888 -130.35590 7.04298 2.72316 -130.29708 1007.52668
3995.0000 -138.09224 -131.73593 6.35631 2.70170 -130.61855 956.59928
4000.0000 -139.86051 -133.74925 6.11127 2.50825 -133.51717 855.89890
FREEZING PROCESS: loop number 17 T-loop= 909.00000000000000
main_MD> interactions number 17 at Temperature= 909.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.50982 0.58900 -0.00405
force_rgl> df(natom) 2.49771 1.70057 -0.35955
4005.0000 -139.76973 -131.99165 7.77808 2.59812 -132.17065 932.84171
4010.0000 -139.77467 -132.72857 7.04610 2.58162 -132.41777 873.63917
4015.0000 -140.23850 -134.49138 5.74711 2.55326 -132.84272 871.45348
4020.0000 -139.41261 -133.29113 6.12147 2.51225 -133.45730 830.39167
4025.0000 -139.66275 -133.56342 6.09933 2.50410 -133.57931 843.30293
4030.0000 -139.51870 -133.43905 6.07964 2.52846 -133.21433 841.20343
4035.0000 -138.39086 -131.06284 7.32802 2.59108 -132.27612 898.13883
4040.0000 -139.20039 -131.74210 7.45829 2.64124 -131.52445 940.84359
4045.0000 -138.16844 -132.52133 5.64711 2.58311 -132.39542 898.68777
4050.0000 -139.52262 -132.29548 7.22714 2.56541 -132.66078 883.88538
4055.0000 -139.53909 -132.93490 6.60419 2.54625 -132.94773 870.39614
4060.0000 -140.03945 -133.66453 6.37492 2.54906 -132.90563 885.74809
4065.0000 -138.76917 -132.77678 5.99240 2.55487 -132.81860 911.79341
4070.0000 -139.02753 -133.15185 5.87568 2.53922 -133.05313 868.99189
4075.0000 -139.61683 -132.81440 6.80244 2.52018 -133.33845 887.60064
4080.0000 -139.34326 -133.10561 6.23765 2.58968 -132.29702 886.67476
4085.0000 -138.13938 -131.25490 6.88448 2.66135 -131.22317 935.95551
4090.0000 -139.16206 -132.63976 6.52230 2.60085 -132.12966 902.43396
4095.0000 -137.61861 -130.28609 7.33253 2.62354 -131.78969 929.71946
4100.0000 -138.60197 -131.88742 6.71455 2.65412 -131.33149 957.15437
4105.0000 -137.42390 -131.91971 5.50420 2.60271 -132.10188 886.51268
4110.0000 -138.87938 -132.22357 6.65581 2.64262 -131.50380 900.67048
4115.0000 -139.46295 -132.71239 6.75056 2.53926 -133.05247 862.73060
4120.0000 -139.45278 -133.82042 5.63236 2.52599 -133.25141 836.93258
4125.0000 -139.32350 -132.05360 7.26990 2.58229 -132.40776 858.04247
4130.0000 -138.51180 -132.81484 5.69696 2.59814 -132.17023 918.38023
4135.0000 -138.73664 -132.04656 6.69008 2.58929 -132.30284 896.55002
4140.0000 -139.56342 -132.97394 6.58947 2.55190 -132.86320 895.01081
4145.0000 -139.75156 -133.02939 6.72217 2.59362 -132.23807 925.29177
4150.0000 -139.40461 -133.58127 5.82334 2.51681 -133.38889 855.31510
4155.0000 -138.78951 -134.08241 4.70710 2.48980 -133.79362 852.04126
4160.0000 -140.35170 -134.15385 6.19785 2.49822 -133.66742 825.44250
4165.0000 -138.97886 -133.00735 5.97151 2.52000 -133.34106 847.60008
4170.0000 -138.41458 -131.66718 6.74740 2.58003 -132.44159 880.05997
4175.0000 -138.57039 -131.73491 6.83548 2.60794 -132.02344 916.59321
4180.0000 -138.67595 -131.60093 7.07502 2.58785 -132.32447 923.44585
4185.0000 -139.46316 -131.86440 7.59876 2.63356 -131.63963 935.78044
4190.0000 -138.51549 -132.00790 6.50759 2.59664 -132.19283 909.82736
4195.0000 -139.12800 -131.90552 7.22248 2.63829 -131.56876 939.28295
4200.0000 -138.79108 -132.54951 6.24157 2.56122 -132.72351 875.56468
4205.0000 -139.84934 -133.18859 6.66075 2.52722 -133.23297 851.38468
4210.0000 -140.07665 -133.56596 6.51069 2.53542 -133.11009 874.25614
4215.0000 -138.92293 -132.54569 6.37724 2.54674 -132.94051 861.07135
4220.0000 -139.79402 -131.38333 8.41069 2.65411 -131.33172 962.81113
4225.0000 -140.56955 -134.03612 6.53342 2.56153 -132.71889 923.14062
4230.0000 -139.96585 -134.33273 5.63312 2.40453 -135.07132 799.28925
4235.0000 -140.23836 -133.12657 7.11178 2.49063 -133.78113 843.41616
4240.0000 -139.60953 -132.75287 6.85666 2.54919 -132.90373 868.40580
4245.0000 -140.15122 -132.13266 8.01856 2.57203 -132.56153 905.42258
4250.0000 -137.58278 -129.89718 7.68560 2.66734 -131.13348 928.15138
FREEZING PROCESS: loop number 18 T-loop= 884.00000000000000
main_MD> interactions number 18 at Temperature= 884.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.07791 -0.27281 1.67446
force_rgl> df(natom) 1.09597 5.28655 -0.91058
4255.0000 -138.32636 -129.64534 8.68103 2.72630 -130.25003 1011.14788
4260.0000 -138.81183 -131.47426 7.33757 2.70578 -130.55739 960.17381
4265.0000 -140.27782 -133.75444 6.52338 2.57125 -132.57319 874.29783
4270.0000 -139.21283 -132.03682 7.17601 2.52137 -133.32057 845.37291
4275.0000 -140.46011 -131.16031 9.29980 2.62191 -131.81413 934.73187
4280.0000 -139.74469 -133.79623 5.94845 2.55514 -132.81452 921.24037
4285.0000 -140.93582 -133.51164 7.42418 2.48049 -133.93308 836.67582
4290.0000 -141.75140 -134.79073 6.96067 2.45384 -134.33246 821.89543
4295.0000 -140.55869 -133.74865 6.81005 2.45178 -134.36332 822.55505
4300.0000 -138.17390 -132.21115 5.96275 2.49386 -133.73280 840.98095
4305.0000 -137.84669 -131.91951 5.92718 2.63643 -131.59662 928.91816
4310.0000 -137.40592 -130.36281 7.04311 2.59251 -132.25464 901.82323
4315.0000 -139.25920 -132.11838 7.14083 2.63576 -131.60654 943.87402
4320.0000 -139.59327 -132.58821 7.00506 2.56875 -132.61070 917.25261
4325.0000 -139.48285 -132.58640 6.89644 2.53319 -133.14350 840.45673
4330.0000 -140.06500 -133.65485 6.41015 2.57800 -132.47204 910.56464
4335.0000 -139.69392 -133.32869 6.36523 2.50595 -133.55161 831.58257
4340.0000 -136.78496 -129.89473 6.89023 2.63945 -131.55128 915.55323
4345.0000 -136.72586 -130.56854 6.15732 2.72831 -130.21982 989.58624
4350.0000 -137.91439 -131.71918 6.19522 2.66698 -131.13886 947.71767
4355.0000 -139.65665 -132.39495 7.26170 2.60053 -132.13447 892.96893
4360.0000 -138.14573 -131.52551 6.62022 2.57479 -132.52014 866.42475
4365.0000 -138.26787 -131.56113 6.70674 2.63676 -131.59162 948.77255
4370.0000 -138.36388 -131.84647 6.51741 2.65561 -131.30924 928.57815
4375.0000 -139.11143 -131.90473 7.20670 2.67582 -131.00630 964.47675
4380.0000 -138.74292 -131.67658 7.06634 2.64130 -131.52359 928.76769
4385.0000 -140.57371 -133.04586 7.52785 2.57746 -132.48014 906.42870
4390.0000 -139.00945 -132.20905 6.80039 2.58561 -132.35808 923.00550
4395.0000 -138.81884 -131.00761 7.81123 2.58949 -132.29989 892.64157
4400.0000 -140.07428 -132.91768 7.15661 2.62976 -131.69647 945.35363
4405.0000 -140.40844 -134.45877 5.94967 2.52229 -133.30683 849.99255
4410.0000 -138.79581 -132.75745 6.03836 2.48098 -133.92582 810.97580
4415.0000 -139.57345 -132.76230 6.81116 2.51850 -133.36357 852.72254
4420.0000 -139.46031 -132.30755 7.15276 2.54106 -133.02555 868.77186
4425.0000 -139.55933 -133.31172 6.24761 2.55410 -132.83019 862.28634
4430.0000 -138.57826 -132.04544 6.53282 2.55509 -132.81540 870.01052
4435.0000 -138.86063 -133.11678 5.74386 2.59084 -132.27972 897.12267
4440.0000 -140.53719 -133.25530 7.28189 2.52668 -133.24097 827.25236
4445.0000 -138.18472 -132.79011 5.39461 2.57915 -132.45476 890.01405
4450.0000 -138.67431 -132.06735 6.60695 2.59094 -132.27818 871.26192
4455.0000 -138.14330 -130.58896 7.55434 2.62572 -131.75701 903.02520
4460.0000 -137.45452 -131.10848 6.34604 2.69897 -130.65948 974.46780
4465.0000 -139.69953 -131.08903 8.61051 2.67702 -130.98839 969.75837
4470.0000 -139.16363 -132.72048 6.44316 2.66963 -131.09907 952.80980
4475.0000 -138.03136 -132.82530 5.20606 2.57106 -132.57603 889.81114
4480.0000 -140.12297 -132.72889 7.39407 2.56697 -132.63726 907.75034
4485.0000 -140.10420 -134.71363 5.39057 2.50174 -133.61466 832.28075
4490.0000 -139.84918 -133.22055 6.62863 2.48108 -133.92433 840.44918
4495.0000 -139.17003 -132.44430 6.72573 2.59198 -132.26265 929.38605
4500.0000 -137.98129 -131.85067 6.13063 2.57573 -132.50600 877.22927
FREEZING PROCESS: loop number 19 T-loop= 859.00000000000000
main_MD> interactions number 19 at Temperature= 859.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -7.25928 -1.91091 10.78850
force_rgl> df(natom) 4.40110 1.56914 -1.25485
4505.0000 -139.96638 -133.49837 6.46801 2.54794 -132.92244 884.47326
4510.0000 -139.28033 -132.27050 7.00982 2.52333 -133.29121 840.82147
4515.0000 -139.44860 -133.64719 5.80141 2.53665 -133.09169 886.10042
4520.0000 -139.23228 -133.06799 6.16429 2.50355 -133.58766 824.54411
4525.0000 -138.18662 -131.86960 6.31702 2.52844 -133.21467 869.56188
4530.0000 -138.47927 -131.93584 6.54344 2.63235 -131.65774 911.46863
4535.0000 -139.96241 -133.56696 6.39545 2.55553 -132.80874 866.86882
4540.0000 -140.05209 -133.36645 6.68563 2.53092 -133.17751 867.74067
4545.0000 -139.42085 -132.76811 6.65274 2.57380 -132.53504 898.79012
4550.0000 -139.40245 -133.62893 5.77352 2.48515 -133.86336 839.14437
4555.0000 -138.50882 -131.52530 6.98352 2.55646 -132.79478 878.49730
4560.0000 -138.53586 -132.58017 5.95568 2.58424 -132.37858 895.27967
4565.0000 -139.63427 -133.90173 5.73254 2.50201 -133.61068 823.26429
4570.0000 -140.09879 -133.85060 6.24819 2.54506 -132.96565 885.67178
4575.0000 -140.90666 -134.85499 6.05166 2.44437 -134.47440 786.15987
4580.0000 -140.05386 -133.84348 6.21038 2.48545 -133.85874 814.04655
4585.0000 -141.09888 -133.82642 7.27245 2.46653 -134.14229 814.21254
4590.0000 -140.25142 -133.36215 6.88927 2.49093 -133.77665 813.84486
4595.0000 -139.02348 -132.26527 6.75822 2.49830 -133.66632 816.23462
4600.0000 -138.35324 -132.13809 6.21515 2.58920 -132.30429 901.18867
4605.0000 -140.25919 -134.19230 6.06689 2.56612 -132.65014 910.86058
4610.0000 -138.97769 -133.73497 5.24272 2.45569 -134.30474 784.80682
4615.0000 -140.12807 -132.47528 7.65279 2.53666 -133.09146 849.15737
4620.0000 -140.16137 -132.44260 7.71877 2.52103 -133.32565 870.24009
4625.0000 -140.32203 -134.17877 6.14325 2.55416 -132.82932 861.69708
4630.0000 -137.64966 -132.02953 5.62013 2.52063 -133.33169 848.50847
4635.0000 -138.13824 -131.16844 6.96980 2.65965 -131.24868 950.93200
4640.0000 -139.23567 -132.85833 6.37734 2.58443 -132.37571 921.10038
4645.0000 -138.41202 -132.14485 6.26717 2.56303 -132.69642 906.29781
4650.0000 -139.57271 -132.12969 7.44302 2.60759 -132.02875 900.65825
4655.0000 -139.25711 -131.28966 7.96745 2.62782 -131.72564 915.82795
4660.0000 -138.14065 -130.47819 7.66246 2.63785 -131.57523 936.96352
4665.0000 -138.38305 -131.44411 6.93893 2.67796 -130.97435 966.99531
4670.0000 -139.45474 -133.04662 6.40812 2.64174 -131.51705 898.79518
4675.0000 -139.23626 -132.72222 6.51403 2.48362 -133.88622 848.61871
4680.0000 -138.18570 -131.46848 6.71723 2.61402 -131.93233 909.25615
4685.0000 -138.70681 -132.33040 6.37641 2.62538 -131.76213 928.49086
4690.0000 -138.21006 -132.44370 5.76636 2.57214 -132.55989 901.98474
4695.0000 -138.37324 -131.83884 6.53440 2.60108 -132.12618 929.72242
4700.0000 -139.27895 -132.06761 7.21134 2.60004 -132.14179 931.09016
4705.0000 -139.07578 -131.47191 7.60387 2.66768 -131.12838 986.26504
4710.0000 -140.18720 -134.26638 5.92083 2.58769 -132.32691 923.23742
4715.0000 -140.31703 -134.42298 5.89405 2.44411 -134.47818 793.97792
4720.0000 -137.80746 -132.63118 5.17628 2.52888 -133.20803 836.42964
4725.0000 -138.83865 -131.90773 6.93092 2.59120 -132.27420 915.98213
4730.0000 -139.94991 -132.99972 6.95019 2.59845 -132.16571 929.68362
4735.0000 -138.76260 -132.14451 6.61808 2.56706 -132.63591 886.51807
4740.0000 -140.28918 -133.11239 7.17678 2.57132 -132.57212 875.58337
4745.0000 -139.31760 -132.68286 6.63475 2.58569 -132.35689 887.86199
4750.0000 -140.58659 -134.39237 6.19422 2.49825 -133.66695 826.29683
FREEZING PROCESS: loop number 20 T-loop= 834.00000000000000
main_MD> interactions number 20 at Temperature= 834.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.67855 -0.75958 4.49214
force_rgl> df(natom) 1.51258 0.48876 -0.30924
4755.0000 -138.80259 -132.58155 6.22104 2.52011 -133.33951 860.07536
4760.0000 -139.43014 -133.59020 5.83993 2.55257 -132.85305 887.39018
4765.0000 -140.28347 -134.00678 6.27669 2.45710 -134.28355 814.17347
4770.0000 -141.81721 -134.87123 6.94598 2.46140 -134.21909 840.97096
4775.0000 -140.05231 -134.51162 5.54070 2.43842 -134.56354 813.06590
4780.0000 -139.47275 -133.10653 6.36622 2.47827 -133.96636 837.72433
4785.0000 -139.14411 -132.87049 6.27363 2.52366 -133.28626 856.54161
4790.0000 -140.31586 -134.04492 6.27094 2.46304 -134.19459 811.48479
4795.0000 -140.10165 -133.85445 6.24721 2.48102 -133.92519 839.39377
4800.0000 -138.66893 -131.99095 6.67798 2.49550 -133.70819 851.18847
4805.0000 -138.65374 -131.41068 7.24306 2.68361 -130.88961 941.02046
4810.0000 -138.35186 -132.45370 5.89815 2.58862 -132.31292 894.82498
4815.0000 -140.85583 -134.92983 5.92600 2.48938 -133.79984 829.10169
4820.0000 -141.07158 -135.24811 5.82346 2.40377 -135.08271 776.24737
4825.0000 -141.54056 -135.41158 6.12898 2.40330 -135.08968 779.12772
4830.0000 -139.12523 -133.01434 6.11088 2.43405 -134.62898 794.07236
4835.0000 -139.25098 -132.21843 7.03255 2.61992 -131.84395 912.02694
4840.0000 -138.92643 -132.55078 6.37565 2.58285 -132.39933 897.59770
4845.0000 -138.14538 -131.91113 6.23425 2.58166 -132.41726 874.73511
4850.0000 -140.09959 -134.04965 6.04994 2.53462 -133.12200 841.68092
4855.0000 -140.12128 -133.16816 6.95312 2.47039 -134.08445 843.96469
4860.0000 -139.75616 -133.27485 6.48131 2.54452 -132.97378 855.35688
4865.0000 -138.31088 -132.12407 6.18681 2.62009 -131.84146 957.18579
4870.0000 -138.27690 -132.02915 6.24776 2.61771 -131.87711 862.63400
4875.0000 -139.85010 -133.12305 6.72705 2.56481 -132.66966 871.77730
4880.0000 -139.97283 -133.67113 6.30170 2.53587 -133.10325 883.68280
4885.0000 -140.86385 -135.35044 5.51341 2.45320 -134.34201 821.81180
4890.0000 -140.10417 -133.84180 6.26237 2.43930 -134.55036 818.88752
4895.0000 -141.01073 -134.88696 6.12377 2.43292 -134.64592 807.03469
4900.0000 -140.01940 -133.69546 6.32394 2.49082 -133.77834 852.62136
4905.0000 -139.52041 -133.55969 5.96072 2.51785 -133.37328 877.37985
4910.0000 -141.88558 -134.98593 6.89965 2.50244 -133.60418 859.43951
4915.0000 -140.35610 -134.12929 6.22680 2.46286 -134.19725 824.51398
4920.0000 -140.44473 -134.75833 5.68640 2.47627 -133.99628 832.17713
4925.0000 -138.16676 -132.07531 6.09145 2.53198 -133.16161 871.32424
4930.0000 -139.44898 -133.97860 5.47039 2.53349 -133.13895 844.43921
4935.0000 -139.34515 -131.91069 7.43446 2.55710 -132.78522 857.54733
4940.0000 -139.47665 -132.22021 7.25644 2.61777 -131.87619 891.98837
4945.0000 -140.06352 -133.93148 6.13205 2.53717 -133.08387 876.96956
4950.0000 -140.59862 -134.33766 6.26096 2.51036 -133.48561 844.68992
4955.0000 -140.32208 -135.04070 5.28137 2.42689 -134.73626 789.19636
4960.0000 -141.14491 -133.73878 7.40614 2.40489 -135.06588 783.88894
4965.0000 -139.54232 -132.92344 6.61888 2.49037 -133.78507 829.39532
4970.0000 -138.08901 -132.71745 5.37156 2.56271 -132.70111 851.05140
4975.0000 -140.01119 -134.22199 5.78920 2.49809 -133.66945 862.54296
4980.0000 -140.20354 -133.51862 6.68492 2.54221 -133.00833 882.12135
4985.0000 -141.01214 -133.73531 7.27683 2.52546 -133.25937 846.64092
4990.0000 -139.57838 -133.75072 5.82766 2.47131 -134.07071 838.28099
4995.0000 -139.46943 -132.58971 6.87972 2.48775 -133.82428 823.41098
5000.0000 -139.90453 -133.45517 6.44936 2.53969 -133.04611 883.22807
FREEZING PROCESS: loop number 21 T-loop= 809.00000000000000
main_MD> interactions number 21 at Temperature= 809.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.53654 -0.58178 3.12891
force_rgl> df(natom) -2.23720 2.64166 -1.09441
5005.0000 -139.39565 -133.04665 6.34900 2.46390 -134.18168 825.92146
5010.0000 -140.33868 -133.63793 6.70075 2.53048 -133.18409 855.34190
5015.0000 -139.92571 -133.81996 6.10575 2.47916 -133.95302 831.79517
5020.0000 -140.54108 -133.52951 7.01157 2.51123 -133.47257 858.60444
5025.0000 -140.91368 -134.43483 6.47885 2.46793 -134.12124 824.32712
5030.0000 -141.09179 -135.31783 5.77397 2.43055 -134.68145 809.60984
5035.0000 -139.50085 -133.71228 5.78857 2.43547 -134.60763 815.20211
5040.0000 -140.54026 -135.46143 5.07882 2.45049 -134.38258 804.37081
5045.0000 -140.90330 -135.98824 4.91507 2.36425 -135.67478 741.71252
5050.0000 -138.74037 -132.48997 6.25040 2.51168 -133.46585 858.72997
5055.0000 -138.23458 -131.73332 6.50126 2.57599 -132.50213 899.00090
5060.0000 -139.93231 -133.46198 6.47034 2.54817 -132.91895 861.57589
5065.0000 -139.21193 -132.53638 6.67556 2.49239 -133.75481 829.55636
5070.0000 -139.79379 -133.99367 5.80012 2.53783 -133.07391 849.47572
5075.0000 -139.71635 -133.04662 6.66973 2.50392 -133.58207 852.23990
5080.0000 -140.69022 -134.44679 6.24343 2.48944 -133.79898 841.50716
5085.0000 -138.85766 -133.27562 5.58204 2.44963 -134.39548 806.79954
5090.0000 -138.69664 -132.56223 6.13441 2.53096 -133.17685 870.35243
5095.0000 -140.08213 -132.97429 7.10784 2.55704 -132.78615 872.97025
5100.0000 -141.12505 -135.19667 5.92838 2.51438 -133.42534 837.29570
5105.0000 -140.33185 -134.83310 5.49875 2.42158 -134.81573 762.36825
5110.0000 -140.75491 -134.60214 6.15277 2.44033 -134.53485 785.53874
5115.0000 -141.54300 -134.65211 6.89089 2.44852 -134.41210 790.94547
5120.0000 -140.05322 -134.38957 5.66364 2.43065 -134.67988 806.58090
5125.0000 -139.39910 -133.75904 5.64006 2.46857 -134.11177 816.46538
5130.0000 -141.04344 -134.44258 6.60086 2.51189 -133.46258 859.99967
5135.0000 -139.53126 -133.68216 5.84910 2.46843 -134.11379 804.74971
5140.0000 -141.20646 -134.80641 6.40005 2.44593 -134.45089 819.06573
5145.0000 -140.02624 -133.31651 6.70974 2.49832 -133.66602 852.12874
5150.0000 -141.99725 -136.16662 5.83063 2.41739 -134.87853 782.44279
5155.0000 -140.41159 -134.12762 6.28396 2.37948 -135.44666 732.88544
5160.0000 -141.16006 -134.70901 6.45105 2.42578 -134.75284 786.63104
5165.0000 -141.05476 -133.48957 7.56519 2.46210 -134.20860 834.63857
5170.0000 -139.94753 -133.64070 6.30683 2.51170 -133.46549 827.08034
5175.0000 -139.30630 -132.32004 6.98626 2.50920 -133.50300 828.43356
5180.0000 -137.46003 -131.67324 5.78679 2.56238 -132.70612 882.07789
5185.0000 -139.65326 -132.63491 7.01835 2.53837 -133.06593 838.46425
5190.0000 -139.38226 -133.38591 5.99636 2.55824 -132.76821 838.85195
5195.0000 -139.08073 -134.04632 5.03440 2.48678 -133.83882 807.15831
5200.0000 -140.13978 -134.64980 5.48998 2.44612 -134.44813 794.99616
5205.0000 -138.94772 -133.50412 5.44360 2.47329 -134.04095 797.15520
5210.0000 -139.98013 -134.45435 5.52577 2.49424 -133.72713 820.05777
5215.0000 -141.02229 -134.27522 6.74707 2.47000 -134.09031 843.91719
5220.0000 -138.48718 -132.03236 6.45482 2.51740 -133.38008 850.26566
5225.0000 -141.04254 -134.24806 6.79448 2.54387 -132.98340 873.54450
5230.0000 -139.66589 -133.76046 5.90543 2.45442 -134.32371 800.67633
5235.0000 -140.74118 -135.22180 5.51938 2.47484 -134.01783 811.87334
5240.0000 -140.66978 -134.88801 5.78177 2.41118 -134.97166 750.21285
5245.0000 -139.30551 -133.17253 6.13298 2.49542 -133.70938 828.39407
5250.0000 -139.81357 -134.11042 5.70315 2.51745 -133.37928 819.65371
FREEZING PROCESS: loop number 22 T-loop= 784.00000000000000
main_MD> interactions number 22 at Temperature= 784.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 5.35248 2.37189 -3.21302
force_rgl> df(natom) -1.38443 1.60744 1.70624
5255.0000 -139.22535 -133.49361 5.73174 2.51971 -133.34542 827.01537
5260.0000 -141.13247 -134.45776 6.67472 2.44373 -134.48398 797.99550
5265.0000 -140.34753 -134.63739 5.71014 2.43016 -134.68722 803.22543
5270.0000 -139.00648 -134.17036 4.83612 2.42257 -134.80098 776.33592
5275.0000 -141.50963 -134.83316 6.67647 2.45867 -134.26002 802.55937
5280.0000 -141.51662 -135.77828 5.73833 2.38087 -135.42584 745.79739
5285.0000 -141.07245 -135.95658 5.11587 2.38692 -135.33520 758.30272
5290.0000 -142.32900 -136.83550 5.49349 2.29533 -136.70749 693.58725
5295.0000 -141.43065 -136.21489 5.21575 2.34731 -135.92859 718.69837
5300.0000 -142.53359 -137.23350 5.30009 2.28334 -136.88715 671.69111
5305.0000 -141.42788 -135.75810 5.66979 2.30705 -136.53189 679.96539
5310.0000 -140.47138 -135.12752 5.34387 2.40087 -135.12615 763.39532
5315.0000 -140.98658 -134.81505 6.17153 2.46838 -134.11456 830.96789
5320.0000 -140.14458 -133.57232 6.57226 2.50272 -133.60004 855.43095
5325.0000 -139.97347 -134.93461 5.03886 2.45002 -134.38964 803.16252
5330.0000 -140.78244 -134.21672 6.56573 2.48167 -133.91539 807.92165
5335.0000 -140.65885 -135.37284 5.28602 2.40464 -135.06961 773.67490
5340.0000 -141.65858 -135.88446 5.77412 2.34001 -136.03809 760.15168
5345.0000 -141.41186 -136.05392 5.35794 2.29670 -136.68701 712.63607
5350.0000 -140.26339 -134.05368 6.20970 2.38747 -135.32695 778.32914
5355.0000 -141.20534 -136.46232 4.74302 2.41449 -134.92198 786.43868
5360.0000 -141.85967 -136.61221 5.24746 2.36179 -135.71166 729.60095
5365.0000 -141.43379 -136.07668 5.35711 2.36931 -135.59897 728.27944
5370.0000 -140.52796 -135.25944 5.26851 2.36338 -135.68790 762.50098
5375.0000 -139.09000 -133.49879 5.59121 2.44838 -134.41429 820.80448
5380.0000 -139.51774 -133.50149 6.01625 2.48209 -133.90918 816.02962
5385.0000 -140.15686 -134.91343 5.24342 2.48553 -133.85754 834.55626
5390.0000 -140.09084 -134.69902 5.39182 2.42754 -134.72655 798.32370
5395.0000 -139.90646 -133.68952 6.21694 2.46890 -134.10671 805.78025
5400.0000 -140.06479 -134.45022 5.61457 2.51906 -133.35518 863.65216
5405.0000 -140.50303 -135.28945 5.21358 2.41722 -134.88110 783.32024
5410.0000 -139.90924 -134.74350 5.16574 2.45097 -134.37541 794.84921
5415.0000 -141.37653 -136.07952 5.29701 2.36588 -135.65039 737.19817
5420.0000 -142.16311 -135.99703 6.16608 2.35651 -135.79072 741.89999
5425.0000 -140.97093 -135.38791 5.58303 2.35755 -135.77528 734.78508
5430.0000 -140.81009 -133.89809 6.91200 2.49071 -133.77999 829.39948
5435.0000 -140.77663 -135.13026 5.64637 2.41567 -134.90436 789.30235
5440.0000 -141.18987 -134.88423 6.30564 2.40227 -135.10513 761.77215
5445.0000 -140.88845 -135.32085 5.56759 2.42167 -134.81446 784.22739
5450.0000 -139.77308 -133.33665 6.43643 2.45388 -134.33177 798.10470
5455.0000 -138.84077 -133.81770 5.02308 2.53968 -133.04621 861.19420
5460.0000 -139.87526 -133.29171 6.58355 2.49019 -133.78784 822.75704
5465.0000 -140.60400 -133.65294 6.95106 2.49245 -133.75392 821.78506
5470.0000 -140.11789 -135.27142 4.84647 2.47740 -133.97940 771.39438
5475.0000 -140.36677 -134.84402 5.52274 2.37016 -135.58626 743.58577
5480.0000 -140.63502 -133.85966 6.77536 2.41897 -134.85487 769.01131
5485.0000 -139.45083 -133.21305 6.23778 2.51699 -133.38623 831.76852
5490.0000 -138.75031 -132.87846 5.87185 2.57439 -132.52621 903.33572
5495.0000 -139.68776 -133.28727 6.40049 2.51905 -133.35528 842.82129
5500.0000 -138.69004 -132.25089 6.43915 2.55264 -132.85208 855.17099
FREEZING PROCESS: loop number 23 T-loop= 759.00000000000000
main_MD> interactions number 23 at Temperature= 759.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.34129 -2.51276 -1.97617
force_rgl> df(natom) 1.74699 2.66816 -3.52401
5505.0000 -139.65123 -133.93252 5.71871 2.55515 -132.81442 882.40954
5510.0000 -140.69754 -135.78417 4.91337 2.43069 -134.67938 773.85949
5515.0000 -140.15030 -133.72644 6.42386 2.41010 -134.98782 761.63995
5520.0000 -139.27570 -133.09337 6.18234 2.49082 -133.77835 836.96039
5525.0000 -140.53183 -134.36911 6.16273 2.49063 -133.78111 830.26808
5530.0000 -140.85473 -134.58394 6.27079 2.44233 -134.50483 812.35136
5535.0000 -141.42576 -136.51093 4.91483 2.39163 -135.26464 753.10770
5540.0000 -141.23200 -135.86363 5.36836 2.31507 -136.41174 704.72426
5545.0000 -142.09492 -136.49344 5.60148 2.32067 -136.32782 704.22350
5550.0000 -141.81830 -136.42087 5.39744 2.32705 -136.23218 727.88076
5555.0000 -142.88942 -137.30961 5.57980 2.29971 -136.64193 688.12543
5560.0000 -142.65334 -137.18861 5.46473 2.23367 -137.63143 633.12757
5565.0000 -141.78380 -136.56113 5.22267 2.25728 -137.27759 657.47941
5570.0000 -142.03147 -136.19197 5.83950 2.30031 -136.63284 698.41096
5575.0000 -140.14481 -135.85542 4.28939 2.38367 -135.38388 758.91400
5580.0000 -139.36766 -133.80374 5.56393 2.45561 -134.30592 781.78176
5585.0000 -139.89775 -133.87217 6.02558 2.47663 -133.99091 820.73917
5590.0000 -141.26901 -134.35389 6.91512 2.41329 -134.93996 792.54096
5595.0000 -140.57259 -133.97447 6.59812 2.45950 -134.24761 817.94423
5600.0000 -139.88078 -133.12329 6.75749 2.48198 -133.91075 831.22727
5605.0000 -139.94769 -133.63894 6.30875 2.50748 -133.52867 816.10628
5610.0000 -142.25100 -136.00939 6.24161 2.39115 -135.27180 731.29063
5615.0000 -139.93375 -134.37119 5.56256 2.37373 -135.53282 733.57689
5620.0000 -141.16153 -135.84418 5.31736 2.37652 -135.49100 748.30750
5625.0000 -139.59682 -134.93422 4.66259 2.39586 -135.20113 771.78238
5630.0000 -142.37948 -136.00925 6.37024 2.37758 -135.47512 765.37793
5635.0000 -142.32616 -136.63955 5.68660 2.31889 -136.35449 734.41487
5640.0000 -140.82825 -135.69441 5.13384 2.33819 -136.06532 726.11284
5645.0000 -142.28354 -136.89953 5.38401 2.35250 -135.85081 757.50127
5650.0000 -141.93710 -136.42048 5.51662 2.32708 -136.23183 732.30452
5655.0000 -141.22525 -135.96244 5.26281 2.32759 -136.22415 714.35131
5660.0000 -141.21618 -134.57806 6.63812 2.39764 -135.17458 770.33440
5665.0000 -139.97639 -133.90013 6.07626 2.44825 -134.41622 816.82886
5670.0000 -140.06600 -134.54982 5.51618 2.47587 -134.00232 821.07293
5675.0000 -140.77620 -135.13496 5.64125 2.44005 -134.53903 783.03385
5680.0000 -140.73704 -134.16035 6.57669 2.40766 -135.02431 782.29221
5685.0000 -140.61255 -134.20446 6.40809 2.48190 -133.91202 811.95573
5690.0000 -141.98152 -136.38748 5.59404 2.38177 -135.41237 749.83420
5695.0000 -142.57752 -136.85474 5.72278 2.30534 -136.55751 682.24366
5700.0000 -141.65236 -136.31471 5.33764 2.32566 -136.25304 717.88851
5705.0000 -141.09567 -136.24362 4.85205 2.35702 -135.78308 723.39503
5710.0000 -142.63966 -137.46698 5.17268 2.30457 -136.56909 710.12835
5715.0000 -140.92800 -136.23102 4.69698 2.33901 -136.05299 735.86303
5720.0000 -140.96276 -135.48275 5.48001 2.39405 -135.22823 756.99440
5725.0000 -141.56576 -135.74334 5.82242 2.37704 -135.48312 768.50565
5730.0000 -141.79299 -135.80931 5.98368 2.33550 -136.10559 720.26935
5735.0000 -141.03434 -135.77661 5.25772 2.34052 -136.03036 724.34655
5740.0000 -141.62158 -136.92461 4.69697 2.31497 -136.41323 704.30591
5745.0000 -141.45447 -135.25246 6.20202 2.35917 -135.75088 730.16370
5750.0000 -140.84266 -135.72195 5.12070 2.41342 -134.93810 778.05964
FREEZING PROCESS: loop number 24 T-loop= 734.00000000000000
main_MD> interactions number 24 at Temperature= 734.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.89277 -0.18269 0.45610
force_rgl> df(natom) -0.30070 3.17730 -1.37054
5755.0000 -142.19954 -137.78960 4.40994 2.27620 -136.99413 677.31325
5760.0000 -141.56292 -135.59707 5.96585 2.30908 -136.50152 701.74889
5765.0000 -141.34808 -135.51736 5.83071 2.37042 -135.58233 741.27741
5770.0000 -140.98439 -136.19206 4.79232 2.35239 -135.85247 731.92976
5775.0000 -141.78667 -136.35415 5.43252 2.29360 -136.73337 684.00570
5780.0000 -142.74696 -137.06488 5.68208 2.34968 -135.89308 721.75329
5785.0000 -141.68272 -137.28145 4.40127 2.27947 -136.94518 681.82061
5790.0000 -141.39490 -136.29702 5.09787 2.32721 -136.22984 728.26901
5795.0000 -141.78993 -135.58535 6.20458 2.35430 -135.82394 727.36764
5800.0000 -140.48027 -134.89252 5.58775 2.41524 -134.91082 757.03975
5805.0000 -140.58458 -134.79763 5.78695 2.42886 -134.70665 787.40675
5810.0000 -141.30738 -135.32508 5.98230 2.36967 -135.59355 750.93286
5815.0000 -138.83195 -133.94318 4.88876 2.44504 -134.46427 798.89761
5820.0000 -139.02679 -133.53796 5.48883 2.50168 -133.61565 840.01200
5825.0000 -141.26673 -135.95731 5.30941 2.41760 -134.87540 767.82044
5830.0000 -141.42873 -134.99807 6.43065 2.37224 -135.55511 742.76073
5835.0000 -141.57718 -136.49086 5.08632 2.37537 -135.50821 722.93128
5840.0000 -142.53874 -136.63940 5.89934 2.35597 -135.79890 758.37734
5845.0000 -142.99009 -137.78133 5.20876 2.28011 -136.93555 713.13333
5850.0000 -142.23633 -137.24458 4.99175 2.19108 -138.26949 644.56117
5855.0000 -141.58805 -136.71071 4.87734 2.29989 -136.63920 713.51001
5860.0000 -142.18383 -135.71447 6.46936 2.32193 -136.30886 728.94779
5865.0000 -139.62272 -135.08039 4.54233 2.39584 -135.20149 774.69354
5870.0000 -141.24040 -135.54999 5.69041 2.37801 -135.46862 742.98592
5875.0000 -139.74005 -133.39982 6.34023 2.45465 -134.32025 833.33089
5880.0000 -141.56677 -135.28057 6.28621 2.47446 -134.02340 818.07084
5885.0000 -139.89610 -135.26255 4.63355 2.35586 -135.80049 731.65187
5890.0000 -140.62879 -135.23474 5.39405 2.37664 -135.48918 743.21602
5895.0000 -140.64289 -135.87555 4.76734 2.38195 -135.40956 708.04248
5900.0000 -140.67857 -135.57692 5.10165 2.38456 -135.37043 747.62809
5905.0000 -140.94051 -135.08370 5.85681 2.39554 -135.20598 773.18019
5910.0000 -140.63354 -134.48844 6.14510 2.43343 -134.63825 813.28254
5915.0000 -141.80161 -136.59659 5.20502 2.38068 -135.42868 779.62750
5920.0000 -141.14336 -135.95019 5.19318 2.32793 -136.21896 705.63147
5925.0000 -140.78348 -135.58742 5.19606 2.31018 -136.48497 693.68039
5930.0000 -141.56186 -135.52851 6.03336 2.39666 -135.18927 749.21921
5935.0000 -141.69303 -135.93404 5.75899 2.33951 -136.04546 707.82818
5940.0000 -141.80451 -136.09281 5.71169 2.36930 -135.59918 756.79980
5945.0000 -141.58812 -136.34572 5.24240 2.36873 -135.60775 750.90952
5950.0000 -140.63875 -135.30262 5.33613 2.35967 -135.74346 751.44847
5955.0000 -140.16536 -134.41494 5.75043 2.39226 -135.25517 745.54371
5960.0000 -140.41363 -134.00484 6.40879 2.47685 -133.98766 821.43120
5965.0000 -140.28952 -134.00737 6.28214 2.46034 -134.23507 797.77002
5970.0000 -140.75427 -134.55716 6.19710 2.40412 -135.07746 780.83826
5975.0000 -140.63503 -133.45239 7.18263 2.43981 -134.54261 824.12252
5980.0000 -139.46392 -132.95031 6.51361 2.53490 -133.11782 839.30156
5985.0000 -139.96439 -134.21463 5.74977 2.48915 -133.80342 815.24495
5990.0000 -139.51615 -133.66467 5.85148 2.49487 -133.71760 821.14473
5995.0000 -141.00817 -135.84921 5.15896 2.47554 -134.00731 811.08432
6000.0000 -140.39854 -134.73968 5.65886 2.40513 -135.06227 775.20480
FREEZING PROCESS: loop number 25 T-loop= 709.00000000000000
main_MD> interactions number 25 at Temperature= 709.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.93668 0.00352 1.10234
force_rgl> df(natom) 3.07669 2.93167 -0.69882
6005.0000 -141.49731 -136.71247 4.78485 2.35493 -135.81449 738.72991
6010.0000 -142.48874 -137.83079 4.65795 2.27783 -136.96977 669.88008
6015.0000 -142.72111 -137.57586 5.14525 2.26900 -137.10203 669.73228
6020.0000 -140.61859 -135.29700 5.32159 2.32941 -136.19679 704.40409
6025.0000 -141.71308 -136.24428 5.46880 2.38953 -135.29600 751.53068
6030.0000 -141.32559 -136.40586 4.91972 2.33145 -136.16625 730.08872
6035.0000 -142.23790 -136.07497 6.16293 2.29208 -136.75618 710.03881
6040.0000 -142.52831 -136.24345 6.28486 2.28887 -136.80433 702.93385
6045.0000 -141.11042 -135.18452 5.92590 2.34198 -136.00846 729.77672
6050.0000 -141.78209 -136.40300 5.37909 2.36718 -135.63088 748.77180
6055.0000 -143.02220 -138.26111 4.76109 2.25105 -137.37104 653.36912
6060.0000 -142.56375 -137.41613 5.14762 2.25166 -137.36184 645.87056
6065.0000 -141.71423 -136.23500 5.47924 2.29857 -136.65902 689.48187
6070.0000 -141.71308 -137.06830 4.64478 2.27015 -137.08474 672.22036
6075.0000 -141.60682 -135.74999 5.85683 2.29442 -136.72110 709.78019
6080.0000 -141.04592 -135.90073 5.14518 2.36718 -135.63089 768.95931
6085.0000 -142.68170 -137.21218 5.46952 2.30047 -136.63044 715.13468
6090.0000 -141.56814 -136.49489 5.07325 2.25450 -137.31931 655.39605
6095.0000 -141.02077 -135.08415 5.93663 2.33567 -136.10302 700.86019
6100.0000 -141.03645 -136.04332 4.99313 2.39374 -135.23294 756.56655
6105.0000 -140.84421 -135.23926 5.60495 2.37201 -135.55849 766.85326
6110.0000 -142.41285 -136.75528 5.65758 2.31862 -136.35859 724.69715
6115.0000 -142.34221 -136.49751 5.84470 2.28876 -136.80595 702.62670
6120.0000 -140.46487 -136.13694 4.32793 2.29892 -136.65370 705.70885
6125.0000 -141.44045 -136.31123 5.12922 2.33029 -136.18368 709.06650
6130.0000 -141.35099 -136.66952 4.68147 2.33067 -136.17796 713.92543
6135.0000 -142.99925 -137.95976 5.03949 2.26832 -137.11217 702.11262
6140.0000 -142.94124 -138.28367 4.65757 2.22613 -137.74436 669.57052
6145.0000 -142.91315 -137.82073 5.09242 2.23047 -137.67930 662.95994
6150.0000 -143.47005 -139.65260 3.81745 2.14750 -138.92254 565.49807
6155.0000 -143.77598 -138.40870 5.36727 2.16120 -138.71726 594.80054
6160.0000 -143.30753 -138.35580 4.95173 2.20512 -138.05912 653.68419
6165.0000 -141.47075 -136.65423 4.81652 2.27814 -136.96505 714.83990
6170.0000 -141.50217 -135.92725 5.57492 2.31701 -136.38262 716.07693
6175.0000 -142.47842 -137.33315 5.14527 2.33644 -136.09158 724.13129
6180.0000 -142.82853 -138.08381 4.74473 2.24933 -137.39676 650.73603
6185.0000 -142.16737 -137.44963 4.71775 2.27415 -137.02488 685.92976
6190.0000 -143.22125 -138.31557 4.90567 2.23256 -137.64804 656.84443
6195.0000 -142.44524 -137.35523 5.09001 2.22508 -137.76015 650.14682
6200.0000 -141.18468 -136.97394 4.21073 2.32466 -136.26796 733.93617
6205.0000 -141.22005 -136.29195 4.92810 2.30299 -136.59272 704.73059
6210.0000 -140.78279 -135.86688 4.91591 2.31902 -136.35257 697.73322
6215.0000 -140.96003 -136.13053 4.82951 2.37628 -135.49461 741.06828
6220.0000 -142.72592 -137.26200 5.46392 2.29351 -136.73472 678.41633
6225.0000 -143.21031 -137.96145 5.24886 2.23758 -137.57287 644.45126
6230.0000 -142.27451 -137.71159 4.56292 2.21190 -137.95755 639.93588
6235.0000 -142.27827 -137.13061 5.14766 2.23597 -137.59695 673.14821
6240.0000 -142.28315 -137.45533 4.82782 2.24581 -137.44950 658.05542
6245.0000 -141.81600 -137.07126 4.74474 2.26289 -137.19363 670.26727
6250.0000 -142.07934 -136.47789 5.60145 2.33473 -136.11716 704.85415
FREEZING PROCESS: loop number 26 T-loop= 684.00000000000000
main_MD> interactions number 26 at Temperature= 684.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.28547 2.17965 -0.59194
force_rgl> df(natom) -1.07426 2.05060 -0.74839
6255.0000 -141.61530 -136.25166 5.36364 2.29163 -136.76300 680.21603
6260.0000 -142.40323 -137.00805 5.39518 2.29839 -136.66166 730.33784
6265.0000 -142.13900 -137.40315 4.73585 2.25247 -137.34972 675.54492
6270.0000 -141.39392 -135.59991 5.79402 2.31720 -136.37975 694.68328
6275.0000 -140.54722 -136.01246 4.53476 2.36688 -135.63536 722.49202
6280.0000 -140.45994 -135.57798 4.88195 2.37519 -135.51088 750.18258
6285.0000 -142.20318 -136.81283 5.39035 2.32367 -136.28283 690.94517
6290.0000 -141.45840 -136.72023 4.73816 2.29864 -136.65792 703.79138
6295.0000 -141.39969 -137.29223 4.10745 2.29602 -136.69711 675.81920
6300.0000 -141.78169 -137.34205 4.43964 2.29557 -136.70386 676.96303
6305.0000 -142.77996 -137.59679 5.18317 2.22544 -137.75473 655.75542
6310.0000 -142.36276 -137.35687 5.00589 2.28309 -136.89090 715.73560
6315.0000 -142.04053 -136.96053 5.08000 2.24238 -137.50086 661.98197
6320.0000 -142.28982 -136.28015 6.00967 2.29403 -136.72696 676.95668
6325.0000 -141.47454 -135.92486 5.54968 2.33288 -136.14491 736.07827
6330.0000 -141.69989 -137.56939 4.13051 2.28038 -136.93145 714.03041
6335.0000 -143.22776 -137.09994 6.12782 2.27374 -137.03107 705.19911
6340.0000 -141.34071 -136.81643 4.52428 2.25787 -137.26884 668.81446
6345.0000 -142.37569 -137.88683 4.48886 2.27280 -137.04511 685.38975
6350.0000 -141.95597 -136.45427 5.50170 2.29086 -136.77450 693.63610
6355.0000 -141.65515 -137.22438 4.43076 2.29413 -136.72552 688.35398
6360.0000 -142.09375 -137.38517 4.70858 2.29136 -136.76704 693.11911
6365.0000 -141.84198 -136.92567 4.91632 2.25654 -137.28878 671.45021
6370.0000 -142.40652 -137.82850 4.57802 2.23162 -137.66206 651.30972
6375.0000 -142.95044 -137.74209 5.20835 2.25382 -137.32949 661.87094
6380.0000 -142.48183 -137.74625 4.73558 2.24135 -137.51630 654.41214
6385.0000 -143.12771 -138.16348 4.96424 2.20883 -138.00351 619.55205
6390.0000 -142.28503 -136.83790 5.44713 2.20575 -138.04970 643.42023
6395.0000 -141.15904 -135.95558 5.20346 2.28352 -136.88444 683.61084
6400.0000 -142.16906 -137.06240 5.10666 2.29609 -136.69605 686.71568
6405.0000 -141.57812 -137.23354 4.34457 2.27410 -137.02562 677.50998
6410.0000 -142.06672 -136.27691 5.78981 2.28379 -136.88046 675.07059
6415.0000 -140.75077 -135.54013 5.21064 2.34764 -135.92362 730.72232
6420.0000 -140.74276 -135.96573 4.77703 2.36100 -135.72354 737.72933
6425.0000 -142.84267 -137.64907 5.19360 2.30774 -136.52151 687.43287
6430.0000 -142.03657 -137.02453 5.01204 2.22312 -137.78950 622.14254
6435.0000 -141.38091 -136.38260 4.99830 2.22960 -137.69233 636.57464
6440.0000 -142.16304 -136.52899 5.63405 2.32862 -136.20870 705.22566
6445.0000 -142.24835 -137.33127 4.91708 2.28306 -136.89138 658.47326
6450.0000 -142.65990 -138.21463 4.44527 2.23448 -137.61932 655.99698
6455.0000 -142.32422 -137.72373 4.60049 2.24505 -137.46086 663.75733
6460.0000 -142.06606 -137.52421 4.54186 2.20967 -137.99099 636.37517
6465.0000 -142.68847 -137.91376 4.77471 2.23572 -137.60061 654.71876
6470.0000 -143.12446 -139.00542 4.11904 2.20189 -138.10760 633.15455
6475.0000 -142.61381 -137.49291 5.12090 2.23180 -137.65942 658.15562
6480.0000 -142.41747 -137.45221 4.96526 2.22740 -137.72528 629.57215
6485.0000 -141.34404 -136.21645 5.12759 2.28117 -136.91969 673.49811
6490.0000 -141.55672 -136.59622 4.96050 2.37359 -135.53485 715.16958
6495.0000 -142.42447 -137.85088 4.57359 2.27259 -137.04822 655.40527
6500.0000 -141.46736 -136.08409 5.38327 2.31285 -136.44497 718.02646
FREEZING PROCESS: loop number 27 T-loop= 659.00000000000000
main_MD> interactions number 27 at Temperature= 659.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -2.63748 2.59993 0.95322
force_rgl> df(natom) -2.06012 0.19095 1.72729
6505.0000 -142.95260 -138.06392 4.88869 2.27647 -136.99008 655.21496
6510.0000 -142.42001 -137.86754 4.55247 2.22212 -137.80439 637.58290
6515.0000 -141.16425 -136.78652 4.37773 2.32661 -136.23880 709.08057
6520.0000 -141.63840 -137.63217 4.00623 2.27242 -137.05081 636.19973
6525.0000 -142.72753 -138.51349 4.21404 2.18065 -138.42577 621.19833
6530.0000 -142.69903 -137.67974 5.01929 2.20056 -138.12751 608.44949
6535.0000 -143.07869 -138.55374 4.52495 2.19978 -138.13917 617.68436
6540.0000 -143.34439 -138.34967 4.99472 2.15324 -138.83659 599.77260
6545.0000 -143.14383 -138.53488 4.60895 2.16372 -138.67952 609.48135
6550.0000 -142.31810 -137.69303 4.62508 2.18942 -138.29438 630.45215
6555.0000 -142.63580 -138.93885 3.69695 2.18718 -138.32797 605.66386
6560.0000 -142.77207 -138.12446 4.64760 2.19368 -138.23055 605.58154
6565.0000 -142.74918 -137.95286 4.79632 2.22694 -137.73224 637.03492
6570.0000 -141.18213 -135.95786 5.22427 2.25368 -137.33158 665.26484
6575.0000 -141.25768 -137.27539 3.98228 2.28332 -136.88744 670.33756
6580.0000 -142.28572 -137.11358 5.17214 2.28361 -136.88314 653.55773
6585.0000 -141.58752 -136.52535 5.06217 2.27449 -137.01980 668.20731
6590.0000 -142.37722 -136.49219 5.88502 2.29597 -136.69794 680.44531
6595.0000 -142.98665 -137.98411 5.00254 2.27320 -137.03913 691.56888
6600.0000 -141.96603 -137.71991 4.24612 2.23667 -137.58644 671.89504
6605.0000 -142.91219 -137.85590 5.05629 2.20819 -138.01318 621.54379
6610.0000 -141.18853 -136.77524 4.41329 2.27705 -136.98146 677.24156
6615.0000 -141.98251 -136.54339 5.43911 2.34576 -135.95186 713.98188
6620.0000 -140.98051 -136.02903 4.95148 2.30776 -136.52126 690.82001
6625.0000 -141.60006 -136.92508 4.67497 2.30961 -136.49352 691.08353
6630.0000 -142.06165 -135.98754 6.07412 2.31401 -136.42765 672.24664
6635.0000 -142.20683 -137.15757 5.04926 2.29283 -136.74495 684.07728
6640.0000 -142.13968 -137.24679 4.89289 2.25365 -137.33205 646.30199
6645.0000 -141.80653 -136.47330 5.33323 2.28777 -136.82083 668.88454
6650.0000 -142.39510 -137.05369 5.34141 2.22906 -137.70046 646.21070
6655.0000 -141.81820 -136.97281 4.84538 2.28464 -136.86763 679.27307
6660.0000 -141.76572 -137.20201 4.56372 2.27442 -137.02084 669.36240
6665.0000 -142.37718 -136.97562 5.40156 2.28541 -136.85617 682.10829
6670.0000 -142.51582 -136.54075 5.97507 2.26619 -137.14417 677.07183
6675.0000 -142.92104 -138.47729 4.44375 2.22672 -137.73558 659.41361
6680.0000 -143.21115 -138.61355 4.59760 2.18341 -138.38443 630.25997
6685.0000 -142.76199 -138.26962 4.49237 2.18239 -138.39969 622.70991
6690.0000 -143.06674 -139.21580 3.85094 2.16878 -138.60363 579.21143
6695.0000 -143.07232 -138.84052 4.23180 2.14291 -138.99129 586.08042
6700.0000 -142.99403 -138.77190 4.22214 2.15649 -138.78778 606.82488
6705.0000 -142.10119 -137.81001 4.29118 2.23447 -137.61936 647.87667
6710.0000 -142.44742 -137.61552 4.83190 2.22076 -137.82482 605.31851
6715.0000 -141.96662 -136.89270 5.07392 2.25011 -137.38498 671.66425
6720.0000 -142.73956 -136.97750 5.76206 2.26556 -137.15360 700.86959
6725.0000 -141.65609 -137.15011 4.50599 2.26609 -137.14568 677.89932
6730.0000 -142.02308 -136.44158 5.58149 2.28501 -136.86216 689.63066
6735.0000 -140.59191 -136.18718 4.40473 2.32555 -136.25468 710.48360
6740.0000 -142.17529 -137.33745 4.83784 2.30908 -136.50149 679.10017
6745.0000 -142.36547 -137.50379 4.86168 2.21627 -137.89213 625.64671
6750.0000 -141.97539 -137.84220 4.13318 2.23125 -137.66764 627.09686
FREEZING PROCESS: loop number 28 T-loop= 634.00000000000000
main_MD> interactions number 28 at Temperature= 634.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.97543 1.78543 0.35357
force_rgl> df(natom) 0.62918 -2.35001 1.10738
6755.0000 -141.73045 -137.16013 4.57032 2.27736 -136.97681 662.87411
6760.0000 -143.34732 -138.49728 4.85005 2.16523 -138.65682 613.04692
6765.0000 -142.06010 -136.56924 5.49086 2.22757 -137.72282 650.78130
6770.0000 -142.40146 -138.00135 4.40011 2.27328 -137.03790 679.87592
6775.0000 -142.09761 -137.10593 4.99168 2.26893 -137.10299 667.56578
6780.0000 -142.45967 -137.91169 4.54798 2.23396 -137.62704 650.20918
6785.0000 -142.56226 -137.76292 4.79933 2.24771 -137.42107 671.30126
6790.0000 -143.29863 -137.95290 5.34573 2.22164 -137.81161 659.16537
6795.0000 -142.56106 -138.34532 4.21573 2.20606 -138.04516 611.05056
6800.0000 -142.66158 -138.32319 4.33839 2.23697 -137.58196 635.97138
6805.0000 -143.09592 -137.76083 5.33509 2.22083 -137.82383 635.46894
6810.0000 -142.82563 -138.10990 4.71573 2.19536 -138.20545 635.93674
6815.0000 -142.32826 -138.10442 4.22384 2.20378 -138.07926 641.10246
6820.0000 -141.80707 -136.89767 4.90940 2.23605 -137.59579 645.38786
6825.0000 -142.90841 -137.96342 4.94499 2.27459 -137.01833 712.38250
6830.0000 -142.61054 -137.75435 4.85619 2.21858 -137.85744 655.13863
6835.0000 -144.05589 -139.55156 4.50433 2.17333 -138.53543 645.31034
6840.0000 -142.91721 -137.85903 5.05819 2.15149 -138.86280 623.41468
6845.0000 -144.51796 -139.51270 5.00526 2.16423 -138.67188 641.59714
6850.0000 -144.24390 -139.88817 4.35573 2.10495 -139.56016 587.60302
6855.0000 -143.41405 -138.75281 4.66124 2.14212 -139.00321 646.58500
6860.0000 -143.69551 -139.48644 4.20906 2.13627 -139.09084 600.88836
6865.0000 -143.76244 -138.21074 5.55170 2.12370 -139.27918 587.41240
6870.0000 -143.16088 -138.51051 4.65037 2.18624 -138.34205 616.59155
6875.0000 -142.49278 -138.38838 4.10440 2.16446 -138.66839 596.90363
6880.0000 -142.92467 -138.07074 4.85393 2.20142 -138.11458 644.06363
6885.0000 -143.08180 -138.30698 4.77482 2.20177 -138.10933 631.28555
6890.0000 -142.27113 -137.65767 4.61347 2.21290 -137.94263 642.61529
6895.0000 -142.69577 -137.20396 5.49181 2.24644 -137.44004 682.47691
6900.0000 -142.93603 -138.33534 4.60069 2.23838 -137.56086 689.66824
6905.0000 -142.93659 -137.77029 5.16630 2.19871 -138.15525 675.15731
6910.0000 -142.67220 -136.52579 6.14640 2.28440 -136.87123 695.36425
6915.0000 -142.47768 -136.68175 5.79592 2.27763 -136.97275 671.26380
6920.0000 -142.76033 -137.55191 5.20842 2.28765 -136.82264 689.98066
6925.0000 -142.74185 -137.88895 4.85290 2.24030 -137.53212 655.75965
6930.0000 -143.02910 -138.77591 4.25319 2.17744 -138.47387 623.76530
6935.0000 -143.68860 -139.39865 4.28995 2.14806 -138.91410 588.15394
6940.0000 -143.09681 -139.06539 4.03142 2.12873 -139.20371 582.88973
6945.0000 -143.38615 -138.56077 4.82539 2.16703 -138.62988 595.47952
6950.0000 -142.17446 -137.29958 4.87488 2.23800 -137.56650 635.81058
6955.0000 -142.21331 -137.05334 5.15997 2.25385 -137.32897 663.47193
6960.0000 -142.77726 -137.85990 4.91735 2.23484 -137.61386 627.68120
6965.0000 -142.68421 -138.46649 4.21773 2.20317 -138.08838 613.66861
6970.0000 -141.83383 -137.99932 3.83451 2.18768 -138.32053 633.91911
6975.0000 -142.55793 -137.56918 4.98874 2.23634 -137.59142 680.86246
6980.0000 -142.92855 -138.00827 4.92028 2.20571 -138.05036 638.72997
6985.0000 -143.02662 -138.62717 4.39945 2.19491 -138.21209 648.60353
6990.0000 -141.59598 -135.87267 5.72332 2.21712 -137.87931 656.17103
6995.0000 -143.07312 -138.32501 4.74811 2.25167 -137.36170 685.88573
7000.0000 -142.93211 -138.69890 4.23321 2.18214 -138.40354 593.64338
FREEZING PROCESS: loop number 29 T-loop= 609.00000000000000
main_MD> interactions number 29 at Temperature= 609.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.28946 -3.03451 1.88855
force_rgl> df(natom) 0.80527 -2.22882 6.26922
7005.0000 -143.49458 -138.67807 4.81651 2.16776 -138.61900 602.46225
7010.0000 -142.54731 -137.48597 5.06134 2.23173 -137.66052 636.10554
7015.0000 -143.10939 -138.51717 4.59222 2.21620 -137.89321 624.01435
7020.0000 -142.45320 -138.44884 4.00436 2.16066 -138.72529 585.23538
7025.0000 -143.99063 -139.08861 4.90202 2.16756 -138.62200 589.93753
7030.0000 -143.67448 -139.04342 4.63106 2.10895 -139.50010 564.01746
7035.0000 -141.89797 -137.01537 4.88260 2.18648 -138.33848 620.69661
7040.0000 -143.00434 -138.34774 4.65660 2.22188 -137.80799 636.73779
7045.0000 -143.64411 -138.17327 5.47084 2.14360 -138.98091 583.17299
7050.0000 -143.15931 -138.69938 4.45992 2.17136 -138.56499 607.91032
7055.0000 -144.27823 -139.77948 4.49875 2.13503 -139.10937 590.31819
7060.0000 -142.58403 -137.81329 4.77074 2.12926 -139.19583 582.45361
7065.0000 -143.76715 -138.77591 4.99124 2.19034 -138.28059 626.83955
7070.0000 -142.28561 -137.58403 4.70158 2.21200 -137.95615 639.83993
7075.0000 -142.14544 -137.93304 4.21241 2.21938 -137.84552 648.79895
7080.0000 -142.87665 -138.41262 4.46404 2.16834 -138.61033 597.85817
7085.0000 -141.87852 -136.95137 4.92715 2.21521 -137.90796 614.38311
7090.0000 -143.33158 -138.53472 4.79686 2.23863 -137.55701 645.04038
7095.0000 -143.38330 -139.01186 4.37144 2.16272 -138.69450 590.22358
7100.0000 -142.39575 -138.51702 3.87873 2.17148 -138.56320 599.21751
7105.0000 -141.69891 -137.59356 4.10536 2.20086 -138.12304 626.66502
7110.0000 -142.38849 -137.20837 5.18012 2.22695 -137.73213 663.22578
7115.0000 -143.42105 -138.24253 5.17853 2.20240 -138.09989 644.77588
7120.0000 -143.26222 -138.20148 5.06075 2.20635 -138.04077 644.74138
7125.0000 -142.35340 -137.60356 4.74984 2.21532 -137.90635 643.39051
7130.0000 -141.36057 -136.81639 4.54418 2.24516 -137.45923 646.04381
7135.0000 -141.46893 -137.04092 4.42801 2.25682 -137.28455 641.76908
7140.0000 -142.02100 -137.08724 4.93377 2.23295 -137.64213 640.70504
7145.0000 -143.35514 -138.99252 4.36262 2.22333 -137.78634 639.86195
7150.0000 -143.47836 -139.04171 4.43665 2.11838 -139.35887 562.24747
7155.0000 -143.66069 -139.51232 4.14837 2.17032 -138.58062 619.82395
7160.0000 -142.92240 -138.85700 4.06540 2.13950 -139.04239 581.86467
7165.0000 -143.32927 -138.58654 4.74272 2.16550 -138.65290 590.11534
7170.0000 -143.22844 -139.22727 4.00117 2.18318 -138.38787 586.37042
7175.0000 -142.14074 -137.54945 4.59129 2.20565 -138.05130 600.94645
7180.0000 -141.99955 -137.73878 4.26077 2.19632 -138.19096 610.02150
7185.0000 -141.86843 -137.36699 4.50144 2.22687 -137.73332 634.40376
7190.0000 -143.41539 -137.96290 5.45249 2.19109 -138.26942 598.78434
7195.0000 -143.28329 -138.25842 5.02487 2.21542 -137.90481 650.20252
7200.0000 -142.55747 -137.68312 4.87435 2.20393 -138.07703 638.14301
7205.0000 -143.54549 -138.36369 5.18180 2.16642 -138.63902 634.50370
7210.0000 -143.09536 -138.23528 4.86008 2.18525 -138.35685 623.20511
7215.0000 -143.27318 -139.30269 3.97050 2.17398 -138.52577 593.80963
7220.0000 -142.92676 -139.18917 3.73759 2.12999 -139.18494 555.90275
7225.0000 -143.71545 -138.50426 5.21120 2.15200 -138.85508 567.24231
7230.0000 -143.32970 -139.27570 4.05400 2.17234 -138.55032 615.50652
7235.0000 -143.49014 -138.80351 4.68663 2.11795 -139.36529 593.99915
7240.0000 -142.44946 -138.74953 3.69993 2.14008 -139.03368 583.01164
7245.0000 -143.37745 -139.20703 4.17042 2.11792 -139.36576 576.28310
7250.0000 -143.91310 -138.80746 5.10563 2.16028 -138.73105 633.66555
FREEZING PROCESS: loop number 30 T-loop= 584.00000000000000
main_MD> interactions number 30 at Temperature= 584.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.22624 -0.88967 -0.00485
force_rgl> df(natom) -0.88475 -1.09542 2.74033
7255.0000 -144.69627 -139.28031 5.41596 2.11094 -139.47041 623.49651
7260.0000 -143.81424 -140.15612 3.65812 2.05607 -140.29253 579.87786
7265.0000 -144.62021 -140.58584 4.03437 2.03899 -140.54844 569.48979
7270.0000 -144.16737 -140.37675 3.79062 2.03394 -140.62415 552.24466
7275.0000 -144.07514 -140.45259 3.62254 2.05066 -140.37355 562.42876
7280.0000 -144.16888 -139.44065 4.72823 2.11954 -139.34153 612.95546
7285.0000 -143.88443 -138.97211 4.91232 2.11734 -139.37450 593.79080
7290.0000 -143.44823 -137.55290 5.89533 2.16460 -138.66628 613.62062
7295.0000 -142.55539 -138.56381 3.99158 2.20992 -137.98719 635.12675
7300.0000 -144.07700 -139.17248 4.90451 2.08473 -139.86301 553.33741
7305.0000 -142.63210 -138.36292 4.26918 2.14298 -138.99033 617.18612
7310.0000 -143.20152 -138.56094 4.64058 2.16142 -138.71404 602.70270
7315.0000 -143.43189 -138.79805 4.63384 2.14500 -138.95994 565.04169
7320.0000 -143.31436 -138.20876 5.10560 2.19536 -138.20544 617.07016
7325.0000 -143.33194 -139.07629 4.25566 2.15730 -138.77574 595.10907
7330.0000 -142.67605 -138.72921 3.94685 2.15239 -138.84931 573.68942
7335.0000 -143.75769 -140.16219 3.59551 2.09196 -139.75474 523.01276
7340.0000 -143.12852 -138.61022 4.51830 2.17073 -138.57445 590.98715
7345.0000 -143.52390 -138.69938 4.82452 2.14190 -139.00644 598.14771
7350.0000 -144.60012 -140.08382 4.51630 2.13075 -139.17346 612.89298
7355.0000 -144.43331 -139.89497 4.53834 2.05546 -140.30164 545.42048
7360.0000 -143.04413 -137.90946 5.13467 2.12766 -139.21979 584.59640
7365.0000 -142.79962 -139.20389 3.59573 2.14832 -138.91023 587.37049
7370.0000 -144.27212 -140.04715 4.22497 2.08836 -139.80871 530.40552
7375.0000 -144.51579 -140.10669 4.40911 2.07219 -140.05098 551.09248
7380.0000 -144.53079 -139.88439 4.64640 2.04147 -140.51126 553.40140
7385.0000 -144.96986 -140.89198 4.07787 2.03825 -140.55947 558.32012
7390.0000 -145.48854 -141.08111 4.40742 2.00582 -141.04549 546.65420
7395.0000 -144.45639 -140.59531 3.86107 2.04309 -140.48699 581.64239
7400.0000 -144.49385 -140.09241 4.40144 2.05378 -140.32683 579.26014
7405.0000 -143.77695 -139.24931 4.52764 2.12479 -139.26284 619.89899
7410.0000 -144.37645 -140.24974 4.12671 2.11379 -139.42765 605.95246
7415.0000 -144.81722 -140.15225 4.66496 2.07833 -139.95889 566.92286
7420.0000 -145.32925 -140.29308 5.03617 2.09190 -139.75558 577.45679
7425.0000 -144.63329 -140.41235 4.22094 2.05410 -140.32197 562.47923
7430.0000 -144.63636 -140.95020 3.68616 2.05973 -140.23761 557.65217
7435.0000 -144.73300 -140.62552 4.10748 2.03664 -140.58355 534.63917
7440.0000 -143.51055 -139.69695 3.81361 2.06023 -140.23013 544.38402
7445.0000 -143.56253 -139.34227 4.22026 2.10315 -139.58699 543.87455
7450.0000 -142.96210 -137.97382 4.98828 2.16900 -138.60040 599.82150
7455.0000 -144.21602 -140.15608 4.05993 2.14195 -139.00568 598.41495
7460.0000 -143.66641 -139.43942 4.22699 2.08821 -139.81086 547.25306
7465.0000 -143.53512 -138.88424 4.65088 2.12508 -139.25848 557.06310
7470.0000 -142.64163 -138.14295 4.49868 2.18040 -138.42954 580.71697
7475.0000 -143.25866 -139.35628 3.90239 2.15274 -138.84403 583.36964
7480.0000 -143.38519 -139.32431 4.06088 2.13011 -139.18315 573.82488
7485.0000 -143.91450 -139.89339 4.02111 2.10294 -139.59019 545.77313
7490.0000 -143.46242 -139.71250 3.74992 2.09975 -139.63799 538.91587
7495.0000 -144.06928 -139.46306 4.60622 2.14129 -139.01562 583.64927
7500.0000 -143.39914 -139.24345 4.15569 2.13524 -139.10620 576.57505
FREEZING PROCESS: loop number 31 T-loop= 559.00000000000000
main_MD> interactions number 31 at Temperature= 559.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.34667 -2.92123 2.64202
force_rgl> df(natom) 0.73547 1.11692 1.69844
7505.0000 -144.02433 -139.99982 4.02452 2.09872 -139.65348 553.87735
7510.0000 -144.64258 -140.74442 3.89816 2.06199 -140.20377 542.19085
7515.0000 -144.78958 -140.02015 4.76943 2.02525 -140.75432 494.75004
7520.0000 -143.59102 -138.97109 4.61993 2.12542 -139.25334 601.24690
7525.0000 -144.82402 -140.84653 3.97749 2.09917 -139.64669 577.87379
7530.0000 -145.00174 -140.80606 4.19568 2.01295 -140.93859 523.99111
7535.0000 -143.99931 -139.98088 4.01843 2.06207 -140.20256 553.26315
7540.0000 -144.54504 -140.79573 3.74931 2.06273 -140.19264 547.78882
7545.0000 -143.78817 -139.62036 4.16780 2.05397 -140.32403 532.51728
7550.0000 -143.75413 -139.00808 4.74605 2.13338 -139.13403 595.54434
7555.0000 -144.33501 -140.38056 3.95444 2.09888 -139.65099 577.14329
7560.0000 -145.00766 -141.89902 3.10864 2.00205 -141.10188 513.21872
7565.0000 -144.58666 -141.13719 3.44947 1.98846 -141.30550 504.87131
7570.0000 -144.97689 -140.72195 4.25494 2.04693 -140.42949 562.26989
7575.0000 -145.29932 -141.16182 4.13750 2.02040 -140.82702 539.65081
7580.0000 -144.26580 -140.13587 4.12992 2.03215 -140.65090 554.46896
7585.0000 -144.31537 -140.32553 3.98984 2.05560 -140.29950 521.50400
7590.0000 -143.89484 -139.68553 4.20931 2.07474 -140.01278 564.07946
7595.0000 -143.59907 -139.34916 4.24991 2.11738 -139.37387 559.70851
7600.0000 -143.22414 -139.24888 3.97527 2.15298 -138.84036 578.97228
7605.0000 -143.89872 -138.53920 5.35952 2.15965 -138.74051 587.10379
7610.0000 -143.42699 -139.34172 4.08527 2.16240 -138.69926 613.06056
7615.0000 -143.49936 -139.24026 4.25911 2.12559 -139.25086 557.38819
7620.0000 -143.75473 -139.82925 3.92548 2.10654 -139.53623 544.80552
7625.0000 -143.32872 -138.71501 4.61372 2.12485 -139.26185 587.28160
7630.0000 -143.78354 -139.80571 3.97783 2.09488 -139.71099 551.63161
7635.0000 -144.02018 -140.03059 3.98959 2.07560 -139.99979 524.42899
7640.0000 -143.59719 -139.27482 4.32237 2.09727 -139.67515 536.82851
7645.0000 -143.03278 -138.42117 4.61161 2.14765 -138.92022 578.30060
7650.0000 -142.82559 -138.57759 4.24800 2.15679 -138.78337 585.75464
7655.0000 -143.14177 -139.17411 3.96766 2.16254 -138.69715 581.34871
7660.0000 -144.26697 -140.51113 3.75584 2.06555 -140.15042 507.90600
7665.0000 -143.23299 -139.06223 4.17076 2.11374 -139.42838 547.34186
7670.0000 -144.18317 -139.94077 4.24240 2.10353 -139.58134 593.24618
7675.0000 -145.47974 -141.22026 4.25948 1.99216 -141.25011 503.99925
7680.0000 -144.94027 -140.61334 4.32693 2.03183 -140.65572 540.43904
7685.0000 -144.70254 -141.02634 3.67619 2.04831 -140.40882 530.08813
7690.0000 -144.63205 -140.97479 3.65726 1.99806 -141.16167 507.23317
7695.0000 -144.34387 -139.81638 4.52750 2.05066 -140.37354 540.33720
7700.0000 -143.89776 -140.09208 3.80569 2.11913 -139.34765 582.14259
7705.0000 -145.11328 -140.51181 4.60148 2.08872 -139.80326 570.65991
7710.0000 -143.95927 -139.58756 4.37171 2.08493 -139.86009 577.37741
7715.0000 -143.89038 -139.61436 4.27603 2.09876 -139.65277 575.85426
7720.0000 -144.11463 -139.98871 4.12591 2.09919 -139.64634 585.15865
7725.0000 -144.08234 -139.69255 4.38979 2.06669 -140.13329 540.54086
7730.0000 -144.16017 -140.08795 4.07223 2.08242 -139.89769 539.24564
7735.0000 -144.10374 -140.08953 4.01422 2.05117 -140.36592 549.38688
7740.0000 -144.13915 -140.21678 3.92237 2.06799 -140.11392 543.47143
7745.0000 -144.30548 -140.39544 3.91004 2.08735 -139.82374 549.06476
7750.0000 -144.14526 -139.76596 4.37930 2.08892 -139.80035 561.53451
FREEZING PROCESS: loop number 32 T-loop= 534.00000000000000
main_MD> interactions number 32 at Temperature= 534.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.17445 -0.27909 -1.22594
force_rgl> df(natom) -2.03355 1.11303 -1.28607
7755.0000 -143.70436 -139.55777 4.14659 2.09607 -139.69314 551.49459
7760.0000 -143.41308 -138.52375 4.88934 2.15515 -138.80786 589.56531
7765.0000 -143.14067 -138.66269 4.47798 2.19434 -138.22077 636.56083
7770.0000 -143.91208 -139.65428 4.25780 2.13175 -139.15853 568.74419
7775.0000 -143.87097 -139.85648 4.01449 2.09168 -139.75899 568.37509
7780.0000 -144.41193 -139.99958 4.41235 2.06348 -140.18151 517.40002
7785.0000 -144.38113 -140.87724 3.50389 2.05476 -140.31216 533.74604
7790.0000 -144.27849 -140.37898 3.89951 2.04829 -140.40913 526.32818
7795.0000 -144.41193 -140.65459 3.75733 2.03737 -140.57272 519.71721
7800.0000 -143.83819 -140.15474 3.68344 2.04741 -140.42221 522.60831
7805.0000 -144.08244 -140.59086 3.49158 2.03616 -140.59089 516.59843
7810.0000 -144.32310 -140.69119 3.63191 2.02393 -140.77405 501.03320
7815.0000 -143.78178 -139.76473 4.01705 2.05447 -140.31645 534.81343
7820.0000 -144.97867 -141.33037 3.64830 2.08121 -139.91584 551.24294
7825.0000 -143.85371 -140.47513 3.37857 2.05655 -140.28536 505.94096
7830.0000 -144.14698 -139.60642 4.54056 2.07205 -140.05299 533.97981
7835.0000 -143.37599 -139.08500 4.29099 2.09347 -139.73214 546.94774
7840.0000 -144.83388 -140.64425 4.18964 2.11673 -139.38365 599.16851
7845.0000 -144.66937 -141.03143 3.63794 2.02297 -140.78842 517.31433
7850.0000 -144.51956 -139.14735 5.37222 2.07089 -140.07040 579.56919
7855.0000 -144.56712 -140.24472 4.32241 2.08998 -139.78437 569.05678
7860.0000 -144.41786 -140.09127 4.32659 2.04655 -140.43513 555.20732
7865.0000 -145.59632 -141.09520 4.50112 2.04636 -140.43804 538.93534
7870.0000 -144.67898 -140.43227 4.24671 2.02543 -140.75152 541.91027
7875.0000 -143.65336 -139.92552 3.72784 2.07567 -139.99881 579.44670
7880.0000 -144.46924 -140.46769 4.00155 2.05428 -140.31926 559.51675
7885.0000 -144.57142 -140.42142 4.15000 2.06418 -140.17094 551.21793
7890.0000 -144.99652 -141.75338 3.24314 1.99647 -141.18556 477.99668
7895.0000 -144.91920 -141.37270 3.54650 1.94521 -141.95365 453.75111
7900.0000 -145.55180 -142.11468 3.43712 1.97712 -141.47550 494.67677
7905.0000 -144.96350 -140.92637 4.03713 1.96742 -141.62078 487.08261
7910.0000 -144.83544 -141.13908 3.69637 2.02556 -140.74963 537.86211
7915.0000 -144.71549 -141.55494 3.16056 1.99479 -141.21071 523.35448
7920.0000 -144.79436 -141.08773 3.70663 1.99762 -141.16826 531.82815
7925.0000 -145.65862 -141.81836 3.84026 2.01101 -140.96759 544.95214
7930.0000 -145.15940 -141.79197 3.36743 1.96238 -141.69627 499.29208
7935.0000 -145.46071 -141.32074 4.13997 1.95629 -141.78753 499.57763
7940.0000 -146.00245 -141.91506 4.08739 1.97121 -141.56393 520.13244
7945.0000 -145.64682 -141.91412 3.73269 1.94688 -141.92864 489.92283
7950.0000 -144.01806 -140.45697 3.56108 2.00214 -141.10062 514.19149
7955.0000 -144.90242 -140.51487 4.38755 2.04028 -140.52901 543.03340
7960.0000 -144.99483 -140.75015 4.24468 2.01316 -140.93550 552.75424
7965.0000 -146.00421 -141.80541 4.19880 1.97087 -141.56905 506.14309
7970.0000 -145.13976 -141.15856 3.98120 1.98706 -141.32649 508.19794
7975.0000 -145.06068 -141.22046 3.84022 1.97639 -141.48638 512.58119
7980.0000 -145.32718 -141.73565 3.59152 1.97769 -141.46685 523.11616
7985.0000 -144.84845 -140.84198 4.00646 1.99488 -141.20933 532.18681
7990.0000 -144.75462 -140.29430 4.46032 2.04022 -140.53004 544.63880
7995.0000 -144.91087 -140.70688 4.20399 2.03064 -140.67350 545.76006
8000.0000 -145.88202 -141.54959 4.33242 1.98762 -141.31813 533.60325
FREEZING PROCESS: loop number 33 T-loop= 509.00000000000000
main_MD> interactions number 33 at Temperature= 509.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.48697 0.60803 0.21923
force_rgl> df(natom) -0.89745 3.07838 -1.90854
8005.0000 -145.86391 -142.45816 3.40575 1.93849 -142.05429 473.02934
8010.0000 -144.57620 -141.28916 3.28704 1.95967 -141.73696 482.45768
8015.0000 -145.04758 -141.28639 3.76118 1.97488 -141.50901 494.68281
8020.0000 -145.50995 -140.85464 4.65530 1.96928 -141.59292 495.89194
8025.0000 -145.39909 -141.80718 3.59191 1.97535 -141.50201 515.77412
8030.0000 -145.93236 -142.36488 3.56748 1.94482 -141.95939 488.41905
8035.0000 -145.24517 -140.99002 4.25515 1.94035 -142.02641 476.18338
8040.0000 -144.10149 -140.44158 3.65991 2.02351 -140.78039 549.62091
8045.0000 -145.15222 -141.69320 3.45902 1.99433 -141.21751 531.90627
8050.0000 -145.49838 -141.62200 3.87638 2.00492 -141.05886 554.43263
8055.0000 -145.13661 -140.95067 4.18595 1.99122 -141.26414 537.23985
8060.0000 -144.64782 -140.48592 4.16190 2.01229 -140.94843 552.95465
8065.0000 -144.61399 -140.96530 3.64869 2.03068 -140.67290 554.70277
8070.0000 -145.94589 -141.96138 3.98450 1.96657 -141.63348 512.47817
8075.0000 -145.74971 -141.80909 3.94062 1.95713 -141.77497 490.77160
8080.0000 -144.77013 -141.07490 3.69524 1.97883 -141.44980 520.56017
8085.0000 -145.02559 -141.17461 3.85097 2.00655 -141.03453 520.78303
8090.0000 -144.58765 -140.66112 3.92653 2.02383 -140.77553 505.69271
8095.0000 -145.16262 -141.42103 3.74159 1.99502 -141.20723 504.65768
8100.0000 -145.78830 -142.47275 3.31555 1.95200 -141.85190 484.14608
8105.0000 -145.79960 -142.45564 3.34395 1.92930 -142.19193 450.64138
8110.0000 -145.73369 -142.29308 3.44061 1.91179 -142.45435 435.05850
8115.0000 -145.21334 -142.18128 3.03206 1.93566 -142.09671 453.79812
8120.0000 -145.71144 -142.34432 3.36711 1.94979 -141.88491 477.21353
8125.0000 -145.39289 -141.37040 4.02250 1.95285 -141.83916 470.56067
8130.0000 -145.16535 -141.37608 3.78927 1.99730 -141.17307 520.65526
8135.0000 -145.33515 -140.88029 4.45486 1.97068 -141.57197 488.01438
8140.0000 -144.34927 -140.64499 3.70428 2.04510 -140.45680 560.86441
8145.0000 -144.34351 -141.21949 3.12401 2.00421 -141.06954 501.23588
8150.0000 -144.94348 -141.84162 3.10186 1.99686 -141.17963 502.97623
8155.0000 -145.07092 -140.77078 4.30014 1.93903 -142.04613 465.25538
8160.0000 -145.10235 -141.41357 3.68878 2.00051 -141.12495 515.02416
8165.0000 -144.58514 -141.17716 3.40798 1.95829 -141.75763 449.69757
8170.0000 -144.91087 -140.61530 4.29557 2.01771 -140.86734 521.38672
8175.0000 -145.53695 -141.62915 3.90780 1.98812 -141.31065 510.74375
8180.0000 -145.53350 -141.61326 3.92024 1.94665 -141.93199 465.19436
8185.0000 -145.16308 -141.39098 3.77210 1.97327 -141.53311 498.66137
8190.0000 -145.29459 -141.33462 3.95998 1.97218 -141.54951 504.65667
8195.0000 -145.01856 -141.09449 3.92407 2.02830 -140.70855 545.79489
8200.0000 -145.86136 -141.66622 4.19514 1.97486 -141.50937 509.08600
8205.0000 -145.90335 -141.87985 4.02349 1.94661 -141.93266 483.43284
8210.0000 -145.96160 -142.22713 3.73447 1.95094 -141.86772 498.41659
8215.0000 -144.74964 -141.46266 3.28698 1.95264 -141.84233 486.73447
8220.0000 -145.62233 -141.54119 4.08113 1.94371 -141.97608 476.60011
8225.0000 -145.90917 -142.06640 3.84277 1.96935 -141.59190 504.26583
8230.0000 -145.45067 -141.43937 4.01130 1.96310 -141.68554 492.81849
8235.0000 -145.43613 -142.19749 3.23864 1.96416 -141.66965 492.47631
8240.0000 -145.67849 -142.17560 3.50289 1.92869 -142.20107 483.64539
8245.0000 -146.12259 -142.29632 3.82628 1.93307 -142.13545 477.87384
8250.0000 -145.70813 -141.39478 4.31335 1.95200 -141.85188 493.70874
FREEZING PROCESS: loop number 34 T-loop= 484.00000000000000
main_MD> interactions number 34 at Temperature= 484.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.10498 -2.43161 -1.03500
force_rgl> df(natom) 1.69802 0.84012 -0.82628
8255.0000 -145.75957 -141.46031 4.29926 1.97240 -141.54621 530.03510
8260.0000 -145.59405 -141.49751 4.09654 1.99067 -141.27246 562.17433
8265.0000 -146.20453 -142.48891 3.71562 1.93838 -142.05598 512.97373
8270.0000 -145.06676 -141.66119 3.40557 1.93351 -142.12885 497.71823
8275.0000 -145.60036 -141.76869 3.83168 1.96226 -141.69816 518.26371
8280.0000 -145.56144 -142.19680 3.36463 1.92689 -142.22807 492.25825
8285.0000 -146.93874 -143.56246 3.37628 1.87789 -142.96236 454.57716
8290.0000 -145.58369 -142.18604 3.39765 1.88092 -142.91687 455.02996
8295.0000 -145.86224 -142.30748 3.55476 1.90948 -142.48898 482.31907
8300.0000 -145.56159 -142.41620 3.14539 1.94539 -141.95086 511.37134
8305.0000 -146.52037 -143.54943 2.97094 1.89033 -142.77589 467.26534
8310.0000 -146.61049 -142.77989 3.83060 1.84189 -143.50164 422.35732
8315.0000 -146.08641 -142.78406 3.30235 1.88121 -142.91256 460.13425
8320.0000 -145.86012 -142.43269 3.42743 1.92166 -142.30646 497.75142
8325.0000 -146.34894 -142.36568 3.98326 1.91737 -142.37077 494.53731
8330.0000 -145.88359 -141.64477 4.23882 1.93604 -142.09095 509.63365
8335.0000 -146.10312 -141.89408 4.20904 1.98718 -141.32477 528.95864
8340.0000 -146.55870 -142.66324 3.89547 1.92575 -142.24514 504.55293
8345.0000 -146.11318 -142.17991 3.93327 1.92089 -142.31802 493.31224
8350.0000 -145.90703 -142.25792 3.64911 1.93131 -142.16193 495.89083
8355.0000 -146.24376 -142.27002 3.97374 1.92557 -142.24782 498.10421
8360.0000 -146.33765 -141.82473 4.51292 1.95008 -141.88058 522.20452
8365.0000 -145.75198 -141.92743 3.82455 1.96794 -141.61301 534.75310
8370.0000 -145.77566 -141.36566 4.41000 1.96109 -141.71564 530.42041
8375.0000 -146.13494 -142.07712 4.05782 1.93997 -142.03210 513.95891
8380.0000 -145.83231 -142.53964 3.29267 1.91367 -142.42613 488.00127
8385.0000 -146.37643 -142.50153 3.87490 1.89979 -142.63419 478.98637
8390.0000 -145.86142 -142.31425 3.54716 1.92975 -142.18516 497.25914
8395.0000 -146.65068 -142.38777 4.26291 1.90676 -142.52965 481.52554
8400.0000 -146.38030 -143.21445 3.16584 1.88684 -142.82820 457.80132
8405.0000 -146.23762 -142.22931 4.00830 1.90773 -142.51521 481.65327
8410.0000 -145.78750 -141.99679 3.79071 1.95136 -141.86148 517.64056
8415.0000 -145.76827 -142.51991 3.24835 1.90937 -142.49057 478.81309
8420.0000 -145.31526 -141.88422 3.43104 1.95376 -141.82550 523.43244
8425.0000 -146.37947 -142.90232 3.47716 1.92140 -142.31036 494.94631
8430.0000 -146.45579 -142.86683 3.58896 1.88269 -142.89039 460.47494
8435.0000 -146.69019 -143.45290 3.23729 1.86081 -143.21821 448.57505
8440.0000 -146.73290 -142.20318 4.52972 1.88935 -142.79050 465.62763
8445.0000 -146.63327 -142.54059 4.09268 1.92457 -142.26285 501.83136
8450.0000 -145.84026 -141.92479 3.91546 1.90178 -142.60434 478.14864
8455.0000 -144.87707 -141.29067 3.58639 1.96761 -141.61790 537.66067
8460.0000 -145.88999 -142.46841 3.42158 1.96106 -141.71610 526.08499
8465.0000 -146.42169 -143.07573 3.34596 1.88460 -142.86176 460.64236
8470.0000 -146.82444 -143.77822 3.04622 1.85208 -143.34902 427.83579
8475.0000 -146.55706 -142.62779 3.92927 1.87544 -142.99904 452.57835
8480.0000 -145.95029 -142.10455 3.84575 1.93831 -142.05703 496.80280
8485.0000 -145.41621 -141.77167 3.64453 1.95851 -141.75428 522.87105
8490.0000 -144.97726 -140.99655 3.98071 1.97778 -141.46562 518.27079
8495.0000 -145.25606 -140.94417 4.31189 1.98630 -141.33793 479.48516
8500.0000 -144.69094 -140.58256 4.10838 2.04500 -140.45833 516.47053
FREEZING PROCESS: loop number 35 T-loop= 459.00000000000000
main_MD> interactions number 35 at Temperature= 459.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.14617 -2.62695 1.82489
force_rgl> df(natom) 5.21425 -4.03362 3.13730
8505.0000 -145.66211 -141.44420 4.21791 1.98607 -141.34128 496.94164
8510.0000 -145.50579 -142.02083 3.48496 1.96750 -141.61965 497.49673
8515.0000 -145.71416 -142.25594 3.45822 1.88322 -142.88245 442.79181
8520.0000 -145.59927 -142.78642 2.81285 1.89412 -142.71911 458.35800
8525.0000 -145.67356 -142.18215 3.49141 1.89426 -142.71708 440.46148
8530.0000 -145.86618 -141.86958 3.99660 1.95324 -141.83332 507.15094
8535.0000 -145.81707 -142.37524 3.44183 1.94885 -141.89899 488.29024
8540.0000 -146.28076 -142.82889 3.45186 1.89299 -142.73609 447.30589
8545.0000 -145.88321 -142.38360 3.49961 1.91081 -142.46908 469.17066
8550.0000 -146.71385 -143.37101 3.34284 1.89154 -142.75771 451.97002
8555.0000 -146.21058 -143.11848 3.09210 1.88685 -142.82796 441.93905
8560.0000 -145.50793 -142.04264 3.46529 1.90891 -142.49750 463.36236
8565.0000 -144.66111 -141.23864 3.42248 1.96568 -141.64693 467.62325
8570.0000 -145.66197 -141.92102 3.74095 1.94960 -141.88779 473.69195
8575.0000 -145.37794 -141.86964 3.50830 1.95352 -141.82905 484.66856
8580.0000 -145.64204 -142.36508 3.27697 1.92887 -142.19837 472.07745
8585.0000 -145.79507 -141.62662 4.16845 1.93111 -142.16482 471.38091
8590.0000 -145.25592 -141.81204 3.44388 1.97272 -141.54137 522.59875
8595.0000 -145.99277 -142.25255 3.74022 1.95722 -141.77359 486.33929
8600.0000 -146.29166 -142.86236 3.42930 1.89362 -142.72665 445.08009
8605.0000 -145.68835 -142.17310 3.51524 1.89588 -142.69274 442.66901
8610.0000 -145.15319 -141.65997 3.49321 1.94809 -141.91042 487.61071
8615.0000 -145.93634 -142.68692 3.24943 1.91924 -142.34273 468.32339
8620.0000 -145.75558 -142.70680 3.04878 1.89111 -142.76423 445.75210
8625.0000 -146.43230 -143.10042 3.33189 1.89720 -142.67293 439.96793
8630.0000 -145.75904 -142.38526 3.37378 1.90472 -142.56032 458.17640
8635.0000 -146.08020 -142.77654 3.30366 1.90513 -142.55409 458.90696
8640.0000 -146.67881 -143.45109 3.22771 1.85098 -143.36546 403.85335
8645.0000 -146.42708 -143.06287 3.36421 1.85448 -143.31308 397.82690
8650.0000 -146.02605 -143.29796 2.72809 1.84316 -143.48270 399.97046
8655.0000 -146.19224 -143.15235 3.03989 1.85540 -143.29930 402.58784
8660.0000 -146.87049 -143.13300 3.73749 1.89273 -142.73996 438.82384
8665.0000 -146.65821 -144.07047 2.58773 1.86091 -143.21677 424.02191
8670.0000 -145.94916 -142.22870 3.72046 1.88765 -142.81605 445.55692
8675.0000 -146.24930 -142.39933 3.84997 1.91315 -142.43393 457.35295
8680.0000 -145.95372 -142.35922 3.59451 1.93905 -142.04586 481.53230
8685.0000 -145.81429 -142.27868 3.53562 1.91817 -142.35871 475.33041
8690.0000 -146.18274 -143.01693 3.16581 1.91011 -142.47949 453.53660
8695.0000 -145.90246 -142.48800 3.41446 1.92458 -142.26267 460.63960
8700.0000 -145.39119 -141.87105 3.52015 1.91318 -142.43345 453.59447
8705.0000 -145.64100 -142.68632 2.95467 1.92465 -142.26168 466.41615
8710.0000 -146.03753 -143.06553 2.97200 1.87630 -142.98614 415.85540
8715.0000 -145.85588 -142.58134 3.27454 1.91285 -142.43840 442.76553
8720.0000 -145.66174 -142.07388 3.58785 1.92081 -142.31922 459.59490
8725.0000 -145.89190 -142.73784 3.15406 1.93618 -142.08883 478.48336
8730.0000 -145.98975 -142.11461 3.87513 1.91718 -142.37357 453.77577
8735.0000 -144.81160 -141.35340 3.45820 1.96346 -141.68019 508.18078
8740.0000 -145.20837 -141.98561 3.22276 1.94244 -141.99504 495.89679
8745.0000 -144.22349 -140.85821 3.36528 1.99378 -141.22575 514.12833
8750.0000 -145.77027 -142.27161 3.49866 1.94473 -141.96074 482.94224
FREEZING PROCESS: loop number 36 T-loop= 434.00000000000000
main_MD> interactions number 36 at Temperature= 434.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 3.13966 4.72298 -1.46746
force_rgl> df(natom) 0.31955 0.99921 0.56823
8755.0000 -145.99343 -142.32439 3.66904 1.94440 -141.96578 478.54116
8760.0000 -145.71383 -142.02660 3.68723 1.91785 -142.36351 455.50951
8765.0000 -145.95734 -142.68777 3.26956 1.93011 -142.17983 468.59066
8770.0000 -146.73683 -144.06025 2.67658 1.84621 -143.43703 397.06138
8775.0000 -146.65275 -142.47367 4.17909 1.83306 -143.63395 399.77837
8780.0000 -146.45185 -142.61205 3.83981 1.92527 -142.25233 482.90670
8785.0000 -146.60699 -143.94952 2.65747 1.85783 -143.26287 422.50075
8790.0000 -146.84976 -143.33301 3.51675 1.83103 -143.66444 418.28021
8795.0000 -146.23603 -142.86757 3.36846 1.87358 -143.02690 450.71440
8800.0000 -146.35097 -143.19706 3.15391 1.86937 -143.08996 436.38839
8805.0000 -145.88946 -142.78786 3.10160 1.86031 -143.22570 440.08309
8810.0000 -146.89839 -143.42415 3.47423 1.82871 -143.69913 414.39982
8815.0000 -146.13232 -142.69075 3.44157 1.88241 -142.89457 459.09694
8820.0000 -145.75476 -142.43674 3.31802 1.92886 -142.19854 480.37241
8825.0000 -145.90783 -142.44691 3.46091 1.90942 -142.48979 473.41634
8830.0000 -145.34770 -142.51491 2.83279 1.92235 -142.29604 479.65435
8835.0000 -146.64107 -143.28890 3.35216 1.88567 -142.84566 439.58337
8840.0000 -146.35724 -142.08325 4.27398 1.88935 -142.79051 434.34691
8845.0000 -147.09518 -143.61542 3.47977 1.89036 -142.77549 438.36693
8850.0000 -146.72106 -142.99115 3.72991 1.85389 -143.32186 407.92711
8855.0000 -146.00288 -143.16465 2.83824 1.85379 -143.32333 405.64900
8860.0000 -146.14644 -143.48052 2.66592 1.87495 -143.00634 432.79036
8865.0000 -146.25633 -142.83434 3.42199 1.86893 -143.09658 432.92557
8870.0000 -145.59208 -142.40165 3.19043 1.86967 -143.08544 418.74439
8875.0000 -144.96464 -142.00725 2.95740 1.93245 -142.14474 440.37925
8880.0000 -145.15989 -141.98425 3.17564 1.93231 -142.14688 439.08586
8885.0000 -145.71489 -142.28278 3.43212 1.91926 -142.34239 427.94650
8890.0000 -145.28051 -142.43331 2.84720 1.94618 -141.93907 450.52114
8895.0000 -145.63931 -141.82555 3.81376 1.93432 -142.11671 447.95039
8900.0000 -146.03604 -142.79942 3.23662 1.91937 -142.34078 462.54443
8905.0000 -145.56137 -141.93126 3.63011 1.93189 -142.15310 466.77461
8910.0000 -145.87902 -142.00281 3.87621 1.92971 -142.18576 471.47084
8915.0000 -146.96813 -143.17753 3.79060 1.89137 -142.76029 436.03313
8920.0000 -146.12700 -142.83656 3.29044 1.87945 -142.93897 429.07475
8925.0000 -146.27816 -143.35031 2.92785 1.88162 -142.90635 423.52508
8930.0000 -145.91234 -142.30957 3.60276 1.88872 -142.80006 430.71549
8935.0000 -145.97706 -142.68530 3.29176 1.88636 -142.83531 424.94081
8940.0000 -145.99991 -142.66901 3.33089 1.89959 -142.63710 437.51304
8945.0000 -145.53823 -142.08682 3.45141 1.90342 -142.57981 441.37711
8950.0000 -145.87368 -141.89122 3.98245 1.91518 -142.40360 448.97702
8955.0000 -145.91030 -142.78410 3.12620 1.92981 -142.18426 471.03243
8960.0000 -146.19865 -142.84560 3.35305 1.89940 -142.63999 442.29177
8965.0000 -145.62802 -142.43067 3.19735 1.89570 -142.69538 446.64324
8970.0000 -146.02559 -142.36537 3.66022 1.90218 -142.59834 458.22723
8975.0000 -146.55071 -143.05873 3.49198 1.89971 -142.63541 451.64736
8980.0000 -146.34623 -143.20177 3.14446 1.86634 -143.13535 426.38822
8985.0000 -146.05768 -143.05834 2.99934 1.85572 -143.29454 401.79196
8990.0000 -145.63973 -142.55129 3.08844 1.87274 -143.03943 424.08067
8995.0000 -145.89724 -142.27643 3.62081 1.93419 -142.11866 465.18740
9000.0000 -146.00600 -142.66258 3.34343 1.91754 -142.36819 450.46607
FREEZING PROCESS: loop number 37 T-loop= 409.00000000000000
main_MD> interactions number 37 at Temperature= 409.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.87765 -0.54136 -0.28781
force_rgl> df(natom) 0.88374 -0.08151 0.26113
9005.0000 -146.21827 -143.92336 2.29491 1.87345 -143.02888 426.85637
9010.0000 -146.49443 -142.83951 3.65492 1.85178 -143.35351 407.20230
9015.0000 -146.82612 -143.99455 2.83157 1.84979 -143.38334 406.69064
9020.0000 -146.36785 -143.75828 2.60957 1.81387 -143.92150 370.75059
9025.0000 -146.94169 -143.26548 3.67621 1.84640 -143.43415 405.73025
9030.0000 -146.50915 -143.96749 2.54166 1.83665 -143.58027 401.34363
9035.0000 -146.16331 -143.31053 2.85278 1.85719 -143.27246 401.70773
9040.0000 -145.66508 -142.90895 2.75613 1.86775 -143.11428 409.55270
9045.0000 -146.85466 -144.10914 2.74552 1.81684 -143.87707 371.57777
9050.0000 -146.30633 -143.14805 3.15828 1.82969 -143.68449 386.88083
9055.0000 -145.82691 -142.70500 3.12191 1.89288 -142.73764 433.79745
9060.0000 -146.59216 -143.35483 3.23733 1.86914 -143.09335 420.18945
9065.0000 -146.52309 -143.72735 2.79574 1.84777 -143.41354 404.83775
9070.0000 -146.10116 -142.88868 3.21248 1.85009 -143.37877 401.06567
9075.0000 -146.98256 -144.01169 2.97087 1.83378 -143.62318 388.38377
9080.0000 -146.79012 -144.09456 2.69557 1.81064 -143.96999 376.90528
9085.0000 -146.15593 -143.29456 2.86138 1.82495 -143.75552 381.80665
9090.0000 -146.81495 -143.53024 3.28470 1.85885 -143.24757 402.69145
9095.0000 -146.14620 -142.39890 3.74730 1.87654 -142.98251 438.25908
9100.0000 -146.91554 -143.64251 3.27303 1.86366 -143.17555 422.61923
9105.0000 -146.38022 -143.60875 2.77147 1.86283 -143.18800 435.65157
9110.0000 -146.21119 -142.58647 3.62471 1.88383 -142.87324 437.88398
9115.0000 -146.12950 -142.57307 3.55643 1.87085 -143.06783 423.20237
9120.0000 -146.36106 -143.65055 2.71051 1.85033 -143.37516 413.24021
9125.0000 -146.86451 -143.64423 3.22028 1.82855 -143.70159 390.65377
9130.0000 -146.79801 -144.11384 2.68417 1.81812 -143.85779 384.14898
9135.0000 -147.00375 -143.68664 3.31711 1.82253 -143.79181 391.84271
9140.0000 -146.72163 -144.16879 2.55284 1.82537 -143.74928 392.26734
9145.0000 -147.47761 -144.68672 2.79088 1.77138 -144.55814 363.71938
9150.0000 -147.34144 -144.48820 2.85324 1.78715 -144.32186 374.31759
9155.0000 -147.13339 -143.45929 3.67410 1.84799 -143.41035 431.05801
9160.0000 -146.52053 -143.69172 2.82880 1.83383 -143.62254 414.52825
9165.0000 -146.65368 -143.73972 2.91396 1.81224 -143.94592 392.08754
9170.0000 -146.65659 -144.13993 2.51667 1.80917 -143.99197 394.94315
9175.0000 -146.68545 -143.42625 3.25920 1.81224 -143.94595 396.09642
9180.0000 -147.61754 -144.41885 3.19869 1.81108 -143.96335 397.54068
9185.0000 -147.11248 -143.70516 3.40732 1.80774 -144.01346 394.77889
9190.0000 -147.35463 -144.30495 3.04968 1.79067 -144.26922 379.33408
9195.0000 -145.32571 -143.12349 2.20222 1.82408 -143.76848 408.14272
9200.0000 -146.83415 -143.39728 3.43687 1.83260 -143.64091 412.28501
9205.0000 -146.60843 -143.85500 2.75343 1.80921 -143.99139 397.08811
9210.0000 -147.38139 -144.55106 2.83033 1.80241 -144.09326 390.79815
9215.0000 -147.38634 -144.89417 2.49218 1.78810 -144.30760 373.29491
9220.0000 -147.45721 -144.21506 3.24214 1.77061 -144.56976 355.38172
9225.0000 -147.58285 -144.63895 2.94390 1.76984 -144.58130 356.80400
9230.0000 -146.79824 -144.10957 2.68868 1.79187 -144.25120 375.79485
9235.0000 -146.41167 -142.91914 3.49253 1.81806 -143.85876 399.60820
9240.0000 -146.17929 -143.62904 2.55025 1.84979 -143.38335 424.29896
9245.0000 -146.98725 -143.86458 3.12267 1.81584 -143.89207 396.84255
9250.0000 -147.10921 -143.45734 3.65186 1.82439 -143.76398 405.49023
FREEZING PROCESS: loop number 38 T-loop= 384.00000000000000
main_MD> interactions number 38 at Temperature= 384.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.32819 0.25007 2.25006
force_rgl> df(natom) 0.54788 -0.37675 -0.30628
9255.0000 -146.44782 -143.56669 2.88113 1.83731 -143.57030 418.77737
9260.0000 -146.26773 -143.61519 2.65254 1.80449 -144.06212 387.09925
9265.0000 -146.35564 -142.28706 4.06858 1.85656 -143.28182 411.45012
9270.0000 -147.01870 -143.71563 3.30308 1.86604 -143.13980 419.88775
9275.0000 -146.96150 -143.35383 3.60767 1.84254 -143.49190 394.08937
9280.0000 -146.68865 -144.02209 2.66655 1.84523 -143.45166 397.80758
9285.0000 -147.00611 -144.56537 2.44074 1.79960 -144.13536 354.71212
9290.0000 -146.87186 -143.86002 3.01184 1.79178 -144.25246 347.65438
9295.0000 -146.68012 -143.62531 3.05480 1.82436 -143.76432 376.80756
9300.0000 -146.75857 -143.94174 2.81683 1.82923 -143.69141 378.80850
9305.0000 -146.83299 -144.57352 2.25948 1.80193 -144.10044 359.61710
9310.0000 -147.23691 -144.65461 2.58230 1.79107 -144.26321 347.18921
9315.0000 -146.84233 -144.66424 2.17809 1.76222 -144.69546 327.85950
9320.0000 -146.50196 -144.07166 2.43031 1.79739 -144.16844 359.74292
9325.0000 -146.74489 -143.75409 2.99080 1.81004 -143.97897 367.60808
9330.0000 -146.28895 -143.27123 3.01772 1.85529 -143.30086 413.94667
9335.0000 -146.06202 -142.79423 3.26778 1.84887 -143.39705 396.91823
9340.0000 -146.75248 -143.82295 2.92953 1.84895 -143.39591 413.43573
9345.0000 -146.61925 -143.93020 2.68905 1.83122 -143.66158 392.53515
9350.0000 -146.73244 -143.99165 2.74079 1.80284 -144.08685 369.82256
9355.0000 -146.76429 -144.14049 2.62380 1.79741 -144.16815 350.69620
9360.0000 -146.95509 -143.74191 3.21318 1.81820 -143.85669 380.59146
9365.0000 -146.69384 -144.21679 2.47705 1.81491 -143.90591 379.45946
9370.0000 -146.67019 -143.74028 2.92991 1.81929 -143.84026 380.95675
9375.0000 -147.14737 -144.15800 2.98937 1.79103 -144.26375 358.71848
9380.0000 -146.91454 -144.11763 2.79691 1.80456 -144.06098 364.22275
9385.0000 -146.54724 -144.04590 2.50134 1.82171 -143.80400 383.75971
9390.0000 -146.95664 -143.91801 3.03864 1.81869 -143.84935 387.24695
9395.0000 -146.81149 -144.04645 2.76504 1.80437 -144.06392 372.64238
9400.0000 -147.03943 -144.01782 3.02161 1.80645 -144.03266 374.03823
9405.0000 -146.62861 -144.02265 2.60595 1.81604 -143.88901 378.09202
9410.0000 -147.30851 -145.22389 2.08462 1.75482 -144.80638 317.93897
9415.0000 -146.96409 -144.68509 2.27900 1.75871 -144.74799 330.95395
9420.0000 -146.32468 -143.97879 2.34589 1.78884 -144.29660 359.10914
9425.0000 -146.15345 -143.16457 2.98888 1.83765 -143.56516 397.43737
9430.0000 -146.90327 -144.34331 2.55996 1.84369 -143.47475 402.25236
9435.0000 -147.14675 -144.55305 2.59369 1.79516 -144.20188 362.92535
9440.0000 -147.14292 -144.09191 3.05101 1.79233 -144.24436 377.05181
9445.0000 -147.44269 -144.00328 3.43941 1.80096 -144.11498 386.12938
9450.0000 -146.53693 -144.17642 2.36051 1.80699 -144.02468 392.01253
9455.0000 -147.09527 -144.11198 2.98329 1.79078 -144.26756 378.36252
9460.0000 -147.13191 -144.24555 2.88636 1.80571 -144.04388 390.46072
9465.0000 -146.59193 -143.86899 2.72294 1.79642 -144.18307 383.79990
9470.0000 -147.09487 -144.00871 3.08616 1.81950 -143.83711 405.41291
9475.0000 -147.39246 -144.37121 3.02125 1.79552 -144.19643 379.08010
9480.0000 -147.15314 -144.51138 2.64177 1.76831 -144.60417 353.61493
9485.0000 -146.78563 -144.04334 2.74229 1.80342 -144.07817 394.90258
9490.0000 -147.08904 -144.33346 2.75558 1.77772 -144.46324 367.86684
9495.0000 -147.59703 -144.73870 2.85834 1.78384 -144.37149 369.29873
9500.0000 -146.94913 -144.39333 2.55580 1.78952 -144.28639 377.49649
FREEZING PROCESS: loop number 39 T-loop= 359.00000000000000
main_MD> interactions number 39 at Temperature= 359.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.75516 -0.86456 -0.32335
force_rgl> df(natom) 0.40620 -0.49948 0.84527
9505.0000 -147.09981 -144.41384 2.68597 1.77355 -144.52565 361.99446
9510.0000 -147.39798 -144.69262 2.70536 1.76862 -144.59952 355.20246
9515.0000 -147.26620 -144.68055 2.58566 1.76621 -144.63560 354.12975
9520.0000 -146.83499 -144.20151 2.63348 1.77588 -144.49084 362.40270
9525.0000 -146.85182 -144.91881 1.93301 1.76489 -144.65538 349.14871
9530.0000 -147.28307 -144.48856 2.79451 1.75197 -144.84906 340.55831
9535.0000 -147.50703 -144.94556 2.56147 1.76422 -144.66547 353.61467
9540.0000 -146.96884 -144.37510 2.59375 1.77658 -144.48026 368.32412
9545.0000 -147.54125 -144.89189 2.64936 1.74170 -145.00297 330.29602
9550.0000 -146.98577 -144.76599 2.21978 1.74494 -144.95430 334.88170
9555.0000 -146.64271 -143.93453 2.70818 1.79072 -144.26841 375.79150
9560.0000 -147.01817 -144.49988 2.51829 1.79700 -144.17438 384.92077
9565.0000 -147.33834 -144.48470 2.85364 1.76407 -144.66773 351.83561
9570.0000 -147.07987 -144.47105 2.60882 1.79171 -144.25352 380.06252
9575.0000 -146.94338 -144.03420 2.90918 1.78797 -144.30958 373.79586
9580.0000 -147.58665 -144.93942 2.64723 1.77215 -144.54665 358.52903
9585.0000 -147.26251 -144.26216 3.00035 1.77695 -144.47472 363.58775
9590.0000 -147.49559 -144.94371 2.55188 1.79555 -144.19608 378.76814
9595.0000 -147.02934 -144.74985 2.27948 1.74464 -144.95894 333.69071
9600.0000 -147.69958 -145.12101 2.57856 1.75441 -144.81245 344.26408
9605.0000 -147.40487 -144.57128 2.83359 1.77747 -144.46702 361.83500
9610.0000 -147.85010 -144.99442 2.85568 1.73580 -145.09134 327.75229
9615.0000 -147.71353 -144.64397 3.06956 1.75152 -144.85573 339.53502
9620.0000 -147.18566 -144.24518 2.94048 1.79131 -144.25959 382.15934
9625.0000 -146.91857 -143.93564 2.98293 1.79101 -144.26403 377.42309
9630.0000 -146.95729 -143.84927 3.10802 1.81219 -143.94677 398.45700
9635.0000 -146.36805 -143.80206 2.56599 1.80745 -144.01773 389.77834
9640.0000 -146.25119 -143.53157 2.71962 1.84641 -143.43402 427.25527
9645.0000 -146.91328 -143.78712 3.12616 1.82702 -143.72445 407.75979
9650.0000 -147.26641 -144.89885 2.36756 1.80149 -144.10710 381.88289
9655.0000 -147.14094 -144.77169 2.36925 1.74823 -144.90503 336.50911
9660.0000 -147.49008 -144.71094 2.77914 1.74299 -144.98361 334.49002
9665.0000 -147.52272 -144.89175 2.63097 1.77495 -144.50465 357.91992
9670.0000 -147.34907 -144.54593 2.80314 1.75941 -144.73749 345.75431
9675.0000 -147.26052 -144.67475 2.58577 1.75160 -144.85465 340.84240
9680.0000 -147.21314 -144.15382 3.05933 1.75875 -144.74746 350.40749
9685.0000 -146.89832 -144.10243 2.79589 1.78915 -144.29197 371.61276
9690.0000 -147.44521 -144.47762 2.96759 1.77982 -144.43174 366.24362
9695.0000 -146.99929 -144.50162 2.49767 1.77461 -144.50982 361.40070
9700.0000 -146.72137 -143.92175 2.79961 1.78067 -144.41899 365.45802
9705.0000 -147.44490 -145.17129 2.27361 1.77349 -144.52661 360.16698
9710.0000 -147.00465 -144.72498 2.27967 1.74733 -144.91854 335.87506
9715.0000 -147.40843 -144.91513 2.49330 1.77611 -144.48726 363.62685
9720.0000 -147.57593 -144.97034 2.60559 1.75920 -144.74069 346.68914
9725.0000 -147.21389 -144.58095 2.63294 1.75851 -144.75108 349.45977
9730.0000 -147.60079 -144.72309 2.87770 1.76046 -144.72184 348.08416
9735.0000 -147.51707 -144.92995 2.58711 1.74845 -144.90174 337.10220
9740.0000 -147.64975 -144.84839 2.80136 1.77223 -144.54553 358.66057
9745.0000 -147.66254 -145.48266 2.17988 1.72958 -145.18449 322.74069
9750.0000 -147.07293 -144.57014 2.50279 1.74313 -144.98153 333.43397
FREEZING PROCESS: loop number 40 T-loop= 334.00000000000000
main_MD> interactions number 40 at Temperature= 334.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.92187 2.76040 -0.34440
force_rgl> df(natom) -0.85084 -1.08773 -0.33353
9755.0000 -147.33297 -145.15790 2.17508 1.75317 -144.83102 340.10187
9760.0000 -147.90179 -145.02923 2.87256 1.74291 -144.98479 332.48997
9765.0000 -146.85326 -144.07628 2.77699 1.76431 -144.66415 351.64214
9770.0000 -146.73231 -143.85788 2.87443 1.79542 -144.19797 379.95422
9775.0000 -147.79341 -145.19233 2.60108 1.75596 -144.78924 342.64646
9780.0000 -147.97430 -145.72375 2.25055 1.69884 -145.64518 291.13596
9785.0000 -147.61008 -145.42843 2.18166 1.71411 -145.41624 305.07278
9790.0000 -147.58131 -145.10185 2.47945 1.73044 -145.17162 319.07605
9795.0000 -147.15326 -144.22776 2.92549 1.77578 -144.49226 360.90227
9800.0000 -147.63446 -144.99094 2.64352 1.77414 -144.51677 358.43400
9805.0000 -147.35867 -145.00558 2.35309 1.73418 -145.11554 324.54088
9810.0000 -147.50538 -144.99524 2.51014 1.76308 -144.68252 347.58131
9815.0000 -147.33271 -145.25903 2.07369 1.73266 -145.13841 324.12578
9820.0000 -147.45517 -144.62303 2.83214 1.73967 -145.03329 327.48240
9825.0000 -147.56338 -145.19918 2.36420 1.74106 -145.01258 330.66164
9830.0000 -147.28465 -144.60896 2.67569 1.74853 -144.90062 330.96398
9835.0000 -147.62865 -144.76525 2.86339 1.76911 -144.59215 345.19283
9840.0000 -147.25008 -144.48488 2.76521 1.75122 -144.86034 318.51645
9845.0000 -147.58660 -145.31551 2.27109 1.75410 -144.81719 321.64360
9850.0000 -146.90444 -144.14709 2.75736 1.76838 -144.60311 345.53559
9855.0000 -146.61897 -144.21995 2.39902 1.80301 -144.08423 366.71555
9860.0000 -147.10503 -144.23024 2.87478 1.80910 -143.99299 372.05743
9865.0000 -147.41898 -144.68637 2.73261 1.77679 -144.47710 343.27823
9870.0000 -146.70317 -144.26379 2.43938 1.77931 -144.43936 337.31194
9875.0000 -147.34805 -144.51735 2.83070 1.78073 -144.41813 338.20094
9880.0000 -146.62840 -144.22150 2.40690 1.80484 -144.05688 357.81997
9885.0000 -147.24471 -144.47428 2.77043 1.77115 -144.56164 326.48342
9890.0000 -147.26329 -144.65524 2.60805 1.78082 -144.41682 349.25064
9895.0000 -146.64846 -144.59088 2.05758 1.79057 -144.27059 356.87141
9900.0000 -146.89417 -144.50109 2.39307 1.78415 -144.36687 341.13517
9905.0000 -147.16261 -144.82295 2.33966 1.74254 -144.99030 302.51760
9910.0000 -147.45054 -144.68058 2.76996 1.74322 -144.98021 303.18582
9915.0000 -147.38341 -145.15514 2.22827 1.75075 -144.86731 316.12763
9920.0000 -147.27149 -144.64320 2.62829 1.73770 -145.06291 301.04034
9925.0000 -147.05409 -145.03076 2.02333 1.74312 -144.98171 303.27134
9930.0000 -147.58137 -144.89701 2.68436 1.76208 -144.69761 322.98557
9935.0000 -146.99780 -144.04393 2.95387 1.76722 -144.62050 334.26821
9940.0000 -147.08199 -144.12186 2.96013 1.80370 -144.07389 365.09437
9945.0000 -147.16846 -144.76648 2.40198 1.77137 -144.55834 341.92061
9950.0000 -147.02433 -143.96428 3.06005 1.78613 -144.33719 353.84040
9955.0000 -146.77924 -144.01603 2.76322 1.79611 -144.18770 363.24827
9960.0000 -146.51639 -143.79379 2.72260 1.81029 -143.97514 373.65615
9965.0000 -147.17377 -144.34380 2.82997 1.79760 -144.16530 355.77129
9970.0000 -147.24669 -144.68048 2.56621 1.76643 -144.63240 334.19484
9975.0000 -147.16576 -144.26988 2.89589 1.77723 -144.47050 354.22918
9980.0000 -146.66915 -144.52181 2.14734 1.78189 -144.40079 352.57519
9985.0000 -146.38810 -143.83000 2.55810 1.79093 -144.26522 358.16654
9990.0000 -147.22597 -144.91323 2.31274 1.77752 -144.46626 343.51111
9995.0000 -147.07022 -144.62692 2.44330 1.75683 -144.77622 326.37675
10000.0000 -146.74200 -144.33677 2.40523 1.76067 -144.71861 333.13439
FREEZING PROCESS: loop number 41 T-loop= 309.00000000000000
main_MD> interactions number 41 at Temperature= 309.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.61087 0.04387 0.23409
force_rgl> df(natom) -1.29961 2.56441 -0.03213
10005.0000 -147.68426 -145.66328 2.02099 1.72832 -145.20342 300.14334
10010.0000 -147.25873 -144.34971 2.90902 1.73328 -145.12907 307.11790
10015.0000 -147.49314 -144.71261 2.78054 1.77581 -144.49180 344.80441
10020.0000 -147.10198 -144.49908 2.60290 1.75924 -144.74005 333.06614
10025.0000 -147.03129 -144.49994 2.53134 1.75458 -144.80987 328.47209
10030.0000 -147.00256 -144.64966 2.35290 1.76359 -144.67485 335.27865
10035.0000 -147.56810 -145.47928 2.08882 1.73687 -145.07525 305.42716
10040.0000 -147.45732 -145.31643 2.14089 1.71001 -145.47780 284.91764
10045.0000 -147.42015 -145.29434 2.12581 1.72416 -145.26571 300.61460
10050.0000 -147.85745 -145.57841 2.27903 1.71937 -145.33751 299.01245
10055.0000 -147.26474 -144.99059 2.27415 1.72842 -145.20189 298.21993
10060.0000 -147.08072 -144.74167 2.33906 1.74155 -145.00511 304.97371
10065.0000 -147.31230 -145.23625 2.07605 1.73669 -145.07801 296.64173
10070.0000 -147.61956 -144.82822 2.79134 1.72200 -145.29812 285.61774
10075.0000 -147.02190 -144.41598 2.60592 1.77239 -144.54311 342.73684
10080.0000 -147.34666 -145.16616 2.18050 1.74899 -144.89364 327.87745
10085.0000 -147.43374 -145.06961 2.36414 1.75537 -144.79813 324.61827
10090.0000 -147.69988 -145.56455 2.13533 1.72350 -145.27563 295.74403
10095.0000 -147.88796 -145.72344 2.16452 1.72121 -145.30990 297.60286
10100.0000 -147.26926 -144.76294 2.50632 1.71257 -145.43936 286.88732
10105.0000 -147.64426 -145.21905 2.42520 1.73718 -145.07067 308.08699
10110.0000 -147.47807 -145.11560 2.36247 1.72317 -145.28052 295.21811
10115.0000 -147.32904 -144.56378 2.76525 1.74763 -144.91406 322.33222
10120.0000 -147.47956 -144.90497 2.57459 1.76597 -144.63928 336.89142
10125.0000 -147.83585 -145.65012 2.18573 1.73018 -145.17558 301.67445
10130.0000 -147.36967 -145.26749 2.10219 1.71435 -145.41268 283.08510
10135.0000 -147.58407 -145.22457 2.35949 1.71575 -145.39173 288.18213
10140.0000 -147.28251 -145.02688 2.25563 1.73129 -145.15895 302.85233
10145.0000 -147.63594 -144.71833 2.91761 1.72617 -145.23564 301.50009
10150.0000 -147.26866 -144.80795 2.46071 1.76927 -144.58989 337.77617
10155.0000 -147.24307 -144.92042 2.32265 1.74527 -144.94936 308.99410
10160.0000 -147.24383 -144.60634 2.63750 1.74930 -144.88897 315.36518
10165.0000 -147.11530 -144.69317 2.42213 1.77564 -144.49432 344.59431
10170.0000 -147.23362 -145.05401 2.17961 1.76048 -144.72155 329.25013
10175.0000 -147.54930 -145.75987 1.78944 1.72677 -145.22665 301.04914
10180.0000 -147.20337 -144.71539 2.48798 1.73648 -145.08116 314.82553
10185.0000 -147.11209 -145.15121 1.96089 1.76632 -144.63401 338.45362
10190.0000 -147.81758 -145.60253 2.21505 1.70884 -145.49535 275.00957
10195.0000 -147.58702 -145.58249 2.00453 1.69198 -145.74785 268.17844
10200.0000 -147.58518 -145.35857 2.22661 1.71962 -145.33369 294.25786
10205.0000 -146.90676 -144.66019 2.24657 1.74192 -144.99956 312.22426
10210.0000 -147.66518 -145.42044 2.24473 1.74282 -144.98615 303.14255
10215.0000 -147.56960 -145.34730 2.22230 1.72382 -145.27088 287.27230
10220.0000 -147.08817 -144.90918 2.17900 1.75933 -144.73874 325.85400
10225.0000 -147.01207 -144.32312 2.68895 1.77027 -144.57483 333.58897
10230.0000 -146.67422 -144.39765 2.27657 1.77803 -144.45850 347.57011
10235.0000 -147.77266 -145.26262 2.51004 1.73915 -145.04107 311.84405
10240.0000 -147.82808 -145.48117 2.34691 1.70201 -145.59759 273.87210
10245.0000 -147.03045 -144.99767 2.03278 1.73215 -145.14596 305.88635
10250.0000 -147.57607 -145.02931 2.54675 1.73264 -145.13868 303.94375
main_MD> EXECUTION TIME: 0 [day], 0 [hour], 13 [min], 28.1721037 [s].
main_MD> Deallocating global variables
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