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nanoparticlesims/growth_Melting_Silver_ICO_2451/freezeSims/run_30/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_30.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 = 30 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: 30 3000
main_MD> Size of nv and nvoiz: 30 3000
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 = 30
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> 4.9230739144486314E-003 -0.17052169624685737 -0.14880971728716047 initial drift of cluster / NP1 for coalescence
init> 0.33514848706663269 0.36954856829248933 0.34522901806361689 scaling for velocity /for coalescence NP1
init.f90 > facguy = 3.9404553532561950E-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) -2.61912 2.81065 -3.15535
force_rgl> df(natom) 1.12886 -1.38186 -2.45754
preparo> THERMALIZATION PROCESS AT 1350.9833038151460
preparo> TOTAL ENERGY, KINETIC EN., POT. ENERGY, DELTA
5000 -60.093956766705887 4.4154086600161850 -64.509365426722070 6.6058504188063480E-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= 1322.0000000000000
main_MD> interactions number 1 at Temperature= 1322.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -2.17184 -7.90682 -4.69835
force_rgl> df(natom) 0.48309 -0.89147 3.58163
5.0000 -66.08269 -61.69749 4.38520 2.88854 -60.61148 1357.46025
10.0000 -67.36141 -62.68627 4.67514 2.66355 -62.78372 1240.47177
15.0000 -66.84770 -62.70416 4.14354 2.59692 -63.42701 1129.76669
20.0000 -67.02625 -62.16127 4.86499 2.66445 -62.77502 1180.70210
25.0000 -66.68730 -60.69631 5.99099 2.83657 -61.11322 1395.25953
30.0000 -66.64921 -60.87890 5.77030 2.85270 -60.95750 1339.24178
35.0000 -67.28870 -61.39324 5.89546 2.81430 -61.32824 1419.17408
40.0000 -65.47861 -59.89402 5.58459 2.89644 -60.53516 1415.28554
45.0000 -68.06823 -61.76951 6.29872 2.84952 -60.98816 1336.26351
50.0000 -66.69857 -62.60899 4.08958 2.69813 -62.44987 1259.36841
55.0000 -66.75486 -61.91703 4.83783 2.75448 -61.90575 1221.14982
60.0000 -66.24757 -62.14781 4.09976 2.83053 -61.17151 1387.92463
65.0000 -68.18439 -63.82328 4.36111 2.55627 -63.81951 1100.47880
70.0000 -67.82100 -63.87435 3.94664 2.59150 -63.47931 1112.68064
75.0000 -68.42943 -63.46400 4.96543 2.60352 -63.36333 1111.06655
80.0000 -67.06210 -62.75978 4.30232 2.50447 -64.31957 1093.00167
85.0000 -67.10874 -62.03162 5.07712 2.77127 -61.74369 1289.65422
90.0000 -67.16976 -61.44189 5.72787 2.75559 -61.89509 1253.55894
95.0000 -65.86303 -61.26677 4.59626 2.88160 -60.67848 1380.55449
100.0000 -67.76901 -63.21120 4.55781 2.65632 -62.85356 1216.16747
105.0000 -66.51375 -59.69950 6.81425 2.80338 -61.43363 1285.81673
110.0000 -66.75364 -61.61297 5.14067 2.91782 -60.32876 1348.70228
115.0000 -64.28711 -59.94836 4.33875 2.87544 -60.73796 1371.29538
120.0000 -66.75770 -59.89629 6.86141 3.01269 -59.41277 1566.43378
125.0000 -66.25208 -60.98212 5.26996 2.96572 -59.86628 1466.88821
130.0000 -66.29390 -60.61627 5.67763 2.78281 -61.63231 1310.03006
135.0000 -67.38575 -61.09220 6.29355 2.78151 -61.64486 1248.08084
140.0000 -66.92939 -62.48045 4.44895 2.75388 -61.91157 1242.78209
145.0000 -66.49216 -61.12649 5.36567 2.65675 -62.84939 1170.95627
150.0000 -65.79948 -61.25573 4.54375 2.86421 -60.84640 1413.22796
155.0000 -66.48194 -61.99867 4.48327 2.77613 -61.69681 1262.65584
160.0000 -67.38512 -61.82909 5.55603 2.77917 -61.66745 1333.58698
165.0000 -67.33969 -62.55882 4.78086 2.69250 -62.50422 1229.48569
170.0000 -67.54002 -61.76456 5.77546 2.72220 -62.21749 1256.19664
175.0000 -65.84276 -61.97415 3.86861 2.73974 -62.04813 1267.11868
180.0000 -67.05018 -62.61435 4.43582 2.76619 -61.79272 1321.23618
185.0000 -67.77251 -62.93138 4.84113 2.66461 -62.77348 1206.22146
190.0000 -67.31481 -62.90110 4.41371 2.68480 -62.57858 1254.44834
195.0000 -67.27366 -62.47542 4.79824 2.61303 -63.27151 1171.97317
200.0000 -67.49521 -61.92905 5.56616 2.73044 -62.13787 1257.57009
205.0000 -66.23837 -60.62223 5.61615 2.83109 -61.16610 1329.58701
210.0000 -66.57367 -61.64502 4.92865 2.78461 -61.61489 1370.61554
215.0000 -65.93403 -62.02315 3.91089 2.73149 -62.12771 1317.78007
220.0000 -65.75735 -60.77448 4.98287 2.75193 -61.93039 1280.33583
225.0000 -68.05679 -63.13783 4.91896 2.75877 -61.86441 1302.67076
230.0000 -67.98955 -63.39341 4.59614 2.56200 -63.76412 1157.15588
235.0000 -67.61137 -63.18410 4.42727 2.64150 -62.99662 1212.32580
240.0000 -67.59438 -62.52912 5.06526 2.71675 -62.27003 1186.69418
245.0000 -66.28406 -61.26982 5.01424 2.84066 -61.07374 1350.11234
250.0000 -67.05706 -60.46076 6.59629 2.77051 -61.75104 1328.67654
FREEZING PROCESS: loop number 2 T-loop= 1297.0000000000000
main_MD> interactions number 2 at Temperature= 1297.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.02379 2.86078 -0.99126
force_rgl> df(natom) 5.21997 -2.42099 -1.49767
255.0000 -66.98503 -62.12275 4.86228 2.89197 -60.57836 1436.28113
260.0000 -68.38099 -64.24382 4.13717 2.64354 -62.97693 1174.37655
265.0000 -66.89895 -61.55681 5.34215 2.64653 -62.94801 1224.83333
270.0000 -65.48777 -61.78803 3.69974 2.72186 -62.22072 1283.37822
275.0000 -65.45141 -60.73457 4.71684 2.83706 -61.10847 1370.63229
280.0000 -67.07901 -61.36886 5.71015 2.82656 -61.20984 1356.53997
285.0000 -66.23998 -62.05546 4.18452 2.83066 -61.17029 1325.21326
290.0000 -66.99303 -61.97332 5.01971 2.77715 -61.68690 1333.42365
295.0000 -66.49176 -60.69329 5.79846 2.82891 -61.18715 1306.68879
300.0000 -65.89205 -61.32396 4.56810 2.87128 -60.77810 1393.44056
305.0000 -65.65651 -60.86089 4.79562 2.82576 -61.21755 1403.96016
310.0000 -64.49400 -58.45878 6.03523 2.93888 -60.12545 1476.04802
315.0000 -66.73832 -62.41642 4.32190 2.80258 -61.44135 1271.99155
320.0000 -67.74989 -62.42878 5.32111 2.71812 -62.25682 1232.86342
325.0000 -66.08831 -61.10324 4.98507 2.67643 -62.65938 1171.72909
330.0000 -66.39044 -61.35497 5.03546 2.84733 -61.00935 1292.56762
335.0000 -67.52236 -62.68213 4.84023 2.75835 -61.86846 1315.52545
340.0000 -66.61127 -61.19504 5.41623 2.76126 -61.84033 1302.90342
345.0000 -65.65265 -60.13420 5.51845 2.86365 -60.85172 1434.69414
350.0000 -67.95896 -62.64195 5.31701 2.72921 -62.14978 1276.28635
355.0000 -66.43847 -62.43634 4.00212 2.71950 -62.24351 1263.46062
360.0000 -66.72682 -61.45551 5.27131 2.65937 -62.82407 1198.52422
365.0000 -64.40306 -59.71457 4.68849 2.89771 -60.52291 1432.84810
370.0000 -66.95567 -62.13616 4.81951 2.83842 -61.09533 1400.52610
375.0000 -67.84414 -63.59830 4.24585 2.75588 -61.89226 1282.85458
380.0000 -65.92255 -61.19429 4.72826 2.79754 -61.49001 1294.14374
385.0000 -67.07918 -62.93608 4.14310 2.75506 -61.90020 1285.81538
390.0000 -67.93064 -63.70173 4.22890 2.60133 -63.38447 1129.38069
395.0000 -67.61354 -62.83457 4.77897 2.60320 -63.36641 1179.18011
400.0000 -66.74745 -62.28183 4.46562 2.61713 -63.23193 1131.61620
405.0000 -66.83429 -62.82825 4.00604 2.70880 -62.34679 1262.55439
410.0000 -65.96238 -61.60434 4.35804 2.74675 -61.98041 1240.41156
415.0000 -67.69597 -62.31969 5.37628 2.77725 -61.68596 1327.01941
420.0000 -67.36607 -63.45427 3.91181 2.63730 -63.03715 1222.48849
425.0000 -67.17664 -62.77989 4.39675 2.59967 -63.40044 1159.57453
430.0000 -65.24247 -59.83810 5.40437 2.81599 -61.31195 1384.28509
435.0000 -65.97181 -61.00096 4.97085 2.88097 -60.68453 1389.49395
440.0000 -65.45643 -60.08553 5.37090 2.90848 -60.41892 1450.70486
445.0000 -67.30888 -62.24402 5.06486 2.77995 -61.65984 1284.29604
450.0000 -66.91825 -61.49800 5.42025 2.75056 -61.94365 1350.46314
455.0000 -68.88885 -64.76014 4.12870 2.65186 -62.89656 1205.16906
460.0000 -66.40064 -62.08598 4.31466 2.63879 -63.02278 1145.64062
465.0000 -66.51616 -60.17463 6.34153 2.89159 -60.58199 1388.06153
470.0000 -64.16470 -59.02149 5.14321 3.04023 -59.14686 1505.81279
475.0000 -66.46386 -61.41448 5.04938 2.96519 -59.87144 1475.00932
480.0000 -66.42578 -61.15619 5.26960 2.78752 -61.58678 1350.05925
485.0000 -65.37194 -60.95812 4.41382 2.86254 -60.86248 1365.14776
490.0000 -66.60103 -60.87503 5.72600 2.88975 -60.59973 1467.97556
495.0000 -66.17447 -60.61391 5.56056 2.88289 -60.66599 1431.63806
500.0000 -66.56128 -61.11364 5.44765 2.86474 -60.84120 1381.65261
FREEZING PROCESS: loop number 3 T-loop= 1272.0000000000000
main_MD> interactions number 3 at Temperature= 1272.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.11351 -0.14038 -2.32875
force_rgl> df(natom) 1.20071 -1.24698 1.59609
505.0000 -66.59593 -61.50976 5.08617 2.74625 -61.98521 1244.04237
510.0000 -66.31393 -61.68347 4.63046 2.73076 -62.13477 1240.57670
515.0000 -66.54459 -62.64370 3.90089 2.86587 -60.83036 1438.11480
520.0000 -66.06146 -61.90138 4.16009 2.67582 -62.66526 1221.27304
525.0000 -68.00136 -62.18456 5.81680 2.73476 -62.09623 1294.43504
530.0000 -68.33582 -61.94625 6.38956 2.70451 -62.38827 1210.86677
535.0000 -67.36822 -62.93260 4.43562 2.71572 -62.28002 1277.40500
540.0000 -65.91551 -59.99473 5.92078 2.86451 -60.84344 1374.87822
545.0000 -67.61252 -63.19909 4.41343 2.81269 -61.34379 1354.62356
550.0000 -68.17786 -63.75962 4.41824 2.63892 -63.02148 1202.84126
555.0000 -67.76996 -64.18163 3.58833 2.61010 -63.29975 1154.42639
560.0000 -67.84410 -63.08092 4.76318 2.48892 -64.46974 1065.89934
565.0000 -66.12090 -61.81405 4.30685 2.68659 -62.56127 1237.80602
570.0000 -67.89182 -62.85082 5.04100 2.62489 -63.15695 1160.52164
575.0000 -67.74624 -63.02252 4.72372 2.63109 -63.09707 1222.33519
580.0000 -67.92867 -63.17449 4.75419 2.57011 -63.68589 1126.25697
585.0000 -66.04223 -60.12635 5.91588 2.70268 -62.40591 1231.19266
590.0000 -68.07107 -62.77094 5.30014 2.75596 -61.89147 1315.41578
595.0000 -66.12917 -61.31555 4.81362 2.74048 -62.04099 1313.76984
600.0000 -65.91476 -61.29961 4.61515 2.79771 -61.48836 1289.97483
605.0000 -66.39804 -60.19055 6.20749 2.88135 -60.68088 1534.38851
610.0000 -67.15272 -62.12438 5.02834 2.87298 -60.76172 1426.57637
615.0000 -67.98498 -63.15460 4.83039 2.57194 -63.66815 1098.90650
620.0000 -67.37583 -62.93282 4.44301 2.64194 -62.99232 1185.10593
625.0000 -67.65037 -62.57027 5.08009 2.80080 -61.45853 1362.63996
630.0000 -67.22083 -62.49308 4.72775 2.74728 -61.97532 1290.39560
635.0000 -68.30396 -64.23133 4.07263 2.62850 -63.12211 1186.06644
640.0000 -67.46372 -61.85623 5.60749 2.65463 -62.86987 1212.94318
645.0000 -66.67674 -60.03993 6.63681 2.80716 -61.39719 1400.66844
650.0000 -66.34491 -61.14943 5.19548 2.94830 -60.03445 1474.12279
655.0000 -66.22358 -61.28208 4.94151 2.78593 -61.60213 1318.06465
660.0000 -65.93438 -61.69216 4.24222 2.81069 -61.36310 1315.98399
665.0000 -68.34296 -63.51625 4.82670 2.73081 -62.13433 1261.95747
670.0000 -67.09026 -63.04512 4.04514 2.62454 -63.16031 1194.76857
675.0000 -65.64692 -60.26297 5.38395 2.85493 -60.93598 1402.18278
680.0000 -68.06564 -63.13273 4.93291 2.83380 -61.13995 1334.31472
685.0000 -66.12839 -61.71851 4.40988 2.79131 -61.55021 1306.49120
690.0000 -66.79269 -61.09104 5.70165 2.80026 -61.46383 1265.56540
695.0000 -65.06525 -59.92112 5.14414 2.94846 -60.03295 1432.85881
700.0000 -65.48464 -58.97689 6.50775 3.04420 -59.10860 1516.48790
705.0000 -66.09447 -61.24738 4.84709 2.90150 -60.48634 1360.77316
710.0000 -65.90821 -61.31806 4.59016 2.80534 -61.41471 1311.23825
715.0000 -65.78013 -61.01758 4.76255 2.86905 -60.79959 1396.19596
720.0000 -66.07963 -60.90879 5.17083 2.80614 -61.40705 1312.91537
725.0000 -68.23589 -63.53665 4.69925 2.67254 -62.69694 1241.08227
730.0000 -67.27810 -63.19175 4.08635 2.67338 -62.68885 1264.29859
735.0000 -67.90163 -63.31341 4.58822 2.66647 -62.75551 1218.51733
740.0000 -67.91008 -63.95700 3.95308 2.52946 -64.07834 1101.53718
745.0000 -68.18684 -63.98028 4.20656 2.55833 -63.79963 1120.08691
750.0000 -67.67255 -64.10487 3.56768 2.60933 -63.30724 1173.54472
FREEZING PROCESS: loop number 4 T-loop= 1247.0000000000000
main_MD> interactions number 4 at Temperature= 1247.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.79889 2.64732 -2.49121
force_rgl> df(natom) -0.81380 -3.24735 3.73818
755.0000 -67.46385 -63.47400 3.98985 2.56340 -63.75066 1154.35197
760.0000 -67.22180 -62.87773 4.34407 2.65860 -62.83146 1222.86075
765.0000 -67.00334 -61.63816 5.36518 2.78674 -61.59435 1286.18036
770.0000 -67.03723 -61.23840 5.79883 2.83904 -61.08939 1389.32187
775.0000 -66.70326 -62.48519 4.21807 2.74532 -61.99424 1298.07200
780.0000 -67.63160 -63.39615 4.23545 2.58308 -63.56059 1151.33715
785.0000 -67.24425 -61.98314 5.26111 2.67169 -62.70507 1248.26802
790.0000 -66.17991 -59.99920 6.18071 2.89270 -60.57133 1459.21350
795.0000 -67.03368 -62.61925 4.41443 2.90644 -60.43860 1463.52655
800.0000 -64.65766 -60.09360 4.56406 2.84973 -60.98613 1313.89750
805.0000 -67.20924 -62.56904 4.64020 2.74250 -62.02142 1204.34533
810.0000 -67.03401 -62.87039 4.16361 2.67532 -62.67008 1221.92843
815.0000 -68.10261 -62.63265 5.46996 2.67759 -62.64812 1191.77648
820.0000 -67.13499 -60.78617 6.34883 2.74452 -62.00198 1300.77639
825.0000 -65.99260 -62.09375 3.89885 2.77450 -61.71252 1316.15496
830.0000 -67.45194 -62.64839 4.80355 2.79570 -61.50778 1316.46156
835.0000 -65.84974 -61.09729 4.75245 2.75460 -61.90462 1232.37099
840.0000 -66.30068 -61.66833 4.63235 2.78501 -61.61106 1295.28508
845.0000 -65.81075 -60.87410 4.93665 2.82413 -61.23329 1326.96711
850.0000 -65.41813 -61.03978 4.37835 2.84264 -61.05462 1367.18332
855.0000 -67.03274 -61.92163 5.11111 2.81952 -61.27782 1346.56141
860.0000 -67.94681 -62.70400 5.24281 2.69859 -62.44538 1225.16436
865.0000 -66.66561 -61.08698 5.57863 2.72468 -62.19349 1227.08936
870.0000 -64.21671 -59.74848 4.46823 2.86261 -60.86181 1350.84009
875.0000 -67.10499 -61.53514 5.56985 2.84736 -61.00906 1369.24723
880.0000 -67.45916 -62.81815 4.64101 2.67323 -62.69023 1086.84977
885.0000 -66.34007 -60.12617 6.21390 2.83291 -61.14854 1358.40004
890.0000 -66.86954 -60.16950 6.70004 2.94285 -60.08714 1366.24214
895.0000 -66.99010 -62.12350 4.86660 2.77176 -61.73895 1235.20529
900.0000 -67.26444 -61.79112 5.47332 2.77181 -61.73852 1316.76859
905.0000 -66.53002 -61.87764 4.65237 2.78312 -61.62931 1334.41590
910.0000 -66.41501 -60.70225 5.71276 2.88137 -60.68068 1361.26579
915.0000 -65.91614 -61.60077 4.31536 2.89863 -60.51407 1353.61218
920.0000 -66.33954 -61.83006 4.50949 2.74663 -61.98156 1242.34463
925.0000 -66.61923 -60.52652 6.09270 2.87289 -60.76251 1406.13382
930.0000 -66.76193 -62.92324 3.83869 2.72853 -62.15633 1270.19891
935.0000 -66.60142 -62.96579 3.63563 2.67762 -62.64786 1223.50192
940.0000 -67.84224 -61.91331 5.92893 2.73246 -62.11843 1308.16676
945.0000 -67.03375 -62.13350 4.90024 2.67479 -62.67520 1221.00650
950.0000 -66.53350 -61.42646 5.10704 2.77086 -61.74763 1275.34174
955.0000 -66.04387 -60.49277 5.55111 2.85929 -60.89383 1387.36252
960.0000 -65.22385 -61.79132 3.43253 2.80957 -61.37394 1198.31066
965.0000 -67.04197 -61.55184 5.49013 2.71657 -62.27178 1259.68574
970.0000 -67.36366 -60.22764 7.13601 2.88981 -60.59918 1489.74784
975.0000 -66.59371 -63.04802 3.54569 2.68807 -62.54694 1242.16804
980.0000 -67.38847 -63.24055 4.14792 2.63235 -63.08492 1198.07247
985.0000 -67.71669 -62.92023 4.79646 2.60698 -63.32985 1137.73292
990.0000 -67.75491 -62.81735 4.93755 2.64340 -62.97826 1223.04053
995.0000 -67.49490 -62.36354 5.13135 2.63572 -63.05242 1207.93152
1000.0000 -67.88979 -62.45538 5.43441 2.76247 -61.82865 1289.43024
FREEZING PROCESS: loop number 5 T-loop= 1222.0000000000000
main_MD> interactions number 5 at Temperature= 1222.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.60882 -2.63207 -3.15489
force_rgl> df(natom) -1.26363 -0.78828 -2.75153
1005.0000 -67.27506 -61.91410 5.36096 2.66036 -62.81454 1191.92189
1010.0000 -66.80443 -61.04405 5.76038 2.79313 -61.53262 1360.81194
1015.0000 -66.69573 -62.19064 4.50509 2.73958 -62.04965 1221.78622
1020.0000 -67.79761 -63.06291 4.73469 2.62877 -63.11955 1170.73279
1025.0000 -66.75246 -60.25124 6.50122 2.72048 -62.23402 1246.46509
1030.0000 -66.38731 -61.14205 5.24526 2.84910 -60.99224 1410.00387
1035.0000 -67.78575 -62.00556 5.78019 2.81329 -61.33797 1394.17485
1040.0000 -68.12944 -63.37799 4.75145 2.67520 -62.67121 1222.16227
1045.0000 -67.67573 -62.68749 4.98824 2.53853 -63.99080 1118.68239
1050.0000 -67.23333 -60.33221 6.90112 2.77043 -61.75179 1322.85784
1055.0000 -66.52014 -61.32799 5.19216 2.86925 -60.79769 1454.94334
1060.0000 -67.49764 -61.51635 5.98129 2.80327 -61.43473 1289.95376
1065.0000 -67.74100 -62.73744 5.00357 2.70095 -62.42261 1240.84857
1070.0000 -67.01593 -62.91498 4.10095 2.67010 -62.72051 1234.23448
1075.0000 -67.61456 -64.26481 3.34975 2.62962 -63.11125 1134.07204
1080.0000 -68.67214 -63.37290 5.29924 2.62119 -63.19271 1111.40356
1085.0000 -67.60724 -62.67261 4.93463 2.64176 -62.99410 1185.54522
1090.0000 -64.47932 -60.34724 4.13208 2.77339 -61.72324 1334.55948
1095.0000 -66.06440 -60.58882 5.47558 2.94134 -60.10171 1411.23469
1100.0000 -66.26651 -61.40676 4.85976 2.79525 -61.51215 1273.22286
1105.0000 -66.84292 -61.18234 5.66059 2.74016 -62.04405 1274.49100
1110.0000 -65.83584 -61.01407 4.82177 2.81176 -61.35275 1347.27171
1115.0000 -66.73395 -60.35320 6.38075 2.90639 -60.43916 1445.89383
1120.0000 -67.32561 -61.57522 5.75039 2.82132 -61.26041 1412.94162
1125.0000 -67.01667 -61.46239 5.55428 2.73180 -62.12472 1306.81570
1130.0000 -66.06326 -60.44828 5.61498 2.83324 -61.14537 1280.87655
1135.0000 -67.37225 -62.04140 5.33084 2.77056 -61.75058 1305.68460
1140.0000 -68.06687 -63.43492 4.63195 2.65218 -62.89344 1158.42679
1145.0000 -67.34749 -61.96481 5.38268 2.70537 -62.37997 1259.13043
1150.0000 -66.19070 -60.96931 5.22139 2.71007 -62.33456 1268.84784
1155.0000 -67.15561 -61.46485 5.69076 2.72650 -62.17597 1262.02385
1160.0000 -66.39475 -61.19538 5.19937 2.79086 -61.55453 1313.69307
1165.0000 -67.19817 -62.23706 4.96110 2.69294 -62.49998 1268.49039
1170.0000 -66.63568 -62.44008 4.19560 2.70755 -62.35889 1310.64502
1175.0000 -68.50584 -64.10800 4.39784 2.57518 -63.63695 1113.54916
1180.0000 -69.57786 -64.90843 4.66943 2.46797 -64.67205 1047.73674
1185.0000 -67.76761 -63.77528 3.99233 2.43670 -64.97397 1015.99853
1190.0000 -66.59474 -63.19190 3.40284 2.59085 -63.48558 1135.70871
1195.0000 -69.26785 -64.63030 4.63755 2.56443 -63.74071 1174.70296
1200.0000 -67.13319 -62.17133 4.96186 2.62352 -63.17022 1174.61586
1205.0000 -66.04455 -61.99085 4.05370 2.78183 -61.64175 1360.56209
1210.0000 -67.80012 -62.11370 5.68642 2.74910 -61.95777 1340.75493
1215.0000 -66.44458 -60.95107 5.49351 2.79420 -61.52228 1357.14374
1220.0000 -66.24594 -61.94855 4.29738 2.73344 -62.10889 1318.01996
1225.0000 -66.90551 -62.20779 4.69772 2.68518 -62.57491 1230.95957
1230.0000 -68.90865 -64.18551 4.72313 2.61795 -63.22400 1126.42504
1235.0000 -68.35940 -63.99757 4.36183 2.53941 -63.98222 1110.65248
1240.0000 -66.59272 -61.86742 4.72531 2.62580 -63.14822 1189.23278
1245.0000 -67.05399 -62.43891 4.61508 2.74046 -62.04111 1264.00442
1250.0000 -68.40792 -63.12428 5.28364 2.67244 -62.69784 1163.54708
FREEZING PROCESS: loop number 6 T-loop= 1197.0000000000000
main_MD> interactions number 6 at Temperature= 1197.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.65628 -0.68689 -0.61078
force_rgl> df(natom) 0.76083 0.27146 1.72992
1255.0000 -69.20080 -64.44136 4.75945 2.62779 -63.12900 1208.40956
1260.0000 -68.89608 -65.02017 3.87592 2.49462 -64.41469 1039.17315
1265.0000 -67.76904 -62.74904 5.02000 2.53878 -63.98836 1063.91772
1270.0000 -68.36044 -63.67664 4.68380 2.66440 -62.77552 1212.76056
1275.0000 -68.13444 -63.30030 4.83414 2.54726 -63.90647 1130.00433
1280.0000 -68.36720 -62.93518 5.43203 2.61606 -63.24224 1200.64160
1285.0000 -67.50305 -60.81574 6.68731 2.78192 -61.64088 1347.86074
1290.0000 -66.51143 -62.05166 4.45977 2.80937 -61.37580 1342.67582
1295.0000 -67.61584 -64.05541 3.56042 2.68974 -62.53082 1190.06047
1300.0000 -68.18030 -61.99726 6.18304 2.65532 -62.86316 1254.41870
1305.0000 -67.19190 -61.74994 5.44196 2.70606 -62.37324 1222.92219
1310.0000 -68.80437 -63.89630 4.90807 2.72872 -62.15446 1242.37866
1315.0000 -67.98928 -64.62793 3.36136 2.50764 -64.28902 1030.51710
1320.0000 -68.84119 -65.50182 3.33936 2.50432 -64.32108 1090.44636
1325.0000 -67.43611 -63.43065 4.00546 2.47140 -64.63894 997.06840
1330.0000 -66.53964 -61.88735 4.65229 2.75123 -61.93713 1303.00700
1335.0000 -66.45448 -62.48984 3.96464 2.74768 -61.97144 1296.97933
1340.0000 -67.12610 -63.55116 3.57494 2.64412 -62.97134 1190.79550
1345.0000 -67.63678 -63.22251 4.41427 2.58418 -63.55003 1208.02492
1350.0000 -68.34811 -63.38784 4.96027 2.55749 -63.80766 1126.92864
1355.0000 -66.44853 -63.08746 3.36107 2.60290 -63.36923 1136.88007
1360.0000 -67.88160 -63.05722 4.82438 2.64806 -62.93328 1159.93188
1365.0000 -67.31585 -62.57807 4.73778 2.66777 -62.74300 1177.11574
1370.0000 -66.96665 -62.49494 4.47171 2.71696 -62.26808 1309.65491
1375.0000 -67.16510 -62.61644 4.54866 2.74485 -61.99876 1283.51630
1380.0000 -68.56898 -64.12879 4.44020 2.55897 -63.79337 1124.88443
1385.0000 -67.29733 -63.41737 3.87995 2.58198 -63.57124 1211.85183
1390.0000 -69.11323 -64.02729 5.08594 2.57005 -63.68642 1157.33303
1395.0000 -68.57071 -65.03926 3.53145 2.47629 -64.59167 1064.24137
1400.0000 -69.24318 -64.28692 4.95626 2.48367 -64.52039 1077.95362
1405.0000 -68.67427 -62.38006 6.29422 2.55728 -63.80972 1158.18165
1410.0000 -66.89758 -62.95927 3.93831 2.65041 -62.91058 1201.27233
1415.0000 -67.43186 -62.34850 5.08336 2.67637 -62.65996 1207.18782
1420.0000 -68.00840 -63.44335 4.56506 2.68491 -62.57748 1206.41402
1425.0000 -66.35528 -61.34582 5.00946 2.65913 -62.82639 1215.79615
1430.0000 -67.07847 -62.98761 4.09086 2.69570 -62.47332 1239.89424
1435.0000 -67.64829 -63.40160 4.24669 2.61292 -63.27250 1125.24199
1440.0000 -67.12728 -64.02882 3.09845 2.58554 -63.53686 1128.89375
1445.0000 -69.01499 -64.93204 4.08295 2.51039 -64.26244 1065.66551
1450.0000 -68.20773 -63.52373 4.68400 2.48345 -64.52258 1084.05495
1455.0000 -68.34732 -63.09598 5.25134 2.68897 -62.53832 1190.45131
1460.0000 -67.11380 -61.59452 5.51928 2.77598 -61.69816 1385.86066
1465.0000 -66.70192 -61.94442 4.75751 2.79878 -61.47809 1325.48989
1470.0000 -66.85793 -62.85868 3.99925 2.69039 -62.52457 1150.04633
1475.0000 -66.84838 -63.00601 3.84238 2.58288 -63.56258 1155.44557
1480.0000 -66.94164 -63.11839 3.82325 2.65852 -62.83224 1173.62772
1485.0000 -67.42246 -62.27303 5.14943 2.68008 -62.62411 1229.22995
1490.0000 -66.92883 -62.42328 4.50555 2.68786 -62.54904 1242.04197
1495.0000 -65.17454 -61.12356 4.05098 2.77548 -61.70302 1385.38738
1500.0000 -67.32003 -62.53777 4.78225 2.77925 -61.66663 1271.34626
FREEZING PROCESS: loop number 7 T-loop= 1172.0000000000000
main_MD> interactions number 7 at Temperature= 1172.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -7.97260 -1.61585 2.34189
force_rgl> df(natom) 1.18066 3.46704 0.19228
1505.0000 -68.58031 -62.97731 5.60300 2.66656 -62.75460 1230.18795
1510.0000 -68.41977 -64.53145 3.88832 2.48565 -64.50131 1082.37895
1515.0000 -68.05158 -62.22776 5.82382 2.58450 -63.54690 1168.49086
1520.0000 -69.06638 -64.75490 4.31148 2.66489 -62.77078 1190.34460
1525.0000 -68.30552 -63.99914 4.30638 2.50289 -64.33489 1049.91956
1530.0000 -68.64554 -64.26663 4.37892 2.58129 -63.57792 1132.44365
1535.0000 -68.44004 -64.12393 4.31611 2.59002 -63.49365 1148.74332
1540.0000 -67.62820 -63.98844 3.63977 2.58391 -63.55258 1200.98739
1545.0000 -67.45544 -61.91991 5.53553 2.67190 -62.70311 1233.75198
1550.0000 -67.89262 -63.25405 4.63857 2.73092 -62.13324 1261.57047
1555.0000 -67.29027 -63.14388 4.14639 2.66371 -62.78214 1181.25511
1560.0000 -68.67569 -63.64324 5.03246 2.60819 -63.31816 1199.20875
1565.0000 -66.15736 -61.32268 4.83468 2.66728 -62.74768 1191.28434
1570.0000 -66.75193 -60.89487 5.85706 2.79949 -61.47122 1327.24181
1575.0000 -67.65447 -62.37520 5.27927 2.80427 -61.42510 1412.11385
1580.0000 -66.42841 -62.09309 4.33532 2.66436 -62.77584 1147.89035
1585.0000 -67.55166 -63.21461 4.33705 2.66232 -62.79555 1205.48752
1590.0000 -68.01312 -63.37869 4.63443 2.55554 -63.82653 1123.47754
1595.0000 -66.65100 -62.75270 3.89830 2.59072 -63.48689 1136.15131
1600.0000 -68.36414 -62.42952 5.93462 2.62919 -63.11541 1169.72211
1605.0000 -67.18791 -62.97400 4.21391 2.66343 -62.78488 1191.13972
1610.0000 -68.19448 -64.23062 3.96386 2.56477 -63.73745 1119.97016
1615.0000 -67.61540 -63.32933 4.28606 2.55077 -63.87258 1098.87062
1620.0000 -65.66218 -61.01664 4.64554 2.78323 -61.62822 1290.65789
1625.0000 -65.61154 -61.07199 4.53955 2.83797 -61.09971 1325.11542
1630.0000 -66.29160 -61.19483 5.09677 2.83088 -61.16811 1318.26167
1635.0000 -66.55453 -62.34717 4.20736 2.80119 -61.45480 1343.10767
1640.0000 -66.54095 -62.48952 4.05143 2.73734 -62.07124 1259.41822
1645.0000 -67.56100 -64.27225 3.28874 2.60542 -63.34498 1083.34178
1650.0000 -68.17789 -64.27688 3.90101 2.49868 -64.37555 1091.50507
1655.0000 -67.18086 -63.66197 3.51889 2.52443 -64.12687 1075.70100
1660.0000 -68.55980 -62.37107 6.18873 2.64711 -62.94239 1212.39960
1665.0000 -67.75655 -63.44803 4.30852 2.64208 -62.99099 1178.98104
1670.0000 -69.43853 -63.94793 5.49060 2.56482 -63.73696 1128.18401
1675.0000 -69.26336 -65.43945 3.82392 2.44407 -64.90274 1043.30558
1680.0000 -68.97634 -65.11534 3.86100 2.31098 -66.18774 910.05166
1685.0000 -68.37457 -64.06917 4.30541 2.49024 -64.45697 1037.79983
1690.0000 -67.50923 -64.19211 3.31713 2.54668 -63.91208 1116.68967
1695.0000 -67.46547 -62.84281 4.62266 2.57425 -63.64590 1128.22378
1700.0000 -67.74692 -61.31776 6.42916 2.65583 -62.85828 1218.60470
1705.0000 -68.13945 -64.29229 3.84716 2.63569 -63.05272 1186.01349
1710.0000 -67.98712 -63.90631 4.08080 2.54221 -63.95520 1078.02843
1715.0000 -66.76329 -61.89761 4.86568 2.62498 -63.15614 1192.14613
1720.0000 -67.24117 -62.20723 5.03394 2.78447 -61.61622 1290.09693
1725.0000 -65.33474 -61.09788 4.23687 2.66024 -62.81570 1232.39724
1730.0000 -67.16562 -62.98087 4.18475 2.66940 -62.72727 1149.87981
1735.0000 -67.19348 -63.49273 3.70075 2.64606 -62.95256 1169.11987
1740.0000 -66.09194 -62.09271 3.99923 2.68067 -62.61843 1141.41702
1745.0000 -67.04287 -61.37622 5.66665 2.76884 -61.76710 1242.73249
1750.0000 -66.40974 -61.53176 4.87798 2.84945 -60.98891 1358.05236
FREEZING PROCESS: loop number 8 T-loop= 1147.0000000000000
main_MD> interactions number 8 at Temperature= 1147.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.00900 -0.76143 -1.06973
force_rgl> df(natom) 5.51890 -0.69406 -4.34533
1755.0000 -69.24137 -64.12368 5.11768 2.74166 -62.02954 1272.60819
1760.0000 -68.68101 -63.99326 4.68775 2.54763 -63.90290 1089.25885
1765.0000 -67.70281 -63.54750 4.15531 2.55327 -63.84841 1073.25108
1770.0000 -67.28930 -62.60249 4.68681 2.67537 -62.66962 1183.36991
1775.0000 -67.83769 -63.34546 4.49223 2.65294 -62.88615 1192.14776
1780.0000 -68.41313 -64.65118 3.76195 2.55702 -63.81224 1123.70651
1785.0000 -68.44747 -63.95439 4.49308 2.55176 -63.86307 1085.37924
1790.0000 -67.85464 -64.80853 3.04612 2.59917 -63.40530 1149.12246
1795.0000 -68.21442 -63.65895 4.55547 2.50435 -64.32078 1021.73171
1800.0000 -68.15977 -64.43952 3.72024 2.49796 -64.38251 1038.58580
1805.0000 -67.17474 -63.31109 3.86365 2.64388 -62.97358 1130.91827
1810.0000 -66.82641 -63.18060 3.64581 2.64185 -62.99319 1108.68854
1815.0000 -68.16597 -63.51860 4.64737 2.57649 -63.62427 1150.90424
1820.0000 -67.89982 -63.90154 3.99828 2.53256 -64.04836 1105.30866
1825.0000 -68.37616 -64.43918 3.93698 2.49416 -64.41911 1069.29736
1830.0000 -67.73517 -64.48758 3.24759 2.45058 -64.83988 1023.49231
1835.0000 -68.26342 -64.87599 3.38743 2.52206 -64.14979 1052.81957
1840.0000 -67.99829 -63.86552 4.13277 2.48075 -64.54866 1036.21817
1845.0000 -68.63406 -64.82391 3.81015 2.48822 -64.47647 1051.50616
1850.0000 -69.13654 -64.71013 4.42641 2.44119 -64.93059 1029.17918
1855.0000 -68.23608 -63.32970 4.90637 2.53702 -64.00530 1073.67542
1860.0000 -66.62806 -62.37576 4.25230 2.62827 -63.12431 1181.76554
1865.0000 -66.96862 -61.35694 5.61168 2.77735 -61.68499 1294.63780
1870.0000 -67.43137 -62.26133 5.17004 2.79482 -61.51628 1396.34990
1875.0000 -65.53641 -61.86898 3.66744 2.74037 -62.04201 1250.66076
1880.0000 -67.61138 -62.84422 4.76716 2.65219 -62.89339 1196.61119
1885.0000 -67.27812 -62.23793 5.04019 2.72759 -62.16542 1256.26312
1890.0000 -66.61825 -62.28235 4.33591 2.71656 -62.27192 1265.99530
1895.0000 -68.66749 -63.86422 4.80326 2.62597 -63.14651 1146.60958
1900.0000 -65.84749 -60.09630 5.75119 2.75686 -61.88282 1292.69843
1905.0000 -66.40822 -62.06423 4.34399 2.93205 -60.19133 1436.21184
1910.0000 -67.32714 -63.01293 4.31421 2.62335 -63.17186 1139.39514
1915.0000 -70.06810 -66.05556 4.01254 2.54238 -63.95362 1072.36896
1920.0000 -68.02722 -64.04331 3.98392 2.55533 -63.82859 1162.90842
1925.0000 -68.47108 -64.83958 3.63149 2.53083 -64.06508 1024.84739
1930.0000 -67.43529 -62.79534 4.63995 2.54764 -63.90280 1093.47055
1935.0000 -67.32199 -62.70301 4.61898 2.67773 -62.64684 1235.24172
1940.0000 -67.22257 -63.75236 3.47021 2.57976 -63.59270 1123.57489
1945.0000 -68.08977 -64.37727 3.71250 2.50679 -64.29725 1116.21803
1950.0000 -69.75577 -64.97411 4.78166 2.53151 -64.05856 1090.37279
1955.0000 -69.42281 -64.49668 4.92614 2.49190 -64.44095 1096.27143
1960.0000 -68.66021 -64.44290 4.21731 2.53500 -64.02480 1113.92950
1965.0000 -69.04740 -65.45165 3.59575 2.43471 -64.99313 977.40045
1970.0000 -68.05279 -63.85153 4.20126 2.49163 -64.44362 1074.04402
1975.0000 -68.24336 -62.76275 5.48061 2.61064 -63.29452 1166.61466
1980.0000 -69.17847 -64.83684 4.34163 2.55953 -63.78796 1116.70488
1985.0000 -69.43474 -64.94767 4.48708 2.47167 -64.63632 1006.85114
1990.0000 -66.95999 -62.86600 4.09399 2.54196 -63.95760 1105.81282
1995.0000 -65.39069 -59.75809 5.63260 2.77263 -61.73054 1338.90620
2000.0000 -68.14622 -63.85457 4.29166 2.76220 -61.83129 1328.36823
FREEZING PROCESS: loop number 9 T-loop= 1122.0000000000000
main_MD> interactions number 9 at Temperature= 1122.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.82535 -1.70345 1.36621
force_rgl> df(natom) -0.21277 1.84385 -3.15200
2005.0000 -67.96036 -62.61832 5.34204 2.61755 -63.22785 1156.91835
2010.0000 -68.80867 -64.13162 4.67704 2.50589 -64.30593 1125.17386
2015.0000 -68.19879 -63.42941 4.76939 2.62495 -63.15638 1127.32736
2020.0000 -67.36588 -62.90929 4.45659 2.65664 -62.85044 1182.52833
2025.0000 -68.71362 -63.53471 5.17891 2.57568 -63.63211 1105.06106
2030.0000 -66.81233 -62.59331 4.21902 2.63643 -63.04556 1168.28398
2035.0000 -68.57904 -65.38390 3.19514 2.51938 -64.17569 1096.68694
2040.0000 -69.37513 -64.94860 4.42654 2.39212 -65.40430 990.04686
2045.0000 -67.74564 -63.77926 3.96637 2.47125 -64.64033 1091.68454
2050.0000 -67.15273 -64.13265 3.02008 2.55047 -63.87544 1078.98231
2055.0000 -68.27763 -64.11776 4.15987 2.53869 -63.98923 1111.82119
2060.0000 -68.01582 -64.05724 3.95858 2.54462 -63.93195 1081.08720
2065.0000 -67.91668 -63.24317 4.67351 2.54403 -63.93767 1115.28364
2070.0000 -68.09980 -62.68396 5.41583 2.64495 -62.96333 1200.77650
2075.0000 -67.70964 -61.39957 6.31007 2.70781 -62.35635 1260.07604
2080.0000 -66.21601 -61.76982 4.44620 2.83439 -61.13429 1304.59145
2085.0000 -66.01842 -61.42954 4.58889 2.74064 -62.03939 1212.53844
2090.0000 -67.42705 -63.09075 4.33630 2.70519 -62.38169 1232.20364
2095.0000 -67.39402 -62.88325 4.51077 2.66651 -62.75510 1187.55080
2100.0000 -66.01822 -60.97041 5.04781 2.80399 -61.42779 1348.50985
2105.0000 -67.62986 -62.65733 4.97252 2.77521 -61.70567 1344.14547
2110.0000 -67.72973 -62.78265 4.94709 2.66945 -62.72675 1257.91800
2115.0000 -69.07508 -64.55500 4.52007 2.57686 -63.62067 1083.32164
2120.0000 -67.70904 -63.23099 4.47805 2.53767 -63.99908 1136.58040
2125.0000 -68.68943 -64.90248 3.78695 2.53065 -64.06683 1072.41681
2130.0000 -68.72855 -63.43145 5.29710 2.56649 -63.72081 1091.41170
2135.0000 -67.41609 -63.18027 4.23582 2.65777 -62.83949 1214.40962
2140.0000 -67.66726 -62.37563 5.29163 2.65853 -62.83214 1251.58407
2145.0000 -68.22648 -64.07110 4.15538 2.59963 -63.40084 1186.80296
2150.0000 -68.62945 -64.15827 4.47119 2.56087 -63.77511 1073.34567
2155.0000 -68.09343 -64.81957 3.27386 2.48150 -64.54137 1022.08599
2160.0000 -68.37929 -64.33766 4.04164 2.52922 -64.08062 1070.45901
2165.0000 -68.88867 -63.48663 5.40203 2.49880 -64.37432 1058.43085
2170.0000 -69.09315 -66.08281 3.01034 2.43324 -65.00737 1004.93283
2175.0000 -69.25340 -65.65541 3.59799 2.36052 -65.70944 960.77330
2180.0000 -68.16252 -64.47805 3.68447 2.42409 -65.09566 963.91347
2185.0000 -68.42062 -63.28752 5.13310 2.51995 -64.17014 1046.20792
2190.0000 -67.24315 -63.05619 4.18697 2.62379 -63.16762 1212.78418
2195.0000 -69.37131 -63.52590 5.84541 2.58472 -63.54483 1205.81043
2200.0000 -67.65465 -63.13944 4.51521 2.66796 -62.74113 1169.02851
2205.0000 -67.98941 -63.52674 4.46267 2.62546 -63.15142 1194.69880
2210.0000 -68.11367 -62.40887 5.70480 2.63661 -63.04377 1189.68718
2215.0000 -68.31825 -65.47715 2.84110 2.56548 -63.73058 1132.85635
2220.0000 -70.55161 -66.69294 3.85868 2.36401 -65.67578 970.93657
2225.0000 -68.13680 -65.13317 3.00363 2.29857 -66.30759 848.80086
2230.0000 -68.04170 -64.13644 3.90526 2.56285 -63.75596 1143.34780
2235.0000 -69.33902 -64.17655 5.16247 2.54523 -63.92612 1089.74956
2240.0000 -68.50192 -63.90772 4.59419 2.50897 -64.27612 1091.46772
2245.0000 -68.61593 -64.44628 4.16965 2.57790 -63.61070 1208.78522
2250.0000 -66.89881 -63.24271 3.65611 2.54339 -63.94380 1090.57387
FREEZING PROCESS: loop number 10 T-loop= 1097.0000000000000
main_MD> interactions number 10 at Temperature= 1097.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.55756 3.19648 -2.28172
force_rgl> df(natom) 1.55629 3.84130 -1.03194
2255.0000 -65.99490 -61.74382 4.25109 2.73621 -62.08219 1282.07327
2260.0000 -66.85317 -61.63947 5.21370 2.71743 -62.26351 1226.79450
2265.0000 -67.68763 -62.95679 4.73084 2.73488 -62.09501 1270.55071
2270.0000 -67.86077 -62.95278 4.90799 2.65351 -62.88062 1131.34151
2275.0000 -69.27609 -65.26173 4.01436 2.54201 -63.95720 1088.36095
2280.0000 -67.64438 -63.17192 4.47246 2.53382 -64.03624 1086.41783
2285.0000 -67.15978 -62.11007 5.04970 2.68281 -62.59772 1232.38894
2290.0000 -67.60113 -63.94025 3.66087 2.63929 -63.01794 1178.82595
2295.0000 -69.80708 -64.21247 5.59461 2.61974 -63.20668 1165.91133
2300.0000 -68.52607 -63.88336 4.64272 2.45444 -64.80267 998.63332
2305.0000 -68.52811 -64.33096 4.19714 2.50753 -64.29006 1058.32360
2310.0000 -68.93289 -64.18042 4.75247 2.52526 -64.11893 1082.00992
2315.0000 -66.37734 -62.39926 3.97808 2.59492 -63.44635 1082.69499
2320.0000 -67.47084 -62.97141 4.49943 2.59977 -63.39947 1189.71792
2325.0000 -68.50473 -64.76469 3.74004 2.53722 -64.00345 1126.51010
2330.0000 -68.36540 -64.45580 3.90960 2.49122 -64.44754 1084.51833
2335.0000 -68.21792 -64.11065 4.10727 2.56069 -63.77681 1055.56662
2340.0000 -68.28124 -63.67017 4.61107 2.50194 -64.34400 1089.40132
2345.0000 -68.06050 -63.11917 4.94133 2.58379 -63.55380 1152.61926
2350.0000 -66.91041 -63.45304 3.45737 2.63537 -63.05575 1177.23491
2355.0000 -67.33749 -63.27125 4.06625 2.60009 -63.39637 1091.76792
2360.0000 -67.50544 -62.79984 4.70560 2.64349 -62.97737 1166.52624
2365.0000 -66.71456 -62.54273 4.17183 2.67769 -62.64721 1115.52464
2370.0000 -67.64663 -62.71280 4.93383 2.69858 -62.44549 1229.47399
2375.0000 -69.01187 -64.33455 4.67732 2.55765 -63.80616 1138.90064
2380.0000 -68.13344 -63.81920 4.31424 2.49821 -64.38006 1089.40537
2385.0000 -67.79708 -63.50770 4.28938 2.57958 -63.59439 1144.53530
2390.0000 -68.38382 -64.59237 3.79145 2.58860 -63.50735 1149.18362
2395.0000 -68.08772 -64.90755 3.18017 2.37509 -65.56873 954.77154
2400.0000 -69.62499 -65.41564 4.20935 2.44917 -64.85352 1000.38322
2405.0000 -68.84068 -64.37735 4.46333 2.46689 -64.68247 1040.86135
2410.0000 -69.65053 -65.93359 3.71694 2.39182 -65.40728 993.30333
2415.0000 -68.62713 -64.30025 4.32689 2.44968 -64.84862 1025.47090
2420.0000 -68.16261 -64.15657 4.00604 2.48471 -64.51039 1011.85464
2425.0000 -69.00624 -63.57297 5.43327 2.51683 -64.20031 1057.25742
2430.0000 -67.98166 -64.02269 3.95897 2.58523 -63.53992 1139.42834
2435.0000 -67.99838 -63.16475 4.83362 2.58358 -63.55582 1164.47800
2440.0000 -68.29465 -64.31440 3.98025 2.58326 -63.55886 1161.62835
2445.0000 -68.53016 -63.80717 4.72299 2.64662 -62.94721 1235.31921
2450.0000 -69.09924 -65.12278 3.97646 2.50235 -64.34009 1043.47791
2455.0000 -68.10596 -62.60256 5.50340 2.56428 -63.74211 1105.87177
2460.0000 -68.33405 -62.91779 5.41626 2.62890 -63.11828 1154.56849
2465.0000 -67.29608 -63.23175 4.06433 2.55522 -63.82961 1113.46604
2470.0000 -68.10207 -64.17069 3.93138 2.56464 -63.73864 1118.26176
2475.0000 -68.54113 -64.74894 3.79220 2.44714 -64.87311 1031.34337
2480.0000 -69.49739 -65.19942 4.29797 2.46063 -64.74290 1052.76974
2485.0000 -69.48208 -65.20948 4.27260 2.38549 -65.46830 1031.68100
2490.0000 -69.26007 -64.90169 4.35839 2.51117 -64.25491 1129.59913
2495.0000 -68.56559 -64.43906 4.12653 2.49311 -64.42926 1051.37182
2500.0000 -68.81484 -64.56878 4.24606 2.51042 -64.26217 1060.92246
FREEZING PROCESS: loop number 11 T-loop= 1072.0000000000000
main_MD> interactions number 11 at Temperature= 1072.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 4.01167 3.34471 1.69777
force_rgl> df(natom) -0.00941 1.73375 -1.49591
2505.0000 -67.31895 -63.82302 3.49592 2.49566 -64.40471 1027.76875
2510.0000 -67.21769 -63.31547 3.90222 2.61281 -63.27361 1158.27556
2515.0000 -68.15358 -63.63062 4.52295 2.61476 -63.25474 1177.45624
2520.0000 -68.31804 -63.82048 4.49756 2.57184 -63.66917 1081.50315
2525.0000 -67.37789 -63.37273 4.00516 2.65153 -62.89980 1181.71000
2530.0000 -68.37533 -64.48873 3.88659 2.53206 -64.05324 1081.60002
2535.0000 -68.29085 -64.38271 3.90814 2.51147 -64.25199 1060.82821
2540.0000 -69.35286 -65.43438 3.91848 2.42424 -65.09420 998.28453
2545.0000 -68.59367 -65.41003 3.18364 2.39122 -65.41298 983.67136
2550.0000 -70.24507 -65.79774 4.44734 2.33257 -65.97926 909.66670
2555.0000 -70.39412 -66.78426 3.60986 2.32745 -66.02868 910.43012
2560.0000 -69.82612 -66.39987 3.42625 2.34859 -65.82457 945.43075
2565.0000 -69.86820 -66.53571 3.33250 2.31984 -66.10223 896.19325
2570.0000 -69.30843 -66.07817 3.23026 2.32230 -66.07844 912.60888
2575.0000 -68.90811 -65.41121 3.49690 2.32036 -66.09716 899.20412
2580.0000 -69.98106 -65.66346 4.31759 2.40334 -65.29602 972.66026
2585.0000 -68.66185 -64.49864 4.16320 2.38953 -65.42931 913.96976
2590.0000 -69.37720 -64.74725 4.62995 2.49718 -64.39001 1087.07398
2595.0000 -67.90751 -63.70466 4.20285 2.43494 -64.99094 1007.16663
2600.0000 -68.97509 -65.03653 3.93856 2.46630 -64.68812 981.43311
2605.0000 -69.97040 -65.83052 4.13988 2.37115 -65.60685 915.10318
2610.0000 -69.88928 -65.41005 4.47923 2.38926 -65.43194 969.71153
2615.0000 -67.28396 -64.08451 3.19946 2.41478 -65.18556 991.42231
2620.0000 -67.53324 -63.33259 4.20065 2.59388 -63.45632 1106.22699
2625.0000 -68.09906 -64.00346 4.09559 2.57346 -63.65349 1128.47378
2630.0000 -67.80949 -63.94038 3.86911 2.59009 -63.49297 1086.45134
2635.0000 -67.58023 -64.10214 3.47809 2.50277 -64.33598 1083.11763
2640.0000 -68.58508 -65.14857 3.43651 2.49914 -64.37105 1087.25469
2645.0000 -69.65384 -65.80908 3.84476 2.36351 -65.68059 978.18414
2650.0000 -69.54512 -66.11591 3.42922 2.35948 -65.71945 968.33687
2655.0000 -68.84692 -64.00809 4.83883 2.38985 -65.42623 1041.79134
2660.0000 -67.48666 -63.39780 4.08886 2.58496 -63.54251 1152.31908
2665.0000 -68.67487 -63.98378 4.69109 2.58656 -63.52701 1193.22097
2670.0000 -67.99838 -63.76042 4.23796 2.54433 -63.93477 1114.44449
2675.0000 -68.03836 -62.18546 5.85290 2.61421 -63.26008 1165.67334
2680.0000 -67.28765 -63.04463 4.24302 2.67049 -62.71672 1189.47505
2685.0000 -69.03430 -64.47112 4.56318 2.58785 -63.51455 1106.99821
2690.0000 -67.91993 -64.28387 3.63605 2.55181 -63.86257 1161.61990
2695.0000 -68.51108 -65.39185 3.11923 2.48915 -64.46748 1060.40443
2700.0000 -67.98309 -63.93165 4.05144 2.50363 -64.32768 1034.08086
2705.0000 -69.92066 -65.05038 4.87028 2.50567 -64.30806 1037.70745
2710.0000 -69.70785 -65.39480 4.31306 2.48308 -64.52615 1047.22036
2715.0000 -69.00251 -65.49724 3.50527 2.35054 -65.80576 904.54828
2720.0000 -68.91090 -65.35363 3.55727 2.37789 -65.54168 948.99206
2725.0000 -68.93996 -64.95814 3.98182 2.44135 -64.92903 983.01796
2730.0000 -67.65972 -64.13180 3.52792 2.49945 -64.36807 1052.02008
2735.0000 -69.11836 -65.50353 3.61483 2.43298 -65.00980 983.27353
2740.0000 -69.27311 -64.70692 4.56619 2.44589 -64.88523 1017.53463
2745.0000 -67.13828 -64.67780 2.46048 2.43802 -64.96117 1018.80794
2750.0000 -68.60212 -63.89864 4.70349 2.52552 -64.11634 1096.39442
FREEZING PROCESS: loop number 12 T-loop= 1047.0000000000000
main_MD> interactions number 12 at Temperature= 1047.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.15758 -0.20952 0.25697
force_rgl> df(natom) 4.60044 5.87032 -4.13950
2755.0000 -67.21056 -63.02591 4.18465 2.54081 -63.96875 1084.59613
2760.0000 -69.02689 -65.55998 3.46691 2.51306 -64.23664 1074.07604
2765.0000 -68.20346 -63.95367 4.24979 2.49100 -64.44965 1042.49976
2770.0000 -68.27610 -63.70834 4.56776 2.54547 -63.92373 1075.03049
2775.0000 -68.66209 -64.51893 4.14315 2.48513 -64.50636 1033.96756
2780.0000 -68.69657 -64.93848 3.75809 2.54324 -63.94529 1086.85017
2785.0000 -69.74153 -65.78852 3.95301 2.41378 -65.19522 994.28828
2790.0000 -67.93848 -63.89170 4.04678 2.43741 -64.96710 1008.90704
2795.0000 -67.57365 -64.29310 3.28055 2.50302 -64.33361 1063.06146
2800.0000 -67.36612 -63.23812 4.12800 2.58181 -63.57291 1109.86204
2805.0000 -68.31557 -64.32361 3.99196 2.55324 -63.84869 1049.50683
2810.0000 -67.52340 -63.12595 4.39745 2.53487 -64.02606 1063.83818
2815.0000 -69.08961 -64.06804 5.02158 2.55754 -63.80727 1054.28214
2820.0000 -69.07739 -64.92525 4.15214 2.45413 -64.80567 1030.15761
2825.0000 -69.60080 -66.09474 3.50605 2.36442 -65.67178 927.16528
2830.0000 -69.66275 -65.66131 4.00144 2.36218 -65.69341 953.69369
2835.0000 -67.73218 -64.53183 3.20035 2.42702 -65.06734 1001.99478
2840.0000 -67.56363 -63.55443 4.00920 2.58357 -63.55595 1130.26264
2845.0000 -67.69365 -62.23925 5.45440 2.67360 -62.68663 1232.74884
2850.0000 -67.43840 -62.14734 5.29106 2.69580 -62.47233 1229.42408
2855.0000 -68.66665 -63.85881 4.80784 2.69595 -62.47086 1292.62414
2860.0000 -68.86064 -65.48730 3.37333 2.51250 -64.24209 1110.98160
2865.0000 -69.59572 -65.53613 4.05959 2.39075 -65.41760 948.96312
2870.0000 -68.69510 -65.45708 3.23802 2.30274 -66.26731 876.23204
2875.0000 -68.85506 -65.73622 3.11884 2.34972 -65.81372 898.44807
2880.0000 -68.71487 -65.61997 3.09490 2.37700 -65.55034 948.15016
2885.0000 -68.88388 -64.59877 4.28512 2.42669 -65.07060 1001.90852
2890.0000 -67.26625 -63.57630 3.68995 2.55066 -63.87368 1088.49757
2895.0000 -67.89096 -64.36634 3.52462 2.53420 -64.03261 1083.30843
2900.0000 -67.76699 -63.27500 4.49199 2.57630 -63.62611 1154.58743
2905.0000 -68.27014 -63.24596 5.02418 2.61034 -63.29744 1139.85590
2910.0000 -67.80509 -63.66244 4.14265 2.57466 -63.64195 1119.26238
2915.0000 -69.05194 -64.96939 4.08255 2.44861 -64.85892 1013.45718
2920.0000 -70.23880 -66.43213 3.80667 2.32731 -66.03007 911.78237
2925.0000 -69.18928 -65.28288 3.90640 2.35909 -65.72321 963.86353
2930.0000 -67.75741 -64.23527 3.52214 2.40060 -65.32242 947.00999
2935.0000 -69.60224 -65.59242 4.00981 2.44032 -64.93896 992.47179
2940.0000 -68.76991 -63.88535 4.88456 2.50441 -64.32023 1073.70032
2945.0000 -68.79073 -64.62773 4.16301 2.50640 -64.30099 1073.40760
2950.0000 -69.15158 -65.41239 3.73919 2.36231 -65.69215 948.62784
2955.0000 -67.94833 -64.19951 3.74882 2.51105 -64.25606 1042.71630
2960.0000 -69.31523 -63.67332 5.64191 2.47464 -64.60761 1043.66794
2965.0000 -67.67812 -63.59242 4.08571 2.59100 -63.48414 1087.81134
2970.0000 -67.55783 -63.05688 4.50094 2.64235 -62.98838 1110.49555
2975.0000 -70.62926 -66.52432 4.10493 2.42674 -65.07011 1003.66796
2980.0000 -69.11218 -65.29505 3.81713 2.34588 -65.85074 959.49559
2985.0000 -68.09392 -64.32392 3.76999 2.53388 -64.03569 1109.89359
2990.0000 -67.03407 -63.62392 3.41015 2.53370 -64.03742 1097.97244
2995.0000 -69.27429 -64.11336 5.16094 2.54504 -63.92787 1097.19502
3000.0000 -68.74256 -65.14662 3.59593 2.46144 -64.73503 989.86616
FREEZING PROCESS: loop number 13 T-loop= 1022.0000000000000
main_MD> interactions number 13 at Temperature= 1022.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.06475 0.26892 0.61588
force_rgl> df(natom) 0.62876 -0.48645 -1.15368
3005.0000 -68.16186 -64.26530 3.89655 2.40456 -65.28420 983.67039
3010.0000 -68.41966 -65.00962 3.41004 2.45774 -64.77080 990.91923
3015.0000 -68.91274 -64.35972 4.55301 2.45787 -64.76955 1008.11810
3020.0000 -68.22076 -64.27965 3.94111 2.50691 -64.29608 1036.57927
3025.0000 -68.10314 -63.01611 5.08703 2.57002 -63.68675 1083.03960
3030.0000 -67.21688 -62.99871 4.21817 2.62159 -63.18887 1162.45183
3035.0000 -68.89785 -64.92912 3.96873 2.53243 -64.04964 1100.93634
3040.0000 -68.68520 -64.82634 3.85887 2.42510 -65.08589 996.77269
3045.0000 -68.54071 -63.94300 4.59771 2.51557 -64.21242 1052.48824
3050.0000 -68.57309 -63.85650 4.71659 2.49680 -64.39363 1019.91801
3055.0000 -69.28224 -65.52102 3.76122 2.48395 -64.51768 1023.82849
3060.0000 -68.74201 -64.65088 4.09112 2.44691 -64.87534 1029.94905
3065.0000 -68.04144 -63.55795 4.48349 2.51906 -64.17877 1079.22900
3070.0000 -66.55313 -62.23139 4.32174 2.62424 -63.16325 1144.99767
3075.0000 -66.40321 -61.63900 4.76421 2.76108 -61.84205 1313.94811
3080.0000 -67.00164 -62.56955 4.43209 2.71387 -62.29786 1230.52533
3085.0000 -68.21031 -63.97381 4.23650 2.58077 -63.58297 1149.46711
3090.0000 -68.26396 -63.72400 4.53996 2.57581 -63.63082 1091.79489
3095.0000 -67.01267 -62.60570 4.40697 2.57651 -63.62402 1107.49641
3100.0000 -67.70721 -63.24036 4.46684 2.57912 -63.59883 1095.18365
3105.0000 -69.16572 -63.98834 5.17738 2.58332 -63.55831 1135.72056
3110.0000 -67.49365 -63.48695 4.00671 2.61662 -63.23677 1164.32280
3115.0000 -67.85768 -63.64069 4.21699 2.59161 -63.47824 1173.05778
3120.0000 -68.25598 -64.74606 3.50992 2.49938 -64.36878 1049.38872
3125.0000 -68.81562 -65.10487 3.71075 2.46264 -64.72343 1037.27307
3130.0000 -67.87274 -64.51282 3.35992 2.55926 -63.79058 1078.97484
3135.0000 -68.99159 -65.21296 3.77863 2.41215 -65.21100 1035.88241
3140.0000 -68.08526 -64.43352 3.65174 2.45485 -64.79865 1048.59366
3145.0000 -67.53054 -63.45790 4.07264 2.55922 -63.79096 1065.28104
3150.0000 -69.39669 -65.61560 3.78109 2.51366 -64.23088 1070.23859
3155.0000 -69.29188 -64.95617 4.33571 2.34705 -65.83945 947.17815
3160.0000 -68.89641 -64.07866 4.81775 2.51584 -64.20984 1075.80207
3165.0000 -68.86615 -64.55669 4.30946 2.51694 -64.19917 1073.06775
3170.0000 -70.59756 -65.27675 5.32081 2.42530 -65.08400 1084.81450
3175.0000 -69.61422 -64.95996 4.65426 2.40823 -65.24883 1014.72900
3180.0000 -68.44902 -65.11660 3.33243 2.43180 -65.02126 990.82834
3185.0000 -69.10341 -63.85806 5.24536 2.46550 -64.69588 1008.04199
3190.0000 -68.30342 -64.56127 3.74215 2.52173 -64.15300 1033.35417
3195.0000 -68.29645 -64.16493 4.13152 2.54775 -63.90172 1172.17670
3200.0000 -68.53575 -64.82210 3.71365 2.39752 -65.35220 994.23109
3205.0000 -68.66254 -64.69310 3.96944 2.41020 -65.22981 1022.91580
3210.0000 -69.80504 -66.09326 3.71178 2.36204 -65.69475 945.96412
3215.0000 -69.02956 -64.89172 4.13784 2.40367 -65.29282 994.04199
3220.0000 -69.54298 -65.44934 4.09364 2.35441 -65.76839 979.28020
3225.0000 -68.00854 -64.28707 3.72147 2.44179 -64.92477 984.55366
3230.0000 -69.49125 -64.98186 4.50939 2.53924 -63.98393 1150.55974
3235.0000 -68.73062 -65.20808 3.52254 2.41947 -65.14024 1006.57676
3240.0000 -68.97992 -65.89709 3.08282 2.35500 -65.76276 908.58272
3245.0000 -68.05786 -64.00810 4.04976 2.47621 -64.59250 1038.40137
3250.0000 -67.87529 -63.79504 4.08025 2.52993 -64.07383 1016.53405
FREEZING PROCESS: loop number 14 T-loop= 997.00000000000000
main_MD> interactions number 14 at Temperature= 997.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.35225 -2.30830 1.37084
force_rgl> df(natom) -2.09884 -8.72546 -2.47162
3255.0000 -69.12418 -65.47578 3.64840 2.49382 -64.42248 1103.98885
3260.0000 -69.72755 -66.68112 3.04643 2.32175 -66.08380 895.93074
3265.0000 -69.34072 -64.69999 4.64074 2.40030 -65.32534 999.63339
3270.0000 -69.05254 -64.20924 4.84330 2.44623 -64.88188 997.98614
3275.0000 -69.65671 -65.25960 4.39712 2.48234 -64.53328 1095.58661
3280.0000 -70.11615 -65.29659 4.81956 2.37784 -65.54220 998.93814
3285.0000 -70.03309 -65.56881 4.46427 2.46094 -64.73988 1075.43714
3290.0000 -68.81073 -65.60411 3.20663 2.33580 -65.94806 903.13780
3295.0000 -70.10129 -66.19836 3.90293 2.31368 -66.16165 882.31309
3300.0000 -68.47804 -64.20800 4.27003 2.42453 -65.09142 994.37650
3305.0000 -69.43533 -65.03423 4.40110 2.47771 -64.57794 1025.05524
3310.0000 -70.42307 -66.42515 3.99791 2.32144 -66.08675 906.17539
3315.0000 -69.11450 -64.94788 4.16663 2.40269 -65.30231 973.52551
3320.0000 -70.14862 -65.70315 4.44547 2.45585 -64.78907 1051.73591
3325.0000 -69.30218 -65.77115 3.53103 2.34655 -65.84429 916.62704
3330.0000 -68.41315 -65.34126 3.07190 2.39873 -65.34050 997.02268
3335.0000 -70.04448 -65.72218 4.32229 2.36937 -65.62395 899.84185
3340.0000 -68.13412 -64.69413 3.43999 2.47413 -64.61256 997.68113
3345.0000 -68.14079 -63.93624 4.20455 2.53620 -64.01323 1010.90841
3350.0000 -69.10621 -65.68313 3.42308 2.48083 -64.54785 1042.24767
3355.0000 -69.86957 -66.55942 3.31015 2.33672 -65.93922 870.27713
3360.0000 -69.63958 -65.06336 4.57622 2.41611 -65.17274 975.14056
3365.0000 -68.67212 -65.02702 3.64510 2.44973 -64.84813 1027.85864
3370.0000 -68.29028 -63.33261 4.95767 2.48736 -64.48479 1097.15723
3375.0000 -66.84059 -62.58123 4.25936 2.64573 -62.95578 1214.75258
3380.0000 -68.07931 -64.14143 3.93789 2.62208 -63.18413 1121.82038
3385.0000 -68.33436 -64.73350 3.60086 2.45819 -64.76648 1025.36569
3390.0000 -66.79777 -63.31101 3.48676 2.56715 -63.71449 1121.25364
3395.0000 -67.93230 -64.34836 3.58394 2.60391 -63.35955 1129.13980
3400.0000 -69.04355 -65.16561 3.87794 2.38435 -65.47936 916.06730
3405.0000 -69.22827 -65.32698 3.90129 2.39330 -65.39292 957.04395
3410.0000 -68.15185 -64.06283 4.08903 2.47782 -64.57688 1062.53356
3415.0000 -68.40982 -64.20084 4.20898 2.54373 -63.94055 1061.51307
3420.0000 -69.49061 -65.87891 3.61170 2.43254 -65.01407 975.30385
3425.0000 -68.49055 -65.32448 3.16607 2.43375 -65.00245 1050.02899
3430.0000 -67.94328 -65.16220 2.78107 2.42416 -65.09497 934.00406
3435.0000 -69.27067 -64.65004 4.62063 2.41346 -65.19831 927.60592
3440.0000 -68.66605 -66.07456 2.59148 2.40589 -65.27138 967.92422
3445.0000 -68.89473 -65.26018 3.63455 2.38364 -65.48621 927.69862
3450.0000 -69.47609 -66.47713 2.99896 2.40435 -65.28624 983.65813
3455.0000 -70.19700 -66.49465 3.70235 2.30602 -66.23561 901.52105
3460.0000 -68.21631 -63.54912 4.66719 2.40376 -65.29192 1002.74523
3465.0000 -67.36114 -64.65012 2.71102 2.47988 -64.55706 1033.46835
3470.0000 -67.87191 -64.04424 3.82767 2.49292 -64.43111 1017.71423
3475.0000 -68.67310 -65.69342 2.97967 2.41993 -65.13587 949.02645
3480.0000 -69.30021 -64.91801 4.38221 2.41231 -65.20945 1016.71074
3485.0000 -68.63558 -64.59319 4.04239 2.44923 -64.85296 1028.05394
3490.0000 -68.96096 -64.74197 4.21900 2.49859 -64.37634 1011.87738
3495.0000 -68.28645 -64.67756 3.60889 2.47179 -64.63508 1004.13894
3500.0000 -68.52131 -65.52418 2.99713 2.42788 -65.05911 1014.14293
FREEZING PROCESS: loop number 15 T-loop= 972.00000000000000
main_MD> interactions number 15 at Temperature= 972.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.77158 -1.20443 1.09046
force_rgl> df(natom) -3.14977 1.60422 0.04693
3505.0000 -69.55464 -66.00206 3.55259 2.36805 -65.63675 893.71065
3510.0000 -70.36580 -66.79654 3.56926 2.28205 -66.46703 882.05780
3515.0000 -68.84727 -65.56699 3.28028 2.29194 -66.37157 902.52876
3520.0000 -69.00090 -63.97234 5.02855 2.40777 -65.25325 952.43934
3525.0000 -68.35108 -64.28157 4.06950 2.47750 -64.57996 1072.32048
3530.0000 -68.85864 -64.67579 4.18285 2.42101 -65.12544 994.52823
3535.0000 -69.46214 -65.18792 4.27421 2.47090 -64.64375 1073.96350
3540.0000 -68.53184 -65.25070 3.28114 2.48472 -64.51034 1010.21619
3545.0000 -68.18337 -63.71893 4.46444 2.46458 -64.70478 966.90057
3550.0000 -67.47418 -63.64290 3.83128 2.55025 -63.87763 1107.56003
3555.0000 -70.10893 -65.22851 4.88042 2.54219 -63.95541 1044.15849
3560.0000 -68.99636 -66.21134 2.78502 2.38795 -65.44464 925.90017
3565.0000 -70.48211 -66.54817 3.93394 2.26177 -66.66282 850.03915
3570.0000 -68.28975 -65.20657 3.08318 2.35069 -65.80432 974.07074
3575.0000 -68.21594 -64.19108 4.02485 2.54321 -63.94557 1120.68634
3580.0000 -68.50639 -64.78125 3.72514 2.50792 -64.28629 1057.44896
3585.0000 -70.05743 -65.19409 4.86333 2.45703 -64.77759 1016.20345
3590.0000 -69.03165 -66.65111 2.38054 2.29688 -66.32387 881.56617
3595.0000 -69.17491 -65.45529 3.71962 2.32984 -66.00566 911.98213
3600.0000 -68.99710 -65.75983 3.23727 2.40061 -65.32239 973.68292
3605.0000 -69.23463 -66.59239 2.64224 2.28224 -66.46519 848.69401
3610.0000 -68.98528 -64.71105 4.27424 2.33864 -65.92065 927.63707
3615.0000 -69.42284 -66.24550 3.17734 2.38278 -65.49454 947.12240
3620.0000 -70.33446 -66.13436 4.20010 2.36111 -65.70369 950.60226
3625.0000 -69.42916 -66.12215 3.30700 2.32058 -66.09503 860.27100
3630.0000 -70.27605 -66.39716 3.87889 2.32034 -66.09739 896.45784
3635.0000 -69.66323 -66.11859 3.54464 2.36188 -65.69633 934.14722
3640.0000 -68.64288 -64.93175 3.71112 2.35561 -65.75685 900.57980
3645.0000 -68.30857 -63.49010 4.81846 2.46962 -64.65603 1004.85738
3650.0000 -70.29133 -66.99126 3.30007 2.44152 -64.92737 1009.11685
3655.0000 -69.21426 -65.95541 3.25885 2.32835 -66.01999 931.50154
3660.0000 -69.22683 -65.76777 3.45907 2.32202 -66.08113 902.97839
3665.0000 -68.43771 -65.66029 2.77742 2.41849 -65.14974 980.69689
3670.0000 -69.17374 -65.62049 3.55326 2.37834 -65.53735 940.83110
3675.0000 -69.13129 -65.49776 3.63353 2.38570 -65.46629 964.76191
3680.0000 -68.66426 -64.82953 3.83473 2.46389 -64.71136 1057.47541
3685.0000 -69.05038 -64.14717 4.90321 2.47100 -64.64279 1071.07805
3690.0000 -69.24972 -65.38482 3.86489 2.47347 -64.61893 1044.93453
3695.0000 -67.99071 -63.97193 4.01878 2.42902 -65.04809 991.97881
3700.0000 -69.01214 -65.97133 3.04081 2.41461 -65.18721 1000.04148
3705.0000 -69.73464 -65.96663 3.76802 2.36407 -65.67514 963.60866
3710.0000 -68.72368 -66.12761 2.59607 2.30366 -66.25841 850.18232
3715.0000 -69.38813 -66.18717 3.20096 2.30499 -66.24554 888.45767
3720.0000 -70.02381 -66.64771 3.37610 2.27547 -66.53060 881.17793
3725.0000 -67.71321 -64.72636 2.98685 2.36524 -65.66381 919.14264
3730.0000 -69.03729 -65.96382 3.07347 2.36423 -65.67363 970.42417
3735.0000 -69.82661 -66.05446 3.77215 2.32812 -66.02226 891.03422
3740.0000 -70.16050 -66.26341 3.89709 2.33541 -65.95188 970.93777
3745.0000 -69.65219 -66.21426 3.43793 2.31494 -66.14946 906.57258
3750.0000 -69.59683 -64.75436 4.84248 2.35759 -65.73770 938.28878
FREEZING PROCESS: loop number 16 T-loop= 947.00000000000000
main_MD> interactions number 16 at Temperature= 947.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.61999 1.58053 -1.96227
force_rgl> df(natom) -0.14259 -0.79471 -1.90461
3755.0000 -66.39348 -63.49837 2.89511 2.54278 -63.94972 1114.20963
3760.0000 -68.12999 -63.61705 4.51294 2.64995 -62.91497 1261.67054
3765.0000 -68.08219 -64.95734 3.12485 2.49250 -64.43513 1076.93635
3770.0000 -68.94160 -65.50732 3.43428 2.39274 -65.39833 990.76226
3775.0000 -68.41283 -64.09423 4.31861 2.42332 -65.10307 1008.21591
3780.0000 -68.86991 -64.23654 4.63338 2.45665 -64.78129 1030.69687
3785.0000 -67.90853 -64.48918 3.41935 2.45363 -64.81045 974.39918
3790.0000 -69.68193 -65.87638 3.80556 2.39703 -65.35693 972.23851
3795.0000 -69.48342 -66.01971 3.46371 2.30334 -66.26145 929.51474
3800.0000 -67.54097 -63.63566 3.90532 2.48638 -64.49423 1077.14867
3805.0000 -68.55527 -64.39143 4.16384 2.47706 -64.58425 1001.36045
3810.0000 -69.18640 -65.89168 3.29472 2.38208 -65.50126 957.07225
3815.0000 -69.03056 -64.88137 4.14919 2.37572 -65.56269 949.83954
3820.0000 -69.02334 -65.17101 3.85233 2.41769 -65.15750 978.72024
3825.0000 -69.21667 -66.08760 3.12907 2.39765 -65.35095 997.28605
3830.0000 -68.81521 -64.80279 4.01242 2.36260 -65.68934 928.87024
3835.0000 -68.07006 -62.89356 5.17650 2.60173 -63.38054 1145.53606
3840.0000 -68.11824 -63.88957 4.22868 2.58162 -63.57469 1105.24701
3845.0000 -68.05063 -64.37873 3.67190 2.48287 -64.52813 1036.52899
3850.0000 -69.06556 -66.56150 2.50406 2.43793 -64.96205 1009.49553
3855.0000 -69.43585 -65.82420 3.61165 2.30237 -66.27088 866.85787
3860.0000 -68.48068 -65.22841 3.25227 2.40123 -65.31637 992.90355
3865.0000 -70.03900 -67.10735 2.93165 2.29068 -66.38372 895.79852
3870.0000 -70.20472 -65.65920 4.54552 2.33772 -65.92959 958.96414
3875.0000 -68.69941 -65.26191 3.43751 2.34830 -65.82738 938.83783
3880.0000 -68.80283 -64.99778 3.80505 2.38574 -65.46593 916.79803
3885.0000 -69.47453 -64.75196 4.72257 2.43465 -64.99367 1021.16090
3890.0000 -69.12385 -64.49550 4.62835 2.47217 -64.63146 1018.98944
3895.0000 -67.72111 -63.62278 4.09833 2.48745 -64.48390 1080.14175
3900.0000 -68.69030 -63.29372 5.39657 2.56273 -63.75710 1071.14139
3905.0000 -68.05200 -64.45354 3.59846 2.54834 -63.89602 1070.21964
3910.0000 -68.32052 -63.93171 4.38880 2.52324 -64.13843 1055.59293
3915.0000 -68.76082 -65.38649 3.37433 2.43293 -65.01032 1028.05255
3920.0000 -68.99361 -64.59856 4.39505 2.44437 -64.89991 981.84645
3925.0000 -68.90451 -66.06644 2.83807 2.39517 -65.37493 974.67393
3930.0000 -68.80658 -64.39926 4.40732 2.46849 -64.66697 1088.92196
3935.0000 -68.34736 -65.03887 3.30849 2.41902 -65.14462 1013.78788
3940.0000 -68.49057 -64.93573 3.55484 2.45040 -64.84162 968.22005
3945.0000 -68.88701 -64.15678 4.73023 2.50967 -64.26938 1029.27387
3950.0000 -68.61705 -64.84185 3.77521 2.47152 -64.63776 1069.81159
3955.0000 -69.80048 -66.66671 3.13377 2.40005 -65.32779 948.97441
3960.0000 -69.39822 -65.71883 3.67938 2.37046 -65.61348 954.77484
3965.0000 -68.95978 -65.42996 3.52982 2.45700 -64.77792 999.34388
3970.0000 -69.62624 -65.78039 3.84585 2.40960 -65.23561 950.80503
3975.0000 -68.72787 -65.43341 3.29446 2.39254 -65.40024 962.20882
3980.0000 -69.25676 -65.68850 3.56826 2.34662 -65.84363 944.80738
3985.0000 -69.81142 -66.07358 3.73783 2.32821 -66.02137 927.26172
3990.0000 -69.35333 -66.39310 2.96022 2.28802 -66.40943 886.88343
3995.0000 -70.36285 -67.31094 3.05191 2.25133 -66.76363 851.04112
4000.0000 -68.68473 -65.58796 3.09677 2.31276 -66.17054 873.66674
FREEZING PROCESS: loop number 17 T-loop= 922.00000000000000
main_MD> interactions number 17 at Temperature= 922.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.87094 1.15101 -0.38243
force_rgl> df(natom) -0.75420 -3.92384 -1.76547
4005.0000 -69.27944 -65.67903 3.60041 2.45390 -64.80788 1027.29961
4010.0000 -70.37410 -65.55139 4.82271 2.41047 -65.22718 975.12787
4015.0000 -69.97218 -66.67941 3.29277 2.29574 -66.33485 883.86113
4020.0000 -70.30525 -66.90229 3.40296 2.26446 -66.63684 841.35798
4025.0000 -69.58690 -66.46778 3.11912 2.31966 -66.10389 904.40843
4030.0000 -68.76168 -66.00347 2.75821 2.28273 -66.46046 838.58733
4035.0000 -70.20778 -66.93213 3.27565 2.28303 -66.45760 827.73657
4040.0000 -70.05751 -67.11400 2.94351 2.24441 -66.83047 828.67311
4045.0000 -69.98183 -66.34096 3.64087 2.28947 -66.39538 846.80879
4050.0000 -70.46699 -67.32269 3.14430 2.26730 -66.60944 812.48121
4055.0000 -70.09313 -65.18308 4.91005 2.20170 -67.24279 765.01449
4060.0000 -68.49524 -65.34557 3.14967 2.37578 -65.56214 970.83953
4065.0000 -70.06889 -65.87545 4.19344 2.38148 -65.50710 952.26293
4070.0000 -69.25016 -65.89570 3.35446 2.28559 -66.43289 831.43907
4075.0000 -69.64827 -65.18167 4.46661 2.40124 -65.31633 1033.11905
4080.0000 -68.81330 -65.51475 3.29855 2.35627 -65.75051 893.15431
4085.0000 -68.73989 -64.10578 4.63411 2.47309 -64.62261 1011.75310
4090.0000 -68.72442 -64.43451 4.28991 2.50522 -64.31237 1052.60593
4095.0000 -68.61403 -64.80435 3.80968 2.47150 -64.63795 1025.50200
4100.0000 -68.15074 -64.75090 3.39984 2.44883 -64.85682 1035.58324
4105.0000 -68.56606 -65.17138 3.39469 2.47419 -64.61193 1063.20452
4110.0000 -69.64407 -66.61045 3.03362 2.41477 -65.18568 984.67137
4115.0000 -70.54926 -66.75902 3.79024 2.23283 -66.94225 818.11840
4120.0000 -69.47909 -66.35103 3.12807 2.24802 -66.79559 826.76784
4125.0000 -69.34544 -65.92452 3.42092 2.29610 -66.33138 833.30532
4130.0000 -71.13441 -67.10452 4.02990 2.29645 -66.32799 898.50736
4135.0000 -69.35115 -65.23285 4.11830 2.34096 -65.89826 932.48505
4140.0000 -68.31620 -64.37117 3.94503 2.39874 -65.34045 984.81507
4145.0000 -68.52710 -63.75477 4.77233 2.52202 -64.15021 1083.22843
4150.0000 -68.30198 -65.49846 2.80352 2.46772 -64.67440 1017.17379
4155.0000 -69.68592 -65.08891 4.59701 2.42908 -65.04745 985.93220
4160.0000 -69.65067 -65.66302 3.98764 2.39676 -65.35950 912.18089
4165.0000 -69.62118 -65.44658 4.17459 2.36282 -65.68722 949.80745
4170.0000 -69.92083 -66.27835 3.64248 2.35439 -65.76859 930.71483
4175.0000 -69.62520 -66.55776 3.06744 2.28955 -66.39464 893.66537
4180.0000 -70.50314 -67.30626 3.19689 2.23221 -66.94824 803.15202
4185.0000 -69.83868 -65.34218 4.49650 2.33263 -65.97873 915.57204
4190.0000 -68.73482 -65.21240 3.52242 2.42268 -65.10932 1000.19767
4195.0000 -69.94352 -66.13795 3.80557 2.37541 -65.56565 923.33078
4200.0000 -69.30266 -65.58823 3.71443 2.35587 -65.75433 932.50985
4205.0000 -69.90582 -66.70597 3.19985 2.33634 -65.94290 934.16853
4210.0000 -69.13399 -65.51177 3.62222 2.31326 -66.16575 882.24941
4215.0000 -68.66348 -64.45531 4.20817 2.42915 -65.04678 944.25185
4220.0000 -69.00716 -65.42371 3.58345 2.39591 -65.36772 969.07611
4225.0000 -68.59603 -65.59557 3.00045 2.37374 -65.58184 927.61296
4230.0000 -69.24572 -66.27243 2.97329 2.32267 -66.07484 884.13233
4235.0000 -69.21134 -66.22128 2.99006 2.26788 -66.60386 860.11776
4240.0000 -68.72086 -65.46566 3.25520 2.34900 -65.82065 935.28064
4245.0000 -68.77843 -65.26303 3.51540 2.41428 -65.19043 950.38005
4250.0000 -69.51466 -66.20928 3.30538 2.34211 -65.88716 900.86143
FREEZING PROCESS: loop number 18 T-loop= 897.00000000000000
main_MD> interactions number 18 at Temperature= 897.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.61308 -3.00973 -3.01629
force_rgl> df(natom) 0.65277 0.57315 0.86484
4255.0000 -68.53010 -64.96841 3.56169 2.38072 -65.51442 926.32306
4260.0000 -68.98235 -65.45767 3.52468 2.36435 -65.67249 925.86200
4265.0000 -69.30840 -65.74821 3.56019 2.40315 -65.29784 1011.05735
4270.0000 -69.35768 -65.90122 3.45646 2.39100 -65.41515 958.32354
4275.0000 -69.28252 -66.46667 2.81585 2.29139 -66.37687 843.23777
4280.0000 -69.31058 -65.67532 3.63527 2.27423 -66.54253 839.15179
4285.0000 -69.43498 -66.11324 3.32174 2.29245 -66.36661 858.98617
4290.0000 -69.95509 -65.42581 4.52928 2.37768 -65.54376 963.57286
4295.0000 -68.91210 -65.57911 3.33298 2.38420 -65.48082 923.90566
4300.0000 -69.20652 -65.71565 3.49086 2.31359 -66.16251 907.51370
4305.0000 -68.38180 -65.55950 2.82230 2.34771 -65.83312 870.88633
4310.0000 -69.75275 -66.15053 3.60222 2.33347 -65.97059 916.80236
4315.0000 -70.60539 -67.87661 2.72878 2.15940 -67.65119 764.95694
4320.0000 -71.29164 -67.18656 4.10508 2.14030 -67.83564 703.73658
4325.0000 -70.57752 -66.59453 3.98299 2.21747 -67.09054 853.17791
4330.0000 -69.50367 -65.08576 4.41791 2.35088 -65.80248 964.88056
4335.0000 -69.21772 -66.14131 3.07640 2.33982 -65.90933 932.56020
4340.0000 -70.27224 -67.01041 3.26184 2.29234 -66.36770 887.52928
4345.0000 -70.33899 -67.81886 2.52014 2.17377 -67.51244 783.15325
4350.0000 -70.99689 -68.15405 2.84285 2.10991 -68.12903 711.18140
4355.0000 -70.14386 -66.94543 3.19842 2.14811 -67.76025 735.26697
4360.0000 -69.60498 -67.16471 2.44027 2.23375 -66.93334 860.78309
4365.0000 -70.30185 -66.76858 3.53328 2.29700 -66.32275 879.47534
4370.0000 -70.23449 -66.65065 3.58383 2.26951 -66.58815 869.26985
4375.0000 -69.89886 -65.80266 4.09620 2.28276 -66.46021 897.40590
4380.0000 -70.23678 -67.47396 2.76281 2.23118 -66.95823 794.48057
4385.0000 -70.81129 -67.86737 2.94392 2.17688 -67.48243 779.19569
4390.0000 -70.08913 -66.49065 3.59848 2.18608 -67.39364 787.94960
4395.0000 -70.03743 -66.31732 3.72011 2.25930 -66.68673 813.86041
4400.0000 -68.20716 -64.91304 3.29413 2.40819 -65.24918 1025.03488
4405.0000 -69.74688 -65.50869 4.23820 2.43440 -64.99617 994.91041
4410.0000 -69.96738 -66.24642 3.72096 2.32493 -66.05309 913.23776
4415.0000 -70.13780 -66.25518 3.88263 2.31173 -66.18050 897.19651
4420.0000 -71.32044 -68.04443 3.27600 2.23040 -66.96577 844.32418
4425.0000 -70.71347 -66.56123 4.15224 2.13718 -67.86573 733.37151
4430.0000 -68.74751 -65.99875 2.74877 2.31848 -66.11528 902.10771
4435.0000 -70.39271 -67.64126 2.75145 2.27244 -66.55987 842.75701
4440.0000 -70.99375 -68.17444 2.81931 2.14199 -67.81933 725.75936
4445.0000 -69.99464 -65.66153 4.33311 2.18882 -67.36721 812.80915
4450.0000 -69.89054 -66.00796 3.88259 2.38968 -65.42787 971.73009
4455.0000 -70.22020 -67.14408 3.07613 2.26071 -66.67309 837.47651
4460.0000 -70.43913 -66.74040 3.69873 2.21386 -67.12542 814.17758
4465.0000 -70.23341 -67.62757 2.60585 2.22772 -66.99156 797.69156
4470.0000 -70.72083 -67.52578 3.19505 2.20375 -67.22300 786.48665
4475.0000 -71.06478 -69.01981 2.04497 2.08655 -68.35457 691.88239
4480.0000 -70.39334 -66.78507 3.60826 2.20330 -67.22737 802.19943
4485.0000 -70.10854 -66.37818 3.73036 2.24984 -66.77806 853.43223
4490.0000 -70.72761 -67.09994 3.62767 2.27395 -66.54521 904.84411
4495.0000 -70.13512 -67.35445 2.78066 2.16358 -67.61085 782.04307
4500.0000 -69.52903 -66.57182 2.95721 2.26734 -66.60907 860.03294
FREEZING PROCESS: loop number 19 T-loop= 872.00000000000000
main_MD> interactions number 19 at Temperature= 872.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.96543 0.03230 -2.42941
force_rgl> df(natom) -0.33926 -3.15867 0.43001
4505.0000 -69.67360 -66.22688 3.44673 2.30990 -66.19814 904.94438
4510.0000 -68.31060 -65.48525 2.82535 2.34180 -65.89019 899.11928
4515.0000 -68.34993 -64.71715 3.63278 2.44470 -64.89668 933.16581
4520.0000 -68.85249 -65.40719 3.44530 2.41442 -65.18902 948.54526
4525.0000 -70.32000 -66.51186 3.80815 2.26222 -66.65846 842.39680
4530.0000 -70.26404 -66.05278 4.21126 2.27934 -66.49323 886.76513
4535.0000 -69.16231 -65.58287 3.57944 2.42150 -65.12070 992.86515
4540.0000 -69.26197 -65.37603 3.88594 2.41256 -65.20697 1009.98915
4545.0000 -69.15298 -65.22598 3.92700 2.37011 -65.61683 916.53521
4550.0000 -69.42765 -65.87791 3.54973 2.37499 -65.56974 913.76485
4555.0000 -70.90805 -67.80631 3.10174 2.18074 -67.44519 790.41460
4560.0000 -69.73150 -66.32477 3.40673 2.26108 -66.66952 859.41261
4565.0000 -69.63282 -65.77804 3.85478 2.31853 -66.11480 921.62615
4570.0000 -69.25700 -66.04589 3.21110 2.40265 -65.30264 1071.34486
4575.0000 -68.95818 -65.13949 3.81869 2.35427 -65.76978 941.04071
4580.0000 -70.27406 -66.59630 3.67775 2.32291 -66.07257 903.48788
4585.0000 -69.20579 -65.36630 3.83949 2.29867 -66.30657 855.74062
4590.0000 -69.22686 -66.34427 2.88259 2.33874 -65.91974 894.33204
4595.0000 -68.86810 -65.04628 3.82182 2.36652 -65.65151 903.59969
4600.0000 -69.66058 -65.82872 3.83186 2.38598 -65.46362 960.73268
4605.0000 -70.41034 -67.33016 3.08018 2.24695 -66.80590 833.44933
4610.0000 -69.80648 -66.68216 3.12432 2.21150 -67.14818 803.37916
4615.0000 -70.36533 -67.29369 3.07164 2.27694 -66.51634 897.32779
4620.0000 -70.59415 -67.92993 2.66422 2.21972 -67.06884 812.68536
4625.0000 -70.90573 -67.88360 3.02213 2.13804 -67.85749 778.40985
4630.0000 -70.58102 -67.77801 2.80301 2.12056 -68.02617 755.44219
4635.0000 -69.12354 -65.50059 3.62296 2.31525 -66.14655 867.65677
4640.0000 -69.93704 -65.49403 4.44301 2.36104 -65.70443 903.21063
4645.0000 -69.71718 -66.38533 3.33184 2.32006 -66.10003 848.06502
4650.0000 -69.64175 -67.04552 2.59623 2.28165 -66.47089 824.85990
4655.0000 -70.28687 -66.92251 3.36436 2.25271 -66.75034 837.58982
4660.0000 -69.21580 -66.34552 2.87028 2.34521 -65.85725 938.27840
4665.0000 -70.46922 -66.63540 3.83382 2.26730 -66.60944 845.49644
4670.0000 -68.69187 -65.52851 3.16335 2.35188 -65.79286 897.27109
4675.0000 -70.48121 -66.26942 4.21180 2.33576 -65.94848 938.30804
4680.0000 -69.41352 -65.72421 3.68932 2.29381 -66.35354 886.39438
4685.0000 -70.13895 -66.76354 3.37541 2.25884 -66.69116 838.13035
4690.0000 -69.58770 -66.29579 3.29192 2.27374 -66.54732 908.48449
4695.0000 -68.46778 -65.01740 3.45038 2.37332 -65.58585 885.19014
4700.0000 -68.70317 -64.82296 3.88021 2.40642 -65.26624 958.23899
4705.0000 -69.30109 -64.73841 4.56268 2.43039 -65.03484 1045.94477
4710.0000 -68.83402 -65.16153 3.67248 2.43534 -64.98705 981.04314
4715.0000 -70.11487 -66.71128 3.40359 2.35669 -65.74639 939.73012
4720.0000 -69.98931 -66.60627 3.38304 2.23349 -66.93589 802.19600
4725.0000 -70.27316 -66.17399 4.09917 2.30000 -66.29379 896.04013
4730.0000 -70.21385 -66.60663 3.60722 2.27453 -66.53965 919.08692
4735.0000 -69.80717 -66.28896 3.51822 2.27358 -66.54878 891.34806
4740.0000 -68.71635 -64.67811 4.03825 2.33551 -65.95088 889.30881
4745.0000 -68.24689 -65.18184 3.06505 2.44540 -64.88990 981.53233
4750.0000 -69.47199 -64.67345 4.79854 2.44722 -64.87234 1007.86323
FREEZING PROCESS: loop number 20 T-loop= 847.00000000000000
main_MD> interactions number 20 at Temperature= 847.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.39078 0.12005 -3.17473
force_rgl> df(natom) -4.54622 3.67355 -2.27699
4755.0000 -68.96764 -66.39294 2.57470 2.35059 -65.80528 937.43893
4760.0000 -69.45075 -66.67462 2.77613 2.21752 -67.09003 827.37511
4765.0000 -70.58380 -66.28506 4.29874 2.27853 -66.50100 834.32282
4770.0000 -70.31527 -67.72378 2.59149 2.25427 -66.73523 820.09897
4775.0000 -68.95768 -65.90678 3.05091 2.23131 -66.95692 827.13724
4780.0000 -68.85863 -64.83516 4.02346 2.40583 -65.27199 956.61469
4785.0000 -69.04282 -65.50769 3.53513 2.39433 -65.38302 957.21175
4790.0000 -70.00311 -66.71929 3.28382 2.34706 -65.83934 881.26702
4795.0000 -69.57635 -66.48182 3.09453 2.28926 -66.39740 918.12829
4800.0000 -69.96474 -67.03034 2.93441 2.23153 -66.95478 836.78257
4805.0000 -69.44484 -66.30642 3.13842 2.24807 -66.79509 791.00231
4810.0000 -69.94887 -66.71024 3.23863 2.27483 -66.53680 894.45391
4815.0000 -69.11535 -66.27956 2.83579 2.32533 -66.04917 915.98940
4820.0000 -69.16060 -66.26277 2.89784 2.32457 -66.05657 846.62919
4825.0000 -69.64253 -66.04334 3.59919 2.27909 -66.49563 825.72371
4830.0000 -70.00021 -66.95796 3.04226 2.28285 -66.45932 878.29592
4835.0000 -70.42190 -67.39537 3.02654 2.17110 -67.53829 780.22943
4840.0000 -70.55617 -67.98425 2.57193 2.21555 -67.10909 801.24185
4845.0000 -70.36672 -67.58011 2.78660 2.18481 -67.40584 768.81572
4850.0000 -68.89253 -65.78377 3.10876 2.27118 -66.57198 874.38025
4855.0000 -68.89912 -64.99974 3.89938 2.36568 -65.65965 935.36350
4860.0000 -69.56107 -66.26560 3.29547 2.33906 -65.91666 910.59621
4865.0000 -70.08824 -66.47341 3.61483 2.30133 -66.28094 878.21763
4870.0000 -70.22246 -66.44651 3.77595 2.31319 -66.16639 876.47256
4875.0000 -69.74466 -66.29564 3.44902 2.31724 -66.12729 897.18126
4880.0000 -69.80097 -66.58379 3.21719 2.31704 -66.12925 872.47756
4885.0000 -69.41880 -65.68227 3.73653 2.33519 -65.95394 952.25702
4890.0000 -70.53812 -67.41195 3.12617 2.31991 -66.10156 908.01957
4895.0000 -69.59408 -66.08833 3.50575 2.23987 -66.87425 837.59961
4900.0000 -70.35165 -67.26522 3.08643 2.23050 -66.96480 826.00619
4905.0000 -70.47192 -66.58412 3.88780 2.24807 -66.79509 850.05395
4910.0000 -69.25838 -66.01442 3.24396 2.29153 -66.37552 840.63476
4915.0000 -70.43407 -67.01325 3.42081 2.29589 -66.33346 921.73709
4920.0000 -70.29415 -66.99024 3.30391 2.23924 -66.88038 748.57912
4925.0000 -69.80373 -65.62086 4.18287 2.30697 -66.22647 873.12420
4930.0000 -68.66485 -65.67052 2.99434 2.36469 -65.66915 909.29710
4935.0000 -69.65632 -65.99057 3.66575 2.38095 -65.51220 977.47987
4940.0000 -70.20260 -66.55095 3.65165 2.25627 -66.71597 804.30000
4945.0000 -70.53603 -67.37456 3.16147 2.26816 -66.60120 855.58639
4950.0000 -69.43642 -66.41998 3.01643 2.23807 -66.89170 773.09033
4955.0000 -68.92956 -65.84765 3.08191 2.36998 -65.61813 974.13223
4960.0000 -69.36966 -66.93029 2.43937 2.27992 -66.48757 853.00591
4965.0000 -70.10415 -67.28030 2.82385 2.22112 -67.05528 792.30204
4970.0000 -70.23870 -66.17229 4.06641 2.19873 -67.27148 795.59962
4975.0000 -70.98378 -67.29849 3.68529 2.24655 -66.80985 835.37780
4980.0000 -70.30176 -66.13533 4.16643 2.25365 -66.74128 827.83030
4985.0000 -69.45075 -65.34257 4.10818 2.39196 -65.40584 973.57703
4990.0000 -68.85313 -64.94095 3.91218 2.43248 -65.01465 964.05087
4995.0000 -70.82658 -68.30435 2.52222 2.28350 -66.45304 845.80198
5000.0000 -69.86090 -67.01978 2.84112 2.23428 -66.92826 812.04486
FREEZING PROCESS: loop number 21 T-loop= 822.00000000000000
main_MD> interactions number 21 at Temperature= 822.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -2.23017 -3.03268 -2.02309
force_rgl> df(natom) 4.49263 -2.45884 1.18828
5005.0000 -70.14437 -67.74015 2.40422 2.17189 -67.53061 772.00736
5010.0000 -71.02743 -68.17376 2.85367 2.08116 -68.40661 698.55173
5015.0000 -71.41850 -68.63697 2.78152 2.11083 -68.12015 701.20583
5020.0000 -70.85963 -68.13416 2.72547 2.08975 -68.32368 686.19274
5025.0000 -69.96409 -66.98526 2.97883 2.15432 -67.70031 732.11271
5030.0000 -70.21437 -66.67827 3.53609 2.22743 -66.99443 849.85588
5035.0000 -71.04639 -67.77549 3.27090 2.22337 -67.03357 852.45279
5040.0000 -69.90202 -66.50431 3.39771 2.19591 -67.29872 825.44666
5045.0000 -69.99115 -66.31288 3.67827 2.31458 -66.15299 912.78376
5050.0000 -70.23429 -66.79338 3.44091 2.25746 -66.70446 852.25812
5055.0000 -69.56014 -66.01887 3.54127 2.26303 -66.65072 825.46639
5060.0000 -68.93453 -65.86570 3.06883 2.40143 -65.31443 958.04227
5065.0000 -69.73408 -66.07178 3.66230 2.27329 -66.55161 864.91909
5070.0000 -70.86619 -67.68346 3.18273 2.23932 -66.87957 840.14374
5075.0000 -70.48922 -67.72661 2.76262 2.15404 -67.70295 759.83428
5080.0000 -70.76323 -68.07725 2.68599 2.15753 -67.66931 768.39188
5085.0000 -70.07782 -67.24705 2.83077 2.15252 -67.71761 721.21816
5090.0000 -70.21589 -66.66727 3.54862 2.23572 -66.91437 858.23568
5095.0000 -70.42962 -66.56794 3.86168 2.29164 -66.37447 891.44675
5100.0000 -70.22531 -67.13615 3.08916 2.22595 -67.00864 843.81478
5105.0000 -70.33241 -67.36152 2.97089 2.23384 -66.93250 835.45335
5110.0000 -70.23186 -67.21697 3.01489 2.22346 -67.03271 776.74216
5115.0000 -69.71845 -67.03427 2.68418 2.19773 -67.28111 813.89279
5120.0000 -69.63670 -65.86741 3.76929 2.32098 -66.09118 884.20637
5125.0000 -69.66498 -66.83738 2.82760 2.30570 -66.23874 873.74357
5130.0000 -70.10192 -66.63344 3.46848 2.26957 -66.58755 867.18288
5135.0000 -70.00673 -67.26137 2.74536 2.24544 -66.82056 820.48631
5140.0000 -69.79283 -66.47252 3.32031 2.27633 -66.52226 885.28649
5145.0000 -69.47200 -66.74927 2.72273 2.24505 -66.82428 825.93070
5150.0000 -69.82415 -66.12667 3.69748 2.31033 -66.19402 841.64652
5155.0000 -70.95108 -66.48871 4.46236 2.33363 -65.96901 872.34647
5160.0000 -70.60020 -67.75974 2.84046 2.23649 -66.90695 867.72379
5165.0000 -69.51904 -66.18904 3.33000 2.23044 -66.96531 795.87742
5170.0000 -69.81110 -66.92175 2.88935 2.27217 -66.56248 825.07389
5175.0000 -71.42805 -67.67436 3.75369 2.19888 -67.27009 804.20768
5180.0000 -69.85979 -66.79502 3.06477 2.23057 -66.96408 839.61104
5185.0000 -69.33944 -65.65428 3.68516 2.35331 -65.77900 936.41163
5190.0000 -69.23991 -65.62044 3.61946 2.31193 -66.17856 936.06658
5195.0000 -69.39060 -65.72262 3.66799 2.32120 -66.08902 895.83114
5200.0000 -69.90351 -66.58959 3.31392 2.28918 -66.39820 852.70703
5205.0000 -69.77078 -66.09693 3.67386 2.30556 -66.24008 857.32198
5210.0000 -70.56524 -67.31177 3.25346 2.20661 -67.19544 822.12413
5215.0000 -69.62352 -66.15303 3.47049 2.27129 -66.57096 847.91798
5220.0000 -70.77379 -65.78010 4.99369 2.33240 -65.98096 888.87070
5225.0000 -71.03865 -66.93153 4.10712 2.24502 -66.82462 832.77143
5230.0000 -69.56331 -65.91743 3.64588 2.28143 -66.47302 856.26738
5235.0000 -70.78084 -68.11812 2.66272 2.27089 -66.57479 831.21962
5240.0000 -70.52279 -67.17371 3.34908 2.11645 -68.06586 723.14701
5245.0000 -69.81219 -66.59322 3.21897 2.28443 -66.44403 888.21633
5250.0000 -70.21379 -66.58242 3.63137 2.28822 -66.40750 863.69854
FREEZING PROCESS: loop number 22 T-loop= 797.00000000000000
main_MD> interactions number 22 at Temperature= 797.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.71726 0.53083 -0.14175
force_rgl> df(natom) -1.97705 3.21118 -0.04799
5255.0000 -70.38594 -66.84502 3.54092 2.29484 -66.34354 891.27721
5260.0000 -70.28771 -67.63165 2.65606 2.17297 -67.52017 775.84073
5265.0000 -69.51117 -66.73590 2.77526 2.22479 -67.01991 815.58548
5270.0000 -69.82892 -66.47615 3.35277 2.26199 -66.66068 826.46725
5275.0000 -71.03598 -68.91994 2.11605 2.18295 -67.42381 790.94303
5280.0000 -71.04402 -68.20962 2.83440 2.08867 -68.33409 697.12780
5285.0000 -71.05014 -68.61991 2.43023 2.11375 -68.09192 724.28643
5290.0000 -70.77039 -67.80442 2.96597 2.06681 -68.54517 713.67881
5295.0000 -70.13443 -66.98719 3.14724 2.14156 -67.82351 761.23435
5300.0000 -69.08083 -65.82108 3.25975 2.28016 -66.48527 883.91568
5305.0000 -69.51414 -66.40123 3.11290 2.38521 -65.47106 927.85711
5310.0000 -70.80226 -66.90133 3.90093 2.26904 -66.59271 923.54830
5315.0000 -69.41018 -66.76523 2.64495 2.25960 -66.68378 854.47625
5320.0000 -70.21550 -67.46768 2.74782 2.24327 -66.84143 807.22550
5325.0000 -70.65614 -68.27144 2.38470 2.14959 -67.74594 715.35134
5330.0000 -70.43641 -67.09892 3.33748 2.11437 -68.08597 736.17460
5335.0000 -69.44256 -66.02026 3.42230 2.25519 -66.72641 832.31639
5340.0000 -71.12778 -67.51635 3.61143 2.23204 -66.94993 804.27284
5345.0000 -69.83756 -67.09007 2.74749 2.22315 -67.03568 787.98102
5350.0000 -70.87052 -67.99186 2.87867 2.17721 -67.47928 726.91422
5355.0000 -71.29970 -68.02223 3.27747 2.11444 -68.08529 736.06983
5360.0000 -70.72897 -68.14161 2.58736 2.12560 -67.97757 741.82212
5365.0000 -71.01206 -68.17205 2.84001 2.06487 -68.56388 670.21267
5370.0000 -69.84084 -67.29689 2.54395 2.17713 -67.48000 754.49937
5375.0000 -71.39161 -68.26620 3.12541 2.15291 -67.71387 754.05507
5380.0000 -71.49973 -68.70898 2.79074 2.03858 -68.81777 656.01515
5385.0000 -70.69628 -67.52538 3.17090 2.15569 -67.68704 750.30788
5390.0000 -70.97836 -68.43657 2.54179 2.15769 -67.66769 757.57319
5395.0000 -70.80264 -67.55223 3.25040 2.10556 -68.17101 709.94114
5400.0000 -70.00649 -66.43189 3.57461 2.23628 -66.90892 788.46162
5405.0000 -69.98918 -67.21334 2.77584 2.26849 -66.59795 864.02287
5410.0000 -70.10630 -67.53624 2.57007 2.15825 -67.66229 751.27600
5415.0000 -71.43907 -68.25829 3.18078 2.12783 -67.95607 724.24700
5420.0000 -70.92068 -68.46741 2.45327 2.05617 -68.64788 666.82021
5425.0000 -70.97473 -68.46560 2.50912 2.08142 -68.40407 691.16153
5430.0000 -69.87934 -67.25523 2.62411 2.19184 -67.33803 786.27039
5435.0000 -69.99754 -67.23093 2.76661 2.22785 -66.99031 794.55898
5440.0000 -70.31113 -67.40996 2.90117 2.18320 -67.42145 798.19852
5445.0000 -71.33099 -68.72496 2.60603 2.06813 -68.53242 684.21298
5450.0000 -70.65466 -68.08623 2.56843 2.09708 -68.25295 702.66221
5455.0000 -70.50656 -67.74104 2.76552 2.15664 -67.67790 794.95220
5460.0000 -69.25178 -66.14356 3.10822 2.23271 -66.94345 851.83477
5465.0000 -70.14569 -66.23101 3.91468 2.29100 -66.38060 837.40472
5470.0000 -69.45462 -66.44125 3.01337 2.28824 -66.40726 874.12523
5475.0000 -70.24658 -66.84245 3.40413 2.22408 -67.02671 806.74590
5480.0000 -70.60310 -66.89707 3.70602 2.24933 -66.78299 812.97931
5485.0000 -70.42875 -67.61929 2.80947 2.15848 -67.66009 741.57568
5490.0000 -70.33670 -67.45497 2.88174 2.13392 -67.89720 769.34217
5495.0000 -71.34807 -68.49022 2.85784 2.14802 -67.76108 782.49732
5500.0000 -71.16818 -68.31567 2.85251 2.05743 -68.63576 715.62357
FREEZING PROCESS: loop number 23 T-loop= 772.00000000000000
main_MD> interactions number 23 at Temperature= 772.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.90098 -0.76931 0.42162
force_rgl> df(natom) -0.02159 2.90365 -0.23092
5505.0000 -71.00483 -68.48096 2.52387 2.06836 -68.53017 681.11119
5510.0000 -70.98245 -67.98827 2.99418 2.11615 -68.06879 743.45733
5515.0000 -70.83319 -68.44117 2.39202 2.08628 -68.35721 694.09721
5520.0000 -70.13002 -67.27278 2.85724 2.07900 -68.42748 711.63076
5525.0000 -70.03316 -66.71854 3.31461 2.26953 -66.58792 892.94410
5530.0000 -70.62443 -67.52642 3.09801 2.19261 -67.33061 777.01871
5535.0000 -69.98115 -67.14430 2.83685 2.14867 -67.75478 749.40461
5540.0000 -70.52408 -67.72640 2.79768 2.16414 -67.60541 766.12036
5545.0000 -71.05467 -68.23345 2.82122 2.13566 -67.88045 772.47809
5550.0000 -70.84079 -67.95707 2.88372 2.10020 -68.22275 731.37475
5555.0000 -70.83124 -66.97204 3.85920 2.20024 -67.25689 781.23054
5560.0000 -71.46994 -69.15307 2.31688 2.07285 -68.48681 685.98514
5565.0000 -71.95793 -69.27083 2.68710 2.02887 -68.91148 638.02823
5570.0000 -71.43908 -68.84125 2.59783 2.00522 -69.13985 643.08776
5575.0000 -71.68461 -69.17751 2.50710 2.01140 -69.08015 619.23508
5580.0000 -71.13024 -68.63785 2.49239 1.96744 -69.50453 593.63049
5585.0000 -71.00608 -67.64031 3.36577 2.10687 -68.15842 702.48686
5590.0000 -70.94862 -68.50198 2.44664 2.09860 -68.23828 658.71549
5595.0000 -70.66535 -66.94650 3.71885 2.09757 -68.24820 674.52349
5600.0000 -70.55440 -67.53921 3.01519 2.18793 -67.37581 761.51134
5605.0000 -71.07816 -68.42615 2.65201 2.10757 -68.15160 722.27684
5610.0000 -70.96106 -68.08035 2.88071 2.10766 -68.15080 734.20869
5615.0000 -70.47988 -67.83910 2.64078 2.13677 -67.86972 725.96316
5620.0000 -70.07850 -67.99835 2.08016 2.14010 -67.83754 722.68215
5625.0000 -70.46851 -67.62874 2.83977 2.18911 -67.36436 764.13846
5630.0000 -69.99474 -66.92738 3.06736 2.24060 -66.86724 813.47999
5635.0000 -69.70085 -67.25205 2.44879 2.25409 -66.73699 811.60957
5640.0000 -69.31409 -66.55621 2.75788 2.21315 -67.13226 783.37687
5645.0000 -69.53411 -67.28630 2.24780 2.26240 -66.65676 825.65143
5650.0000 -70.19287 -67.08047 3.11241 2.24959 -66.78040 823.40970
5655.0000 -69.67753 -66.26102 3.41652 2.24023 -66.87078 766.29068
5660.0000 -68.95122 -66.13327 2.81794 2.32033 -66.09748 890.62736
5665.0000 -69.98465 -66.33253 3.65211 2.25944 -66.68533 833.76640
5670.0000 -70.04170 -66.95994 3.08176 2.26309 -66.65013 866.30255
5675.0000 -70.13178 -67.12558 3.00619 2.17524 -67.49828 744.08573
5680.0000 -70.54271 -67.48700 3.05571 2.19161 -67.34023 802.19827
5685.0000 -70.60014 -67.82236 2.77777 2.17962 -67.45602 774.66748
5690.0000 -70.35140 -67.84169 2.50971 2.12528 -67.98068 735.66575
5695.0000 -71.18508 -68.22908 2.95600 2.10801 -68.14737 696.72229
5700.0000 -70.97222 -68.74583 2.22640 2.08908 -68.33017 670.28204
5705.0000 -70.92160 -68.06743 2.85417 2.11577 -68.07249 697.18610
5710.0000 -70.85071 -68.10235 2.74836 2.09979 -68.22674 707.50419
5715.0000 -70.75674 -67.67350 3.08323 2.12375 -67.99545 708.66052
5720.0000 -71.47760 -68.52398 2.95362 2.08627 -68.35730 681.69170
5725.0000 -70.87130 -68.34805 2.52325 2.10523 -68.17423 730.03363
5730.0000 -71.03618 -67.42713 3.60906 2.10942 -68.13381 745.49966
5735.0000 -69.33644 -66.42900 2.90744 2.20326 -67.22778 792.35032
5740.0000 -70.21331 -66.63630 3.57701 2.24567 -66.81825 831.90365
5745.0000 -69.95567 -66.20703 3.74864 2.32436 -66.05851 903.71811
5750.0000 -70.40812 -67.10133 3.30679 2.25498 -66.72843 880.67125
FREEZING PROCESS: loop number 24 T-loop= 747.00000000000000
main_MD> interactions number 24 at Temperature= 747.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.06947 1.31412 0.23166
force_rgl> df(natom) -2.09563 -0.23742 1.25263
5755.0000 -70.70214 -67.13696 3.56518 2.20934 -67.16908 820.17908
5760.0000 -71.17067 -68.45976 2.71091 2.14764 -67.76473 753.78231
5765.0000 -71.38865 -68.39789 2.99076 2.10478 -68.17853 691.24516
5770.0000 -70.82043 -67.61997 3.20045 2.10644 -68.16259 706.74671
5775.0000 -70.27263 -66.92978 3.34284 2.20241 -67.23601 828.17397
5780.0000 -70.33405 -67.65171 2.68234 2.14070 -67.83177 733.86136
5785.0000 -70.52212 -66.94206 3.58007 2.17606 -67.49037 792.06479
5790.0000 -70.22669 -67.87894 2.34775 2.17483 -67.50221 760.97439
5795.0000 -70.60850 -68.13456 2.47395 2.13389 -67.89752 698.79740
5800.0000 -69.82211 -67.99343 1.82868 2.13660 -67.87131 753.74950
5805.0000 -72.13964 -69.52093 2.61871 2.10051 -68.21977 691.70670
5810.0000 -71.31420 -68.93639 2.37781 2.00836 -69.10946 636.60704
5815.0000 -71.08906 -68.51038 2.57868 2.05021 -68.70549 670.26276
5820.0000 -70.48749 -67.34609 3.14140 2.10962 -68.13184 730.58058
5825.0000 -70.77739 -68.97321 1.80418 2.14563 -67.78420 712.98412
5830.0000 -71.09744 -67.88022 3.21721 2.09488 -68.27416 705.19499
5835.0000 -71.20785 -68.75363 2.45421 2.10158 -68.20949 683.82826
5840.0000 -71.96236 -69.37945 2.58290 2.00327 -69.15863 623.74231
5845.0000 -70.50272 -67.92049 2.58223 2.05663 -68.64345 676.92282
5850.0000 -71.27343 -68.38944 2.88399 2.09545 -68.26864 709.80211
5855.0000 -70.96836 -68.08669 2.88167 2.12971 -67.93789 763.87393
5860.0000 -71.17120 -68.74067 2.43052 2.05610 -68.64858 678.47163
5865.0000 -70.19588 -67.93445 2.26143 2.12547 -67.97881 769.64607
5870.0000 -71.57116 -69.27382 2.29734 2.03932 -68.81055 662.33648
5875.0000 -70.52662 -67.91701 2.60961 2.07204 -68.49464 704.67904
5880.0000 -70.50368 -66.85989 3.64379 2.16251 -67.62117 796.60323
5885.0000 -70.35498 -67.50805 2.84692 2.22071 -67.05925 809.53837
5890.0000 -70.78409 -67.51763 3.26647 2.15218 -67.72093 775.09077
5895.0000 -70.71710 -67.35081 3.36630 2.14991 -67.74283 774.36877
5900.0000 -70.75124 -67.79294 2.95830 2.17626 -67.48840 831.96230
5905.0000 -70.68809 -67.80908 2.87901 2.14608 -67.77981 762.97998
5910.0000 -70.67557 -68.32937 2.34620 2.14090 -67.82987 760.02448
5915.0000 -71.44690 -68.44920 2.99770 2.09894 -68.23493 716.29197
5920.0000 -71.88878 -68.91320 2.97558 2.08297 -68.38911 680.13329
5925.0000 -71.63183 -69.26891 2.36292 2.02946 -68.90577 643.48805
5930.0000 -71.53409 -68.88026 2.65383 2.02773 -68.92244 673.16511
5935.0000 -71.31144 -68.34491 2.96653 2.09731 -68.25066 730.96121
5940.0000 -70.91877 -67.25878 3.65999 2.07822 -68.43497 688.98707
5945.0000 -71.28070 -68.80605 2.47465 2.15174 -67.72522 785.14952
5950.0000 -70.58192 -67.75876 2.82316 2.07433 -68.47260 699.64343
5955.0000 -71.75492 -68.12250 3.63242 2.17281 -67.52175 748.51388
5960.0000 -69.65334 -66.67242 2.98093 2.18217 -67.43135 781.70465
5965.0000 -70.62766 -68.30502 2.32263 2.19706 -67.28766 789.11861
5970.0000 -70.67376 -67.80552 2.86824 2.11692 -68.06133 696.95381
5975.0000 -70.90975 -68.57586 2.33389 2.13400 -67.89641 713.88345
5980.0000 -70.48984 -68.29577 2.19407 2.11072 -68.12122 704.51922
5985.0000 -70.52768 -68.11682 2.41086 2.10428 -68.18336 713.11713
5990.0000 -71.50346 -69.08942 2.41404 2.03884 -68.81521 645.10690
5995.0000 -70.86518 -67.96239 2.90279 2.07786 -68.43845 663.57691
6000.0000 -71.00980 -67.59584 3.41397 2.13720 -67.86557 768.46099
FREEZING PROCESS: loop number 25 T-loop= 722.00000000000000
main_MD> interactions number 25 at Temperature= 722.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.24927 -2.91828 4.15306
force_rgl> df(natom) 0.63023 0.48308 -0.60383
6005.0000 -70.42764 -67.49759 2.93005 2.17044 -67.54462 710.05797
6010.0000 -69.91809 -67.24367 2.67442 2.17363 -67.51386 709.08913
6015.0000 -69.45871 -65.81753 3.64117 2.24533 -66.82156 800.52158
6020.0000 -70.88801 -67.71142 3.17659 2.19630 -67.29500 741.39389
6025.0000 -69.69370 -67.05184 2.64186 2.20862 -67.17604 789.35157
6030.0000 -70.86843 -67.55898 3.30946 2.17225 -67.52713 798.63248
6035.0000 -70.11844 -67.28817 2.83027 2.15652 -67.67901 768.26845
6040.0000 -70.84544 -67.92941 2.91603 2.14370 -67.80278 718.37658
6045.0000 -70.86460 -68.27064 2.59396 2.10079 -68.21707 684.95700
6050.0000 -71.07016 -67.14455 3.92561 2.13704 -67.86712 748.88245
6055.0000 -70.93380 -67.51903 3.41477 2.22983 -66.97124 841.87550
6060.0000 -70.38842 -67.02109 3.36733 2.21026 -67.16014 827.63017
6065.0000 -70.82718 -67.27207 3.55511 2.23221 -66.94822 775.69680
6070.0000 -70.69651 -67.69873 2.99777 2.20171 -67.24274 807.05716
6075.0000 -71.21349 -68.23610 2.97739 2.15364 -67.70688 762.11586
6080.0000 -70.98575 -67.68741 3.29834 2.13561 -67.88092 730.50247
6085.0000 -71.34034 -68.12852 3.21182 2.20440 -67.21673 845.98062
6090.0000 -71.25656 -69.47968 1.77688 2.05406 -68.66831 663.56282
6095.0000 -70.88190 -68.66974 2.21216 2.06879 -68.52604 681.12846
6100.0000 -71.13710 -67.83626 3.30084 2.11894 -68.04188 712.07499
6105.0000 -70.63312 -68.14500 2.48812 2.14474 -67.79273 725.33408
6110.0000 -70.92737 -67.99566 2.93171 2.15200 -67.72271 764.47177
6115.0000 -71.78799 -68.76045 3.02754 2.07937 -68.42387 674.12449
6120.0000 -72.24230 -69.48060 2.76170 2.02271 -68.97099 656.76404
6125.0000 -71.64782 -69.81575 1.83207 1.94797 -69.69252 600.34621
6130.0000 -70.04336 -67.67225 2.37111 2.02787 -68.92114 628.50908
6135.0000 -70.05006 -67.49186 2.55820 2.15728 -67.67165 730.93355
6140.0000 -71.06540 -68.63962 2.42578 2.10461 -68.18022 732.88036
6145.0000 -71.14603 -68.35942 2.78661 2.05833 -68.62704 634.95111
6150.0000 -71.76624 -68.88051 2.88573 2.03940 -68.80984 625.80536
6155.0000 -70.18860 -66.90324 3.28536 2.12926 -67.94226 785.95112
6160.0000 -69.70064 -66.53323 3.16740 2.25954 -66.68436 869.64567
6165.0000 -70.89542 -68.25105 2.64437 2.16111 -67.63468 778.36898
6170.0000 -70.70201 -67.97698 2.72503 2.10069 -68.21806 655.38576
6175.0000 -71.01425 -68.16200 2.85225 2.13206 -67.91521 665.07009
6180.0000 -71.02130 -68.42553 2.59577 2.13718 -67.86576 699.57719
6185.0000 -70.72800 -67.91049 2.81750 2.16027 -67.64283 736.38527
6190.0000 -71.24764 -68.48655 2.76109 2.08003 -68.41755 658.71830
6195.0000 -71.68267 -68.20815 3.47452 2.07458 -68.47019 656.29645
6200.0000 -70.70417 -67.46266 3.24151 2.10001 -68.22463 711.97355
6205.0000 -69.86895 -67.29408 2.57488 2.17920 -67.46003 774.37830
6210.0000 -70.21090 -67.58274 2.62816 2.18018 -67.45062 778.58510
6215.0000 -70.48836 -67.59473 2.89363 2.15037 -67.73841 724.21168
6220.0000 -71.19723 -68.28180 2.91542 2.14062 -67.83250 744.40268
6225.0000 -70.66475 -67.77774 2.88702 2.13039 -67.93127 743.51356
6230.0000 -70.40420 -68.22452 2.17967 2.13597 -67.87742 736.85341
6235.0000 -71.21928 -68.60089 2.61839 2.08836 -68.33709 684.25210
6240.0000 -70.52385 -67.91810 2.60575 2.08556 -68.36418 681.32192
6245.0000 -71.43386 -68.26314 3.17071 2.12413 -67.99176 718.54228
6250.0000 -71.48295 -68.04623 3.43673 2.11429 -68.08676 722.67113
FREEZING PROCESS: loop number 26 T-loop= 697.00000000000000
main_MD> interactions number 26 at Temperature= 697.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.96067 -4.56284 -2.55697
force_rgl> df(natom) -2.27283 0.04863 -4.58349
6255.0000 -71.39747 -69.07812 2.31935 2.05764 -68.63371 704.81626
6260.0000 -70.76941 -68.58157 2.18783 2.02647 -68.93467 654.99549
6265.0000 -71.22352 -68.12770 3.09581 2.09547 -68.26849 675.57599
6270.0000 -70.60657 -67.02502 3.58156 2.16573 -67.59007 758.30966
6275.0000 -71.52540 -68.09243 3.43296 2.17754 -67.47613 735.64773
6280.0000 -70.84449 -68.20860 2.63589 2.11733 -68.05738 693.61397
6285.0000 -70.84124 -68.17467 2.66658 2.07378 -68.47783 688.35689
6290.0000 -71.88515 -69.40039 2.48476 2.03158 -68.88535 653.99873
6295.0000 -71.47819 -69.21723 2.26097 1.96381 -69.53965 594.17029
6300.0000 -71.58653 -69.15569 2.43084 2.00949 -69.09860 630.67287
6305.0000 -71.27472 -68.56856 2.70615 2.03064 -68.89442 644.53315
6310.0000 -70.64613 -67.68938 2.95675 2.10055 -68.21938 672.92044
6315.0000 -70.51756 -67.26539 3.25217 2.17678 -67.48340 792.40310
6320.0000 -70.56675 -67.47975 3.08700 2.17335 -67.51651 812.55100
6325.0000 -70.98788 -68.45085 2.53703 2.14811 -67.76026 734.16447
6330.0000 -71.45611 -68.85637 2.59974 2.07278 -68.48755 692.44095
6335.0000 -71.25339 -67.92407 3.32932 2.06486 -68.56397 663.79507
6340.0000 -70.40341 -67.44760 2.95581 2.15446 -67.69887 753.60853
6345.0000 -71.00493 -67.83125 3.17368 2.13535 -67.88345 751.62903
6350.0000 -71.51505 -68.52757 2.98748 2.09939 -68.23062 705.14246
6355.0000 -71.03430 -68.53330 2.50100 2.06603 -68.55274 681.36683
6360.0000 -71.63505 -68.47632 3.15874 2.07217 -68.49342 688.77353
6365.0000 -71.63888 -68.81658 2.82231 2.01024 -69.09133 620.49874
6370.0000 -71.52862 -68.72842 2.80020 2.05390 -68.66980 678.48879
6375.0000 -71.59269 -68.53285 3.05984 2.02083 -68.98909 638.24272
6380.0000 -70.15695 -67.82491 2.33204 2.11087 -68.11978 713.90963
6385.0000 -71.54176 -68.89301 2.64874 2.07965 -68.42118 672.22117
6390.0000 -72.40507 -68.82585 3.57922 1.98617 -69.32375 626.99944
6395.0000 -70.71547 -67.34164 3.37382 2.10515 -68.17503 745.60315
6400.0000 -70.97435 -68.19943 2.77491 2.10688 -68.15828 719.26422
6405.0000 -72.08382 -68.70098 3.38284 2.06616 -68.55149 711.48426
6410.0000 -70.96964 -68.21742 2.75222 2.08373 -68.38181 713.17144
6415.0000 -71.07851 -69.06626 2.01224 2.05812 -68.62909 678.57756
6420.0000 -71.75996 -69.12596 2.63400 2.00110 -69.17957 623.71196
6425.0000 -70.91883 -68.05912 2.85972 2.05120 -68.69584 669.80145
6430.0000 -70.37017 -67.42621 2.94396 2.14373 -67.80254 746.70227
6435.0000 -70.52984 -67.61585 2.91399 2.14599 -67.78065 751.84363
6440.0000 -70.29113 -67.99317 2.29796 2.13507 -67.88612 755.00979
6445.0000 -70.70933 -67.83771 2.87161 2.13136 -67.92194 744.08763
6450.0000 -70.62860 -68.08437 2.54423 2.10744 -68.15288 688.22296
6455.0000 -70.87180 -67.46660 3.40520 2.12395 -67.99353 704.66260
6460.0000 -70.77834 -68.20054 2.57780 2.11555 -68.07455 692.85400
6465.0000 -70.78994 -68.24344 2.54650 2.11596 -68.07062 699.29109
6470.0000 -70.60722 -68.39458 2.21264 2.09909 -68.23354 633.25358
6475.0000 -69.92017 -67.24189 2.67828 2.13949 -67.84349 706.95242
6480.0000 -70.95908 -68.43956 2.51952 2.10446 -68.18165 722.75602
6485.0000 -71.03212 -68.30587 2.72625 2.10123 -68.21284 705.99717
6490.0000 -71.70241 -68.91123 2.79118 2.06794 -68.53424 665.41489
6495.0000 -71.31191 -68.66898 2.64294 2.04368 -68.76853 637.02875
6500.0000 -71.40328 -68.45370 2.94959 2.08220 -68.39653 679.18940
FREEZING PROCESS: loop number 27 T-loop= 672.00000000000000
main_MD> interactions number 27 at Temperature= 672.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.09568 2.67283 -1.24983
force_rgl> df(natom) 1.33132 -0.77212 2.56869
6505.0000 -70.79320 -68.32079 2.47242 2.03216 -68.87971 648.72290
6510.0000 -70.48882 -68.38335 2.10548 2.09669 -68.25665 711.17661
6515.0000 -71.40144 -68.53367 2.86778 2.09572 -68.26605 693.40214
6520.0000 -70.96230 -69.14709 1.81521 2.03559 -68.84660 690.63902
6525.0000 -71.05342 -68.54664 2.50678 2.03763 -68.82693 645.51628
6530.0000 -70.99740 -68.71874 2.27866 2.02548 -68.94421 652.80495
6535.0000 -71.34863 -68.72682 2.62181 2.06513 -68.56141 690.78157
6540.0000 -71.64297 -69.19546 2.44752 2.01577 -69.03798 638.19557
6545.0000 -71.61482 -68.89157 2.72325 2.01008 -69.09289 655.23959
6550.0000 -71.05722 -69.11264 1.94458 1.98405 -69.34424 597.87740
6555.0000 -70.30206 -67.88268 2.41937 2.05481 -68.66106 660.81403
6560.0000 -69.90259 -67.81601 2.08658 2.14621 -67.77861 695.43140
6565.0000 -71.26790 -68.56621 2.70169 2.10041 -68.22073 712.16071
6570.0000 -70.47204 -67.59663 2.87541 2.12709 -67.96315 695.48870
6575.0000 -71.02705 -67.96887 3.05819 2.12761 -67.95818 720.15773
6580.0000 -70.08543 -67.97836 2.10707 2.12479 -67.98535 734.42249
6585.0000 -71.11813 -68.81630 2.30183 2.09783 -68.24567 678.13940
6590.0000 -70.86584 -67.90727 2.95856 2.06909 -68.52319 691.36425
6595.0000 -71.39997 -68.48288 2.91709 2.13084 -67.92692 735.57068
6600.0000 -71.47941 -69.09515 2.38426 2.06754 -68.53816 683.15787
6605.0000 -71.09826 -68.87372 2.22454 2.02703 -68.92925 607.72319
6610.0000 -71.85811 -69.81308 2.04502 2.02490 -68.94980 643.53857
6615.0000 -71.10315 -68.66072 2.44243 1.96591 -69.51932 582.05149
6620.0000 -70.59621 -67.93680 2.65941 2.07092 -68.50546 685.92040
6625.0000 -71.64636 -69.03033 2.61603 2.08543 -68.36539 699.82333
6630.0000 -71.22166 -68.20187 3.01979 2.04606 -68.74553 658.18927
6635.0000 -71.67821 -69.42772 2.25049 2.07592 -68.45722 703.69791
6640.0000 -70.90512 -68.07029 2.83483 2.05231 -68.68515 708.15126
6645.0000 -70.89383 -68.47571 2.41812 2.12159 -68.01629 721.54863
6650.0000 -71.15505 -68.41782 2.73724 2.12379 -67.99498 734.01355
6655.0000 -71.15972 -68.10121 3.05850 2.10793 -68.14817 716.37340
6660.0000 -71.18791 -68.65715 2.53076 2.05119 -68.69593 651.99511
6665.0000 -70.75436 -68.37298 2.38137 2.06472 -68.56532 667.13576
6670.0000 -70.74048 -68.21394 2.52654 2.11886 -68.04264 716.40412
6675.0000 -71.67363 -69.69511 1.97852 1.99819 -69.20764 609.47968
6680.0000 -70.28237 -68.58085 1.70152 2.04380 -68.76728 631.14027
6685.0000 -69.61579 -67.63870 1.97709 2.12819 -67.95252 674.64897
6690.0000 -71.05463 -68.28573 2.76890 2.15355 -67.70774 710.26513
6695.0000 -71.30384 -68.92786 2.37598 2.01685 -69.02755 616.02978
6700.0000 -71.26109 -69.14670 2.11439 2.02725 -68.92709 609.38777
6705.0000 -70.81526 -68.16405 2.65121 2.05118 -68.69607 625.99249
6710.0000 -71.17205 -68.80826 2.36379 2.05829 -68.62742 644.00243
6715.0000 -70.57212 -67.47900 3.09312 2.07611 -68.45539 649.73875
6720.0000 -71.16267 -68.02502 3.13765 2.10884 -68.13942 727.00315
6725.0000 -71.10879 -68.22733 2.88146 2.07210 -68.49411 695.88947
6730.0000 -71.71220 -69.02135 2.69085 2.01530 -69.04245 649.74708
6735.0000 -70.32579 -67.00061 3.32517 2.09663 -68.25728 734.45556
6740.0000 -70.37123 -66.85496 3.51626 2.23412 -66.92977 831.32543
6745.0000 -70.84772 -67.43100 3.41672 2.17705 -67.48078 792.17331
6750.0000 -70.27932 -67.32244 2.95688 2.17219 -67.52778 750.26750
FREEZING PROCESS: loop number 28 T-loop= 647.00000000000000
main_MD> interactions number 28 at Temperature= 647.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -6.67125 3.10796 0.09991
force_rgl> df(natom) -1.67127 -1.51537 0.40208
6755.0000 -71.35735 -68.96100 2.39635 2.10221 -68.20338 736.56533
6760.0000 -71.58087 -68.75369 2.82718 2.06621 -68.55097 677.57446
6765.0000 -71.06761 -68.32698 2.74063 2.08611 -68.35883 683.16435
6770.0000 -71.12484 -68.18432 2.94051 2.13746 -67.86309 718.47271
6775.0000 -71.01099 -67.80081 3.21018 2.14348 -67.80495 727.03754
6780.0000 -70.84466 -67.92059 2.92407 2.12649 -67.96900 710.26495
6785.0000 -71.91555 -68.65593 3.25962 2.09375 -68.28503 711.43450
6790.0000 -71.87994 -69.58449 2.29545 1.99384 -69.24972 592.69229
6795.0000 -71.58844 -68.94661 2.64183 2.00891 -69.10418 623.97123
6800.0000 -71.24682 -68.87523 2.37159 2.02288 -68.96931 637.24657
6805.0000 -71.36771 -68.72909 2.63862 2.01076 -69.08631 575.28004
6810.0000 -71.65446 -68.92903 2.72543 2.05215 -68.68674 615.88691
6815.0000 -71.83130 -69.12108 2.71022 1.99764 -69.21303 614.18980
6820.0000 -71.16736 -68.16365 3.00372 2.03740 -68.82908 658.69965
6825.0000 -70.59803 -67.59623 3.00180 2.12566 -67.97698 737.86680
6830.0000 -71.46115 -69.23249 2.22866 2.09367 -68.28587 661.81228
6835.0000 -71.81992 -68.66864 3.15128 2.02634 -68.93587 612.56346
6840.0000 -70.77162 -68.58473 2.18689 2.07485 -68.46751 681.32416
6845.0000 -71.01002 -68.75009 2.25993 2.05547 -68.65469 681.07040
6850.0000 -70.27537 -68.06922 2.20615 2.08948 -68.32625 692.23445
6855.0000 -70.93146 -68.27579 2.65566 2.11767 -68.05410 697.80189
6860.0000 -71.62177 -69.11320 2.50857 2.05627 -68.64698 650.73552
6865.0000 -70.84062 -68.85391 1.98672 2.04491 -68.75660 664.47233
6870.0000 -70.60648 -68.20138 2.40510 2.12144 -68.01770 672.02557
6875.0000 -71.35609 -68.44047 2.91562 2.11162 -68.11252 684.71110
6880.0000 -70.86904 -68.77918 2.08987 2.06094 -68.60184 667.17916
6885.0000 -71.50749 -69.02639 2.48110 2.03418 -68.86025 642.04424
6890.0000 -71.43363 -69.55683 1.87680 1.99819 -69.20773 598.49398
6895.0000 -71.54212 -68.35904 3.18309 2.01370 -69.05796 598.77989
6900.0000 -70.83207 -68.30692 2.52515 2.07965 -68.42122 670.05770
6905.0000 -71.11810 -68.63551 2.48258 2.06250 -68.58679 642.05729
6910.0000 -70.46105 -67.60385 2.85720 2.08874 -68.33348 647.69978
6915.0000 -71.64682 -69.45020 2.19662 2.08481 -68.37140 668.97307
6920.0000 -72.18854 -69.94324 2.24530 1.96592 -69.51925 551.13052
6925.0000 -71.71136 -69.11753 2.59383 1.97709 -69.41145 562.11426
6930.0000 -71.00052 -68.86741 2.13311 2.05856 -68.62481 626.06720
6935.0000 -71.52409 -68.88749 2.63660 2.00833 -69.10982 585.60756
6940.0000 -71.74457 -68.88838 2.85619 2.04457 -68.75986 613.12284
6945.0000 -70.72894 -68.25086 2.47809 2.08436 -68.37577 661.66415
6950.0000 -71.57853 -68.92107 2.65747 2.02865 -68.91357 627.32139
6955.0000 -71.44436 -68.76082 2.68353 2.06983 -68.51597 649.02507
6960.0000 -71.53557 -68.83169 2.70388 2.01467 -69.04860 637.00798
6965.0000 -71.39261 -68.82173 2.57087 2.04791 -68.72762 668.21872
6970.0000 -71.56039 -69.52324 2.03715 1.97758 -69.40664 594.49942
6975.0000 -71.74669 -69.25757 2.48911 2.00861 -69.10711 627.51148
6980.0000 -71.27112 -68.42310 2.84803 2.05425 -68.66640 648.86881
6985.0000 -71.35780 -68.70743 2.65037 2.08588 -68.36102 684.58421
6990.0000 -71.85318 -69.70033 2.15285 1.98789 -69.30714 625.83014
6995.0000 -72.25994 -70.46188 1.79806 1.89596 -70.19472 529.14554
7000.0000 -71.52027 -69.35603 2.16424 1.94524 -69.71887 598.20962
FREEZING PROCESS: loop number 29 T-loop= 622.00000000000000
main_MD> interactions number 29 at Temperature= 622.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.89776 -0.97724 0.79124
force_rgl> df(natom) -1.43973 -0.48188 3.13150
7005.0000 -71.34089 -69.10320 2.23769 1.98249 -69.35931 626.44425
7010.0000 -71.45114 -69.81258 1.63856 1.94063 -69.76344 573.04010
7015.0000 -72.04097 -69.65788 2.38309 1.99076 -69.27943 611.76072
7020.0000 -71.36409 -69.21053 2.15356 1.99729 -69.21641 620.29397
7025.0000 -71.08065 -68.86623 2.21442 2.01629 -69.03289 602.79816
7030.0000 -70.98935 -68.65416 2.33519 2.04886 -68.71846 663.37143
7035.0000 -71.44710 -68.94557 2.50153 2.03555 -68.84694 665.75549
7040.0000 -71.32184 -68.71710 2.60473 2.04055 -68.79871 652.59458
7045.0000 -71.96693 -69.60513 2.36180 2.01062 -69.08766 654.15857
7050.0000 -72.12673 -70.27453 1.85220 1.89247 -70.22841 514.81883
7055.0000 -72.30649 -69.80049 2.50600 1.94689 -69.70300 580.35618
7060.0000 -71.92181 -70.00053 1.92128 1.94814 -69.69090 563.97838
7065.0000 -72.12181 -69.53005 2.59177 1.94407 -69.73023 545.18412
7070.0000 -71.26768 -68.57993 2.68775 1.98097 -69.37393 577.93139
7075.0000 -71.37458 -69.38468 1.98991 2.04383 -68.76703 664.16676
7080.0000 -71.77259 -69.09683 2.67575 1.98364 -69.34818 584.66737
7085.0000 -71.21496 -68.88537 2.32960 2.02227 -68.97523 621.44799
7090.0000 -71.43898 -69.30059 2.13839 2.01550 -69.04055 607.10834
7095.0000 -71.10056 -68.83332 2.26724 2.03416 -68.86044 654.96862
7100.0000 -71.70995 -69.43712 2.27282 1.99141 -69.27311 634.35822
7105.0000 -72.26142 -70.07593 2.18549 1.97773 -69.40521 624.13144
7110.0000 -71.51004 -69.57148 1.93856 1.96106 -69.56618 582.53470
7115.0000 -71.95423 -68.99430 2.95993 1.96875 -69.49195 552.18070
7120.0000 -71.50373 -69.26057 2.24315 1.99991 -69.19107 624.79481
7125.0000 -70.56571 -68.67279 1.89293 1.99407 -69.24749 582.64781
7130.0000 -71.69140 -68.84179 2.84961 2.09209 -68.30105 700.40707
7135.0000 -70.79254 -68.23500 2.55754 2.04105 -68.79388 629.89018
7140.0000 -70.89637 -68.06790 2.82846 2.11784 -68.05249 684.59392
7145.0000 -71.11067 -68.36828 2.74238 2.08799 -68.34068 709.97466
7150.0000 -70.72738 -67.88359 2.84380 2.12818 -67.95262 711.59741
7155.0000 -70.99234 -68.58180 2.41054 2.08427 -68.37664 684.80312
7160.0000 -71.22270 -69.25578 1.96693 2.03981 -68.80584 689.86709
7165.0000 -71.46791 -68.65877 2.80914 2.01334 -69.06144 642.85418
7170.0000 -71.47246 -69.21648 2.25598 2.03219 -68.87942 640.49917
7175.0000 -71.46232 -69.28697 2.17535 2.00462 -69.14560 619.55590
7180.0000 -70.90234 -68.29249 2.60985 2.02866 -68.91347 637.00060
7185.0000 -71.42587 -69.10959 2.31628 2.03307 -68.87090 672.52609
7190.0000 -71.91159 -69.30380 2.60779 1.97716 -69.41073 609.23312
7195.0000 -71.93060 -69.14226 2.78834 1.99884 -69.20142 611.12435
7200.0000 -71.67715 -69.10579 2.57137 1.98701 -69.31560 598.73325
7205.0000 -71.41301 -68.48657 2.92645 2.05598 -68.64975 667.42273
7210.0000 -71.35834 -68.95556 2.40278 2.01179 -69.07639 606.90990
7215.0000 -72.01871 -69.54037 2.47834 1.93168 -69.84979 563.35130
7220.0000 -72.18672 -70.03156 2.15516 1.91608 -70.00048 551.08451
7225.0000 -71.65156 -68.95502 2.69654 1.95365 -69.63772 593.05273
7230.0000 -71.60734 -68.72969 2.87765 2.02546 -68.94442 652.53208
7235.0000 -71.57581 -69.40559 2.17022 2.00137 -69.17699 651.94656
7240.0000 -72.16892 -68.89312 3.27580 2.01070 -69.08690 652.89929
7245.0000 -71.18515 -68.84518 2.33997 2.05851 -68.62533 676.00663
7250.0000 -71.07532 -68.13341 2.94190 2.08394 -68.37982 672.12852
FREEZING PROCESS: loop number 30 T-loop= 597.00000000000000
main_MD> interactions number 30 at Temperature= 597.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.57458 1.40400 0.32778
force_rgl> df(natom) 0.51297 0.50765 2.07142
7255.0000 -70.93424 -68.22463 2.70962 2.09205 -68.30147 653.28090
7260.0000 -71.78922 -68.81166 2.97757 2.06907 -68.52334 645.64780
7265.0000 -71.47313 -69.01416 2.45897 2.02799 -68.92002 640.92373
7270.0000 -71.47968 -69.21730 2.26238 1.97172 -69.46327 575.49730
7275.0000 -71.34389 -69.00756 2.33633 2.00411 -69.15050 615.05408
7280.0000 -71.38381 -68.46542 2.91839 2.04321 -68.77303 653.70101
7285.0000 -71.36899 -68.60630 2.76269 2.05504 -68.65881 653.98635
7290.0000 -71.48459 -69.47342 2.01118 2.01527 -69.04274 658.02995
7295.0000 -71.47283 -68.90461 2.56821 2.02651 -68.93422 668.73488
7300.0000 -72.50764 -70.09647 2.41117 1.98304 -69.35397 599.92347
7305.0000 -71.20863 -69.05043 2.15820 1.95908 -69.58526 571.10705
7310.0000 -71.46531 -69.14469 2.32062 2.02500 -68.94888 607.37336
7315.0000 -71.78334 -69.43174 2.35160 1.99403 -69.24789 632.44187
7320.0000 -71.51018 -69.11355 2.39663 1.98730 -69.31282 579.30653
7325.0000 -71.22987 -68.50725 2.72262 2.05797 -68.63054 675.50920
7330.0000 -72.09027 -69.31027 2.78000 1.99316 -69.25626 601.64908
7335.0000 -71.56577 -68.84571 2.72006 2.01556 -69.03995 621.67694
7340.0000 -71.80114 -69.64956 2.15158 1.98738 -69.31204 612.85521
7345.0000 -71.52238 -68.85416 2.66822 1.98826 -69.30357 669.15377
7350.0000 -71.71997 -69.08964 2.63033 2.01576 -69.03801 629.62751
7355.0000 -70.87414 -69.07834 1.79580 2.01372 -69.05776 645.35785
7360.0000 -70.60641 -68.03522 2.57119 2.03608 -68.84186 642.49399
7365.0000 -71.69923 -69.00215 2.69708 2.08949 -68.32624 714.71594
7370.0000 -71.26940 -69.13308 2.13632 1.99647 -69.22432 606.23518
7375.0000 -71.13786 -68.82920 2.30866 2.01936 -69.00329 619.23952
7380.0000 -72.06387 -69.83213 2.23174 2.00536 -69.13844 606.44702
7385.0000 -71.73446 -69.71808 2.01637 1.94508 -69.72049 548.66169
7390.0000 -72.10681 -70.20383 1.90298 1.93954 -69.77390 560.02543
7395.0000 -71.78481 -69.73814 2.04667 1.90929 -70.06601 537.97624
7400.0000 -72.27362 -69.40266 2.87096 1.99013 -69.28548 623.18691
7405.0000 -71.51420 -68.90025 2.61395 1.99713 -69.21794 615.49058
7410.0000 -71.10876 -68.82332 2.28544 2.03093 -68.89156 659.92012
7415.0000 -71.62482 -69.39239 2.23243 2.02000 -68.99715 663.75126
7420.0000 -70.76892 -68.79769 1.97123 2.01526 -69.04286 638.10499
7425.0000 -71.81184 -69.40451 2.40733 1.97728 -69.40956 618.27609
7430.0000 -71.91009 -68.82557 3.08452 1.99684 -69.22069 628.77190
7435.0000 -71.53281 -69.14864 2.38417 2.03131 -68.88796 669.06257
7440.0000 -72.01082 -69.83044 2.18038 1.95988 -69.57756 597.59410
7445.0000 -72.31610 -70.34376 1.97234 1.91372 -70.02321 503.29063
7450.0000 -72.55177 -70.56934 1.98242 1.85600 -70.58054 461.02578
7455.0000 -72.30160 -70.43961 1.86199 1.85483 -70.59184 481.50876
7460.0000 -72.07931 -69.54188 2.53743 1.92920 -69.87376 562.74793
7465.0000 -71.61963 -69.82911 1.79052 1.96590 -69.51940 595.35753
7470.0000 -71.73460 -69.43112 2.30349 1.94721 -69.69986 588.10047
7475.0000 -71.78891 -69.88158 1.90734 1.99095 -69.27757 589.16470
7480.0000 -71.30460 -68.55128 2.75332 1.94670 -69.70479 528.73551
7485.0000 -72.03155 -70.27565 1.75590 1.97079 -69.47223 592.60771
7490.0000 -71.81034 -69.79308 2.01725 1.88807 -70.27085 480.47721
7495.0000 -71.08700 -69.16579 1.92121 1.98213 -69.36274 587.35661
7500.0000 -71.78275 -69.41498 2.36777 1.99014 -69.28537 589.77041
FREEZING PROCESS: loop number 31 T-loop= 572.00000000000000
main_MD> interactions number 31 at Temperature= 572.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.59530 -0.93434 1.44748
force_rgl> df(natom) -0.53071 0.00823 -0.19686
7505.0000 -71.81126 -69.73273 2.07853 2.00404 -69.15121 616.55572
7510.0000 -71.16969 -69.47676 1.69292 1.95761 -69.59951 551.86722
7515.0000 -72.25602 -69.80580 2.45022 1.97545 -69.42720 585.90476
7520.0000 -71.85891 -69.49583 2.36308 1.92091 -69.95377 557.69017
7525.0000 -71.77729 -69.64470 2.13258 1.97596 -69.42235 629.32242
7530.0000 -72.34971 -70.70331 1.64640 1.91669 -69.99458 535.41016
7535.0000 -71.90684 -69.70371 2.20313 1.92656 -69.89931 530.39841
7540.0000 -71.72340 -69.39445 2.32895 1.97363 -69.44481 577.87066
7545.0000 -72.22145 -69.64909 2.57236 1.96297 -69.54775 543.66224
7550.0000 -71.93254 -70.03275 1.89980 1.93643 -69.80393 530.16809
7555.0000 -71.83713 -68.91107 2.92606 1.96649 -69.51375 593.08221
7560.0000 -71.44867 -69.28954 2.15913 1.99638 -69.22514 605.13453
7565.0000 -71.44414 -69.29668 2.14746 1.97841 -69.39867 589.24376
7570.0000 -72.13806 -69.53474 2.60332 1.98714 -69.31436 601.60924
7575.0000 -71.48524 -69.53252 1.95273 1.98565 -69.32875 631.55660
7580.0000 -72.28674 -69.98935 2.29739 1.93308 -69.83629 556.89149
7585.0000 -72.06740 -70.02213 2.04527 1.91562 -70.00491 541.46964
7590.0000 -71.66388 -69.18345 2.48044 1.98610 -69.32446 584.36925
7595.0000 -71.77921 -69.15738 2.62183 2.00333 -69.15810 639.25316
7600.0000 -71.79215 -69.41516 2.37699 1.94932 -69.67956 567.31174
7605.0000 -72.05400 -69.65526 2.39873 1.94742 -69.69791 564.05460
7610.0000 -72.14758 -70.02360 2.12398 1.92402 -69.92376 554.27785
7615.0000 -72.14754 -70.17484 1.97270 1.90643 -70.09362 519.73246
7620.0000 -71.87559 -70.36124 1.51435 1.89931 -70.16233 515.83095
7625.0000 -72.72679 -70.77589 1.95090 1.86580 -70.48594 504.10516
7630.0000 -72.19745 -70.01498 2.18246 1.87678 -70.37985 496.94077
7635.0000 -71.80534 -69.84752 1.95782 1.90672 -70.09085 526.04830
7640.0000 -71.26654 -69.42768 1.83886 1.99142 -69.27303 605.45547
7645.0000 -70.96659 -69.16870 1.79788 1.99196 -69.26787 580.38816
7650.0000 -71.70678 -69.47793 2.22886 1.99000 -69.28679 592.22998
7655.0000 -72.16380 -69.97448 2.18932 1.93267 -69.84028 549.06469
7660.0000 -72.14904 -69.99248 2.15656 1.91553 -70.00578 511.24077
7665.0000 -72.21623 -70.28177 1.93446 1.89573 -70.19695 511.08487
7670.0000 -72.00038 -69.62535 2.37503 1.92493 -69.91505 554.45883
7675.0000 -71.63032 -69.64975 1.98057 1.98276 -69.35668 580.33559
7680.0000 -71.93711 -69.52987 2.40724 1.97910 -69.39204 587.10072
7685.0000 -72.50528 -69.89725 2.60803 1.95249 -69.64896 545.99870
7690.0000 -71.82948 -69.23661 2.59287 1.96774 -69.50167 562.69128
7695.0000 -71.87329 -70.39598 1.47731 1.94399 -69.73097 555.10797
7700.0000 -72.35771 -70.70858 1.64913 1.85388 -70.60102 467.27659
7705.0000 -71.13743 -69.26257 1.87486 1.88387 -70.31143 489.55246
7710.0000 -71.22401 -68.63462 2.58939 2.02184 -68.97936 636.50727
7715.0000 -71.71579 -69.49067 2.22513 1.98984 -69.28830 587.79389
7720.0000 -71.04824 -69.27436 1.77388 2.00383 -69.15323 603.85516
7725.0000 -71.52289 -69.02114 2.50174 2.02410 -68.95756 626.45519
7730.0000 -71.23928 -68.32339 2.91589 2.10181 -68.20722 683.19567
7735.0000 -71.23242 -69.29503 1.93738 2.00523 -69.13968 592.28113
7740.0000 -71.40521 -69.28998 2.11523 1.97291 -69.45172 567.53232
7745.0000 -70.72522 -68.99335 1.73187 2.01789 -69.01749 607.56047
7750.0000 -72.04839 -69.27006 2.77834 2.00784 -69.11447 602.18642
FREEZING PROCESS: loop number 32 T-loop= 547.00000000000000
main_MD> interactions number 32 at Temperature= 547.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.27109 0.00835 -2.12608
force_rgl> df(natom) -2.66544 -1.24945 -2.98597
7755.0000 -71.95762 -69.54817 2.40945 1.96254 -69.55187 603.58009
7760.0000 -72.37856 -69.71223 2.66633 1.97058 -69.47421 614.26711
7765.0000 -71.55663 -69.41002 2.14661 1.96315 -69.54599 579.70283
7770.0000 -72.44879 -69.25099 3.19780 2.02971 -68.90341 638.02697
7775.0000 -71.97110 -69.06622 2.90488 2.00766 -69.11621 649.59122
7780.0000 -72.32722 -69.98103 2.34619 1.95501 -69.62455 610.15757
7785.0000 -72.15955 -70.02190 2.13765 1.90331 -70.12378 523.65979
7790.0000 -71.99122 -70.65486 1.33637 1.85089 -70.62984 480.97255
7795.0000 -72.83080 -70.87241 1.95839 1.83150 -70.81702 472.64415
7800.0000 -72.61675 -70.33520 2.28155 1.88918 -70.26013 548.34750
7805.0000 -72.54557 -69.75227 2.79329 1.90092 -70.14682 509.90306
7810.0000 -72.21685 -69.96012 2.25673 1.93690 -69.79939 575.97567
7815.0000 -72.43912 -70.05719 2.38193 1.92087 -69.95417 558.14559
7820.0000 -72.12214 -70.21891 1.90323 1.87408 -70.40598 495.03347
7825.0000 -72.13172 -70.06056 2.07117 1.90355 -70.12144 560.36521
7830.0000 -72.19853 -69.64960 2.54893 1.94013 -69.76823 566.61429
7835.0000 -72.19978 -70.32429 1.87549 1.90284 -70.12832 529.43425
7840.0000 -72.24724 -69.98428 2.26295 1.87813 -70.36684 508.38053
7845.0000 -72.44975 -70.69279 1.75695 1.85538 -70.58646 474.70507
7850.0000 -72.10234 -70.43063 1.67172 1.84729 -70.66459 469.86601
7855.0000 -71.62454 -69.87601 1.74853 1.89574 -70.19681 509.25512
7860.0000 -71.81050 -69.15871 2.65179 1.97531 -69.42855 607.32979
7865.0000 -71.74772 -69.38677 2.36096 1.98344 -69.35007 566.87555
7870.0000 -72.14173 -69.89130 2.25044 1.97142 -69.46615 586.17234
7875.0000 -72.07286 -69.69656 2.37630 1.94540 -69.71738 558.31060
7880.0000 -72.01790 -69.59596 2.42195 1.92420 -69.92206 549.28202
7885.0000 -72.04787 -69.85379 2.19408 1.94284 -69.74206 608.55616
7890.0000 -72.03272 -70.33006 1.70266 1.87399 -70.40680 477.12563
7895.0000 -72.29046 -70.54487 1.74559 1.86875 -70.45744 480.53793
7900.0000 -72.62146 -70.87751 1.74394 1.86015 -70.54045 463.47565
7905.0000 -72.61885 -70.94432 1.67453 1.80145 -71.10724 417.18341
7910.0000 -72.60376 -70.33178 2.27198 1.82177 -70.91104 447.87324
7915.0000 -72.47760 -70.39041 2.08720 1.87968 -70.35189 504.79307
7920.0000 -72.61099 -69.76300 2.84799 1.92625 -69.90230 558.34382
7925.0000 -72.32425 -69.80118 2.52307 1.93384 -69.82898 548.92949
7930.0000 -71.54141 -69.59479 1.94663 1.92152 -69.94794 539.37461
7935.0000 -72.11736 -69.47102 2.64635 1.95937 -69.58245 590.99696
7940.0000 -71.60730 -69.37533 2.23197 1.92961 -69.86986 559.57013
7945.0000 -71.58084 -69.50141 2.07943 1.93858 -69.78318 593.15675
7950.0000 -71.93734 -69.58856 2.34878 1.96330 -69.54459 581.04984
7955.0000 -71.54525 -69.25548 2.28977 1.98593 -69.32609 585.89599
7960.0000 -71.45035 -69.10793 2.34242 1.97931 -69.38992 577.19240
7965.0000 -72.00279 -69.25459 2.74820 1.97217 -69.45889 591.59775
7970.0000 -72.08939 -69.66820 2.42119 1.97538 -69.42793 622.84982
7975.0000 -71.30967 -69.37183 1.93784 1.95864 -69.58956 598.28391
7980.0000 -70.87690 -69.30903 1.56786 1.98258 -69.35838 583.61285
7985.0000 -71.69388 -69.50914 2.18473 1.98537 -69.33149 611.84078
7990.0000 -71.76167 -69.50494 2.25673 1.98083 -69.37529 616.12916
7995.0000 -72.52432 -70.71986 1.80446 1.86669 -70.47734 477.00919
8000.0000 -72.34083 -70.12242 2.21841 1.86259 -70.51691 478.74275
FREEZING PROCESS: loop number 33 T-loop= 522.00000000000000
main_MD> interactions number 33 at Temperature= 522.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.40831 -2.05636 0.59309
force_rgl> df(natom) -0.39470 -0.55436 0.75218
8005.0000 -72.21881 -70.18966 2.02915 1.86550 -70.48879 483.93075
8010.0000 -72.38429 -70.35511 2.02918 1.90193 -70.13711 522.84938
8015.0000 -72.48156 -70.10834 2.37321 1.87074 -70.43817 498.31819
8020.0000 -72.31422 -69.87232 2.44190 1.91189 -70.04093 515.03459
8025.0000 -71.84538 -69.85834 1.98704 1.92891 -69.87655 577.54161
8030.0000 -71.75425 -69.89200 1.86225 1.93810 -69.78781 557.57045
8035.0000 -72.38661 -70.14253 2.24408 1.93688 -69.79963 564.20441
8040.0000 -71.80275 -69.56038 2.24237 1.95115 -69.66181 570.03039
8045.0000 -71.64875 -69.79218 1.85657 1.95086 -69.66466 581.47574
8050.0000 -72.39043 -70.47071 1.91971 1.88920 -70.25998 509.36824
8055.0000 -72.30914 -70.05205 2.25710 1.89564 -70.19776 527.06172
8060.0000 -72.75462 -71.06500 1.68962 1.86488 -70.49482 496.42627
8065.0000 -71.93581 -69.90027 2.03554 1.85166 -70.62245 492.68238
8070.0000 -72.55406 -70.82216 1.73190 1.88715 -70.27977 506.84158
8075.0000 -72.42390 -70.63073 1.79317 1.84960 -70.64233 467.86333
8080.0000 -71.86048 -70.54336 1.31713 1.85601 -70.58045 451.19156
8085.0000 -73.05589 -71.05405 2.00184 1.85916 -70.55000 460.26778
8090.0000 -72.33148 -70.81739 1.51409 1.85058 -70.63283 473.76819
8095.0000 -72.04250 -70.22751 1.81500 1.87954 -70.35322 500.65623
8100.0000 -72.56781 -70.29456 2.27325 1.89011 -70.25123 526.38527
8105.0000 -71.65582 -69.58991 2.06590 1.91732 -69.98848 563.75371
8110.0000 -71.97839 -70.18362 1.79477 1.94003 -69.76924 564.42247
8115.0000 -71.92661 -70.15936 1.76725 1.89299 -70.22335 513.38878
8120.0000 -72.13164 -69.99890 2.13274 1.88567 -70.29403 492.23157
8125.0000 -72.27700 -70.30154 1.97546 1.93135 -69.85298 549.33890
8130.0000 -71.46865 -69.53501 1.93364 1.92394 -69.92453 537.44237
8135.0000 -72.67720 -70.49346 2.18374 1.92191 -69.94421 539.17335
8140.0000 -72.38075 -70.28074 2.10001 1.89901 -70.16525 526.01818
8145.0000 -71.86455 -70.02717 1.83738 1.88998 -70.25241 515.11290
8150.0000 -71.76552 -69.81258 1.95293 1.92160 -69.94715 509.81854
8155.0000 -71.65716 -70.14915 1.50800 1.91005 -70.05869 530.93423
8160.0000 -72.24525 -70.13309 2.11216 1.92881 -69.87754 533.86760
8165.0000 -72.39630 -70.39560 2.00070 1.87873 -70.36106 494.37496
8170.0000 -71.87917 -69.81494 2.06423 1.90924 -70.06651 524.23662
8175.0000 -71.65496 -69.94619 1.70877 1.92120 -69.95104 512.14924
8180.0000 -72.40464 -70.41362 1.99102 1.90374 -70.11957 509.80950
8185.0000 -72.61491 -70.30963 2.30529 1.87445 -70.40237 489.61336
8190.0000 -72.63555 -71.23501 1.40054 1.86136 -70.52878 479.62076
8195.0000 -72.40755 -70.23568 2.17187 1.84631 -70.67410 472.11140
8200.0000 -72.25859 -69.64444 2.61414 1.92380 -69.92592 531.84762
8205.0000 -72.04732 -69.65084 2.39648 1.99822 -69.20739 624.78328
8210.0000 -71.92587 -69.62083 2.30505 1.92251 -69.93833 555.75828
8215.0000 -71.91808 -69.33504 2.58304 1.94372 -69.73359 588.49228
8220.0000 -72.41384 -70.20537 2.20847 1.92388 -69.92510 549.28733
8225.0000 -72.64555 -70.61160 2.03395 1.87240 -70.42219 504.80807
8230.0000 -72.40425 -70.15719 2.24706 1.89637 -70.19077 516.93759
8235.0000 -72.35655 -70.17372 2.18283 1.85989 -70.54296 518.48950
8240.0000 -71.16279 -69.14115 2.02164 1.95772 -69.59840 613.66852
8245.0000 -71.44955 -69.67291 1.77664 1.94555 -69.71595 531.34434
8250.0000 -72.16969 -69.87318 2.29651 1.93381 -69.82924 527.66949
FREEZING PROCESS: loop number 34 T-loop= 497.00000000000000
main_MD> interactions number 34 at Temperature= 497.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.71105 1.24180 1.53121
force_rgl> df(natom) -1.17086 -1.75908 -1.10516
8255.0000 -72.45499 -70.73981 1.71518 1.87506 -70.39649 501.41216
8260.0000 -72.33140 -69.83424 2.49717 1.83671 -70.76674 459.99254
8265.0000 -72.05409 -69.81633 2.23776 1.94695 -69.70237 590.06556
8270.0000 -71.80200 -69.68375 2.11825 1.95804 -69.59530 557.97980
8275.0000 -72.48071 -70.71510 1.76561 1.88782 -70.27333 494.89376
8280.0000 -72.80280 -71.11860 1.68420 1.82816 -70.84931 447.69145
8285.0000 -72.56671 -70.91399 1.65272 1.78619 -71.25452 400.79547
8290.0000 -72.53984 -71.12405 1.41579 1.85366 -70.60308 475.74685
8295.0000 -72.87834 -71.31869 1.55965 1.79492 -71.17028 417.16132
8300.0000 -72.56831 -70.81696 1.75135 1.81520 -70.97446 424.05993
8305.0000 -72.55668 -70.49511 2.06157 1.88788 -70.27275 499.26745
8310.0000 -71.77770 -69.23715 2.54055 1.93430 -69.82456 514.10161
8315.0000 -72.28479 -70.23577 2.04902 1.92166 -69.94656 522.85519
8320.0000 -71.83364 -69.85404 1.97960 1.89584 -70.19586 498.22378
8325.0000 -72.32212 -70.61887 1.70325 1.89269 -70.22632 479.53409
8330.0000 -72.08204 -70.52370 1.55835 1.87286 -70.41775 470.25606
8335.0000 -72.14256 -70.07811 2.06444 1.89119 -70.24076 483.86796
8340.0000 -71.90764 -70.34652 1.56112 1.89228 -70.23021 471.54961
8345.0000 -72.18629 -70.22155 1.96474 1.88424 -70.30782 475.09820
8350.0000 -71.47433 -69.87206 1.60226 1.89625 -70.19194 485.67590
8355.0000 -71.85786 -68.97516 2.88270 1.96775 -69.50162 556.52389
8360.0000 -71.77724 -69.91663 1.86061 1.96369 -69.54081 553.75834
8365.0000 -71.45492 -69.54685 1.90807 1.95128 -69.66062 518.24366
8370.0000 -71.72168 -69.39977 2.32191 1.95203 -69.65333 544.74214
8375.0000 -71.92572 -69.87815 2.04757 1.98802 -69.30592 578.66068
8380.0000 -72.35476 -70.90873 1.44602 1.86006 -70.54130 466.55846
8385.0000 -72.00242 -70.04340 1.95902 1.86981 -70.44714 487.47428
8390.0000 -71.15899 -69.54991 1.60908 1.96770 -69.50210 620.66208
8395.0000 -72.08192 -69.88804 2.19388 1.93391 -69.82828 555.92201
8400.0000 -72.11064 -70.01202 2.09862 1.92517 -69.91266 539.97091
8405.0000 -71.35971 -69.52615 1.83357 1.93628 -69.80538 549.03938
8410.0000 -71.92450 -69.98477 1.93973 1.91489 -70.01195 512.79610
8415.0000 -72.08611 -70.04024 2.04587 1.92146 -69.94848 547.17858
8420.0000 -71.95760 -69.85373 2.10387 1.93663 -69.80200 569.82085
8425.0000 -72.27472 -70.52886 1.74586 1.87716 -70.37625 500.83116
8430.0000 -72.16094 -69.66065 2.50030 1.90408 -70.11626 529.67887
8435.0000 -71.44448 -69.68517 1.75932 1.94549 -69.71652 540.87226
8440.0000 -72.53864 -70.73842 1.80021 1.88973 -70.25488 504.22240
8445.0000 -72.39303 -70.82695 1.56608 1.86636 -70.48051 505.75852
8450.0000 -72.32841 -70.40192 1.92649 1.86722 -70.47217 489.08899
8455.0000 -72.36507 -69.95618 2.40889 1.90502 -70.10725 530.82091
8460.0000 -72.40390 -70.25956 2.14435 1.87769 -70.37112 503.62219
8465.0000 -72.72222 -70.55739 2.16483 1.82776 -70.85320 465.14999
8470.0000 -72.37439 -70.32607 2.04831 1.86246 -70.51816 492.63191
8475.0000 -72.24852 -70.26609 1.98243 1.92502 -69.91417 561.99132
8480.0000 -72.50441 -70.66092 1.84350 1.85430 -70.59697 484.86922
8485.0000 -71.94603 -70.27795 1.66808 1.85319 -70.60761 484.48068
8490.0000 -72.38161 -70.08361 2.29800 1.86493 -70.49433 483.72752
8495.0000 -72.11928 -70.04658 2.07270 1.89622 -70.19217 493.00381
8500.0000 -72.04138 -70.07475 1.96663 1.90078 -70.14813 520.57095
FREEZING PROCESS: loop number 35 T-loop= 472.00000000000000
main_MD> interactions number 35 at Temperature= 472.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.51925 0.37846 -0.26168
force_rgl> df(natom) -0.56413 1.73548 -1.29778
8505.0000 -72.86540 -70.79821 2.06719 1.85302 -70.60925 483.68516
8510.0000 -72.92833 -71.37268 1.55565 1.81133 -71.01182 435.32439
8515.0000 -72.47959 -70.80336 1.67624 1.80147 -71.10699 427.38310
8520.0000 -72.34786 -70.73445 1.61341 1.82823 -70.84864 446.53460
8525.0000 -72.93550 -71.07995 1.85555 1.79724 -71.14787 419.22402
8530.0000 -72.93762 -71.43739 1.50023 1.77475 -71.36494 401.01277
8535.0000 -72.77272 -71.00358 1.76914 1.78352 -71.28029 405.78231
8540.0000 -72.42769 -71.18487 1.24282 1.78839 -71.23330 408.71104
8545.0000 -72.37998 -70.27934 2.10064 1.81065 -71.01832 456.36489
8550.0000 -72.78071 -70.55468 2.22602 1.86920 -70.45303 507.66024
8555.0000 -72.45745 -70.48300 1.97446 1.85933 -70.54833 495.72896
8560.0000 -72.73306 -70.75469 1.97837 1.83710 -70.76304 468.23220
8565.0000 -72.73578 -70.49760 2.23818 1.82284 -70.90072 445.80083
8570.0000 -72.38788 -70.61328 1.77460 1.84318 -70.70434 468.11264
8575.0000 -72.28961 -70.11899 2.17063 1.86970 -70.44822 506.14167
8580.0000 -72.30383 -70.56119 1.74264 1.88115 -70.33774 517.38499
8585.0000 -71.94934 -70.54705 1.40229 1.87754 -70.37252 514.99425
8590.0000 -72.30970 -70.58578 1.72392 1.83713 -70.76266 465.01240
8595.0000 -72.98293 -71.45834 1.52459 1.80962 -71.02835 429.62703
8600.0000 -72.27458 -70.66536 1.60923 1.80745 -71.04925 434.79525
8605.0000 -72.78738 -70.85461 1.93277 1.82865 -70.84462 459.41799
8610.0000 -72.85445 -70.66157 2.19287 1.86331 -70.50995 512.29468
8615.0000 -72.13405 -70.37749 1.75655 1.87777 -70.37036 504.11479
8620.0000 -71.78769 -70.25673 1.53095 1.90729 -70.08527 538.37445
8625.0000 -72.74884 -70.98052 1.76831 1.84849 -70.65306 462.27880
8630.0000 -72.81432 -71.42556 1.38877 1.78883 -71.22901 403.17192
8635.0000 -72.71862 -70.37544 2.34318 1.78840 -71.23317 408.76866
8640.0000 -72.52695 -70.89704 1.62991 1.85142 -70.62475 492.45017
8645.0000 -72.44779 -69.91273 2.53506 1.86406 -70.50274 489.35085
8650.0000 -72.44981 -70.66004 1.78978 1.90106 -70.14543 522.19941
8655.0000 -73.13872 -71.42826 1.71046 1.81387 -70.98732 440.15795
8660.0000 -72.58717 -70.50081 2.08636 1.79892 -71.13163 430.63150
8665.0000 -72.34783 -70.63444 1.71339 1.84105 -70.72483 476.53125
8670.0000 -72.74280 -70.34378 2.39902 1.85966 -70.54518 501.39512
8675.0000 -72.95884 -71.04531 1.91354 1.88554 -70.29533 524.12896
8680.0000 -72.80595 -71.51601 1.28994 1.80245 -71.09756 433.50866
8685.0000 -72.27197 -70.37112 1.90085 1.81434 -70.98270 443.43294
8690.0000 -71.91770 -70.21407 1.70363 1.89735 -70.18126 536.81930
8695.0000 -72.22362 -70.30760 1.91602 1.91823 -69.97965 537.64878
8700.0000 -72.78697 -70.68093 2.10604 1.86382 -70.50501 469.81989
8705.0000 -72.74729 -71.03384 1.71346 1.85072 -70.63152 476.45402
8710.0000 -72.55168 -70.55876 1.99292 1.81701 -70.95700 426.19638
8715.0000 -72.75979 -70.60364 2.15615 1.86476 -70.49595 488.27455
8720.0000 -72.14632 -70.25086 1.89547 1.89629 -70.19155 486.90545
8725.0000 -71.79920 -69.98934 1.80986 1.89299 -70.22335 492.61771
8730.0000 -72.38194 -70.59045 1.79149 1.88632 -70.28778 496.43525
8735.0000 -72.37023 -70.41532 1.95491 1.84502 -70.68649 457.37438
8740.0000 -71.77796 -69.76053 2.01743 1.88296 -70.32024 464.79525
8745.0000 -72.01999 -70.25530 1.76469 1.90222 -70.13423 486.03205
8750.0000 -71.82140 -70.16648 1.65492 1.89355 -70.21801 469.43328
FREEZING PROCESS: loop number 36 T-loop= 447.00000000000000
main_MD> interactions number 36 at Temperature= 447.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.55013 1.44041 -0.68635
force_rgl> df(natom) 4.88386 -4.53737 -1.10094
8755.0000 -72.65597 -70.94453 1.71144 1.87259 -70.42034 483.23052
8760.0000 -72.73453 -70.68072 2.05381 1.83448 -70.78829 461.71035
8765.0000 -72.58258 -70.76358 1.81900 1.84059 -70.72933 490.24643
8770.0000 -72.77807 -71.18104 1.59703 1.83573 -70.77618 455.99605
8775.0000 -72.76573 -70.88514 1.88059 1.82127 -70.91579 451.13670
8780.0000 -72.76883 -70.81465 1.95417 1.82966 -70.83481 455.32765
8785.0000 -72.94325 -70.90851 2.03474 1.82378 -70.89160 443.71962
8790.0000 -72.34567 -71.03991 1.30577 1.81510 -70.97538 422.01908
8795.0000 -72.71880 -70.78779 1.93101 1.81658 -70.96113 434.66863
8800.0000 -72.29003 -70.35499 1.93505 1.82184 -70.91035 442.38082
8805.0000 -72.74980 -71.31345 1.43635 1.84082 -70.72710 460.46827
8810.0000 -72.89412 -71.32683 1.56729 1.75895 -71.51748 368.45650
8815.0000 -73.30929 -71.43896 1.87033 1.78702 -71.24653 406.85010
8820.0000 -72.96161 -71.04197 1.91963 1.81551 -70.97147 445.74913
8825.0000 -73.05142 -71.57411 1.47731 1.78317 -71.28368 417.08581
8830.0000 -73.38969 -71.68804 1.70165 1.74880 -71.61549 376.86678
8835.0000 -72.21413 -71.03018 1.18395 1.80023 -71.11900 415.05775
8840.0000 -72.77969 -70.92102 1.85867 1.80127 -71.10894 424.47270
8845.0000 -72.87977 -71.08914 1.79063 1.81548 -70.97170 444.31543
8850.0000 -72.92070 -71.49154 1.42916 1.76462 -71.46282 374.60815
8855.0000 -72.72673 -70.90480 1.82193 1.80811 -71.04292 428.85113
8860.0000 -72.54097 -70.85168 1.68930 1.83902 -70.74443 467.47357
8865.0000 -72.40509 -70.86809 1.53701 1.83426 -70.79037 452.62645
8870.0000 -72.87321 -71.06938 1.80383 1.80906 -71.03375 425.87554
8875.0000 -72.98267 -71.48548 1.49719 1.82424 -70.88714 431.43133
8880.0000 -72.74798 -71.11400 1.63398 1.79672 -71.15284 414.45386
8885.0000 -72.47298 -70.58557 1.88741 1.82273 -70.90174 437.42188
8890.0000 -72.41565 -70.50338 1.91228 1.85237 -70.61554 480.24732
8895.0000 -72.20924 -70.20609 2.00315 1.88273 -70.32248 504.19009
8900.0000 -72.37854 -70.83354 1.54500 1.85324 -70.60717 473.26607
8905.0000 -72.59138 -71.12661 1.46477 1.82526 -70.87736 446.36804
8910.0000 -72.78890 -71.05683 1.73207 1.79584 -71.16134 420.18317
8915.0000 -72.50387 -70.50041 2.00346 1.83341 -70.79861 461.43713
8920.0000 -72.66825 -70.90160 1.76666 1.83866 -70.74796 476.66663
8925.0000 -72.53892 -71.01811 1.52081 1.81171 -71.00812 436.25076
8930.0000 -72.93693 -71.22793 1.70901 1.80983 -71.02631 448.02754
8935.0000 -72.85791 -71.18989 1.66802 1.77117 -71.39954 420.36531
8940.0000 -72.66843 -70.94996 1.71847 1.84717 -70.66580 483.84805
8945.0000 -71.81164 -70.49309 1.31855 1.82784 -70.85244 446.89411
8950.0000 -72.36668 -70.88749 1.47919 1.82767 -70.85401 441.87893
8955.0000 -72.37036 -70.27003 2.10033 1.83043 -70.82742 422.10872
8960.0000 -72.85025 -70.84929 2.00096 1.83217 -70.81059 432.22438
8965.0000 -72.17869 -70.32593 1.85275 1.84073 -70.72793 446.80678
8970.0000 -72.82870 -71.11210 1.71660 1.86411 -70.50226 478.55286
8975.0000 -72.65226 -71.13890 1.51336 1.78072 -71.30738 375.64475
8980.0000 -72.75387 -70.66768 2.08619 1.83452 -70.78789 433.65936
8985.0000 -72.94537 -71.28989 1.65547 1.81067 -71.01814 421.67383
8990.0000 -72.78972 -71.14598 1.64375 1.80132 -71.10843 397.67517
8995.0000 -72.46048 -70.40206 2.05843 1.82162 -70.91246 439.68628
9000.0000 -72.53515 -70.90574 1.62941 1.88459 -70.30451 504.21154
FREEZING PROCESS: loop number 37 T-loop= 422.00000000000000
main_MD> interactions number 37 at Temperature= 422.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.29916 -3.03637 1.09417
force_rgl> df(natom) 2.72457 3.09161 0.51963
9005.0000 -72.82244 -71.28242 1.54002 1.80961 -71.02844 417.55802
9010.0000 -72.90933 -71.25646 1.65287 1.80206 -71.10126 433.63850
9015.0000 -72.78816 -71.32612 1.46204 1.79218 -71.19671 421.30158
9020.0000 -72.80641 -71.01428 1.79213 1.81332 -70.99258 445.22017
9025.0000 -73.00267 -71.61921 1.38347 1.78272 -71.28805 417.28445
9030.0000 -73.11312 -71.36337 1.74975 1.78663 -71.25029 400.02025
9035.0000 -72.72391 -71.22579 1.49811 1.76268 -71.48148 374.22785
9040.0000 -72.40761 -71.05123 1.35638 1.84125 -70.72290 448.32451
9045.0000 -72.61119 -70.52138 2.08981 1.83833 -70.75109 454.79959
9050.0000 -72.82833 -71.05161 1.77672 1.82955 -70.83588 457.38652
9055.0000 -72.35247 -70.59942 1.75306 1.84055 -70.72973 471.60974
9060.0000 -72.36593 -70.57347 1.79246 1.85670 -70.57379 510.21666
9065.0000 -72.52742 -71.22028 1.30714 1.83249 -70.80747 455.07614
9070.0000 -73.04834 -71.41351 1.63483 1.80106 -71.11095 425.59690
9075.0000 -72.66211 -70.92563 1.73648 1.81012 -71.02345 439.74652
9080.0000 -72.80273 -71.21308 1.58965 1.81187 -71.00658 444.45218
9085.0000 -73.06880 -71.00739 2.06141 1.80251 -71.09691 421.34153
9090.0000 -72.75242 -71.23674 1.51568 1.78665 -71.25005 397.04488
9095.0000 -72.63722 -70.65798 1.97924 1.80711 -71.05257 417.08266
9100.0000 -72.89442 -70.59379 2.30063 1.85195 -70.61962 490.33038
9105.0000 -72.70215 -71.09569 1.60646 1.83015 -70.83009 444.41286
9110.0000 -72.89742 -71.51462 1.38281 1.78570 -71.25925 412.54176
9115.0000 -73.08508 -71.40127 1.68381 1.74109 -71.68995 365.46539
9120.0000 -72.90810 -71.00347 1.90463 1.81003 -71.02434 438.33426
9125.0000 -72.53160 -70.77744 1.75417 1.83314 -70.80118 461.42017
9130.0000 -72.62898 -70.61502 2.01396 1.84448 -70.69171 478.99371
9135.0000 -72.60462 -71.16166 1.44296 1.79127 -71.20552 408.48352
9140.0000 -72.75132 -70.91202 1.83931 1.81776 -70.94975 458.56435
9145.0000 -72.71249 -71.41808 1.29441 1.78235 -71.29160 399.30875
9150.0000 -72.83291 -71.40386 1.42904 1.76508 -71.45838 389.46367
9155.0000 -73.10894 -71.28605 1.82289 1.78430 -71.27279 419.94987
9160.0000 -72.45735 -71.26853 1.18881 1.78503 -71.26569 405.92413
9165.0000 -73.16182 -71.66289 1.49894 1.76345 -71.47408 381.54221
9170.0000 -73.05047 -71.16876 1.88172 1.75545 -71.55132 397.73833
9175.0000 -72.59935 -70.83833 1.76102 1.83158 -70.81625 455.16702
9180.0000 -72.82899 -71.53776 1.29124 1.79855 -71.13520 411.63633
9185.0000 -72.52626 -71.32782 1.19844 1.79646 -71.15539 409.30872
9190.0000 -72.58600 -70.96631 1.61969 1.78182 -71.29668 409.13212
9195.0000 -72.60889 -71.08699 1.52191 1.83490 -70.78421 471.88722
9200.0000 -72.90676 -71.31189 1.59487 1.79481 -71.17128 425.70715
9205.0000 -73.11253 -71.55643 1.55611 1.78549 -71.26126 416.68049
9210.0000 -72.72304 -70.87750 1.84555 1.77398 -71.37240 404.97272
9215.0000 -72.73192 -71.03328 1.69864 1.80468 -71.07601 446.21137
9220.0000 -72.80776 -71.05556 1.75220 1.82280 -70.90103 457.60134
9225.0000 -73.12092 -71.77949 1.34143 1.76716 -71.43826 395.86756
9230.0000 -72.65236 -71.04478 1.60758 1.77962 -71.31799 413.15575
9235.0000 -72.69598 -71.40539 1.29059 1.78192 -71.29578 426.94153
9240.0000 -73.19945 -71.88342 1.31603 1.74545 -71.64784 372.44153
9245.0000 -73.39149 -72.21646 1.17504 1.71171 -71.97363 330.17665
9250.0000 -73.27971 -71.99304 1.28667 1.69386 -72.14596 311.19560
FREEZING PROCESS: loop number 38 T-loop= 397.00000000000000
main_MD> interactions number 38 at Temperature= 397.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.92011 2.40607 -1.05305
force_rgl> df(natom) -1.35989 -1.99250 1.64606
9255.0000 -73.23162 -71.83699 1.39463 1.76081 -71.49952 383.62705
9260.0000 -72.79327 -71.39537 1.39790 1.75490 -71.55664 372.77859
9265.0000 -73.41717 -72.07666 1.34052 1.73939 -71.70640 367.48949
9270.0000 -72.91142 -71.72503 1.18640 1.72049 -71.88881 351.14334
9275.0000 -73.08275 -70.96612 2.11663 1.78595 -71.25682 414.27553
9280.0000 -72.54181 -70.82441 1.71740 1.81074 -71.01754 433.16500
9285.0000 -72.64064 -70.62085 2.01979 1.82262 -70.90281 437.77096
9290.0000 -72.52380 -71.02556 1.49824 1.84507 -70.68609 478.88550
9295.0000 -73.00455 -71.27891 1.72564 1.79411 -71.17804 417.00894
9300.0000 -73.16012 -71.71929 1.44083 1.76890 -71.42147 396.50302
9305.0000 -72.62014 -70.99767 1.62247 1.78615 -71.25487 421.61528
9310.0000 -72.59107 -70.99898 1.59209 1.80176 -71.10425 426.70036
9315.0000 -72.62838 -70.71553 1.91284 1.81261 -70.99945 439.99591
9320.0000 -72.73163 -71.29414 1.43750 1.79788 -71.14169 411.13723
9325.0000 -72.67596 -70.92704 1.74892 1.77436 -71.36878 399.68648
9330.0000 -72.89885 -71.49763 1.40121 1.80027 -71.11858 425.18517
9335.0000 -72.88596 -71.55217 1.33379 1.74960 -71.60784 371.70900
9340.0000 -73.11689 -71.46128 1.65561 1.74144 -71.68657 367.68142
9345.0000 -72.93303 -71.25790 1.67513 1.79595 -71.16026 421.52546
9350.0000 -73.07575 -71.32314 1.75262 1.78134 -71.30135 406.19705
9355.0000 -72.70206 -71.13375 1.56832 1.78218 -71.29320 406.36043
9360.0000 -72.91870 -71.59560 1.32310 1.77759 -71.33752 400.73342
9365.0000 -73.00224 -71.54550 1.45674 1.78698 -71.24689 405.43285
9370.0000 -73.14066 -71.59529 1.54537 1.73679 -71.73145 346.87798
9375.0000 -73.07378 -71.82397 1.24981 1.74218 -71.67948 350.92615
9380.0000 -72.73714 -70.97056 1.76659 1.76536 -71.45564 388.75664
9385.0000 -72.97005 -71.06476 1.90529 1.78273 -71.28793 401.46929
9390.0000 -73.07323 -71.85127 1.22196 1.75834 -71.52346 374.23727
9395.0000 -73.19045 -71.43985 1.75059 1.75825 -71.52428 380.23831
9400.0000 -73.04927 -71.78390 1.26536 1.75840 -71.52280 384.61421
9405.0000 -73.22755 -71.70114 1.52641 1.70717 -72.01744 313.86845
9410.0000 -72.91813 -71.79518 1.12295 1.76531 -71.45613 399.95110
9415.0000 -72.92662 -71.62423 1.30239 1.73661 -71.73321 354.56955
9420.0000 -72.67685 -71.13401 1.54284 1.75947 -71.51255 380.63835
9425.0000 -72.95466 -71.49980 1.45486 1.77822 -71.33144 395.28049
9430.0000 -72.99510 -71.69016 1.30494 1.75707 -71.53566 375.35920
9435.0000 -72.97105 -71.43594 1.53510 1.74723 -71.63063 372.82353
9440.0000 -72.42592 -70.92937 1.49654 1.78543 -71.26189 409.56554
9445.0000 -73.18537 -71.98292 1.20245 1.76091 -71.49861 380.01391
9450.0000 -72.59611 -71.21981 1.37629 1.73734 -71.72617 355.45078
9455.0000 -72.96027 -71.44218 1.51809 1.78875 -71.22985 408.91011
9460.0000 -73.15437 -71.61948 1.53489 1.76581 -71.45125 382.68468
9465.0000 -73.14840 -71.62899 1.51941 1.76200 -71.48808 379.93218
9470.0000 -72.72641 -71.44087 1.28555 1.74539 -71.64846 387.59682
9475.0000 -73.42473 -71.83712 1.58761 1.73347 -71.76349 362.05448
9480.0000 -72.71355 -70.82840 1.88515 1.77529 -71.35979 402.90555
9485.0000 -72.67452 -70.67178 2.00274 1.83800 -70.75432 464.57244
9490.0000 -72.22561 -70.73971 1.48590 1.85862 -70.55523 464.24920
9495.0000 -72.39066 -70.11120 2.27947 1.87733 -70.37457 487.14267
9500.0000 -72.49396 -70.78593 1.70802 1.85655 -70.57523 454.45313
FREEZING PROCESS: loop number 39 T-loop= 372.00000000000000
main_MD> interactions number 39 at Temperature= 372.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -2.24703 0.14027 -0.14535
force_rgl> df(natom) -2.35125 -0.00888 1.10765
9505.0000 -72.75552 -71.26130 1.49422 1.78634 -71.25309 367.15608
9510.0000 -72.16481 -70.89004 1.27477 1.81949 -70.93301 409.28671
9515.0000 -72.47142 -71.01989 1.45152 1.81581 -70.96854 432.87638
9520.0000 -72.75468 -71.59924 1.15544 1.77092 -71.40196 379.72110
9525.0000 -72.89368 -71.50537 1.38830 1.74839 -71.61945 335.48361
9530.0000 -73.13019 -71.61442 1.51577 1.79043 -71.21359 402.55343
9535.0000 -73.19423 -71.63638 1.55785 1.75384 -71.56687 370.11128
9540.0000 -73.09071 -71.62561 1.46510 1.74048 -71.69587 352.69947
9545.0000 -72.66527 -71.50139 1.16388 1.76679 -71.44188 377.65546
9550.0000 -73.13372 -71.61716 1.51657 1.77842 -71.32954 395.06449
9555.0000 -72.70750 -71.43709 1.27041 1.74701 -71.63278 351.09069
9560.0000 -72.67520 -71.35086 1.32434 1.76508 -71.45830 358.95647
9565.0000 -73.10277 -71.92722 1.17555 1.74032 -71.69738 343.74306
9570.0000 -72.75134 -71.01872 1.73262 1.74737 -71.62933 367.64965
9575.0000 -72.61055 -71.61616 0.99439 1.77888 -71.32509 399.22712
9580.0000 -72.70048 -71.40578 1.29470 1.76103 -71.49744 368.64178
9585.0000 -73.18692 -72.01019 1.17673 1.72246 -71.86984 326.70281
9590.0000 -73.06565 -71.87404 1.19161 1.71678 -71.92463 317.67364
9595.0000 -73.08584 -71.64177 1.44407 1.72599 -71.83573 332.08573
9600.0000 -72.80633 -71.15328 1.65305 1.78273 -71.28796 401.06907
9605.0000 -73.03001 -71.43318 1.59683 1.80032 -71.11807 429.71553
9610.0000 -73.06328 -71.70741 1.35587 1.73803 -71.71955 360.89516
9615.0000 -72.94053 -71.40927 1.53126 1.73475 -71.75120 325.31394
9620.0000 -73.15959 -71.45205 1.70754 1.76691 -71.44066 374.22310
9625.0000 -72.63860 -71.36489 1.27371 1.79007 -71.21709 420.27253
9630.0000 -72.85176 -71.46112 1.39064 1.75132 -71.59120 353.15149
9635.0000 -72.84963 -71.37255 1.47707 1.77108 -71.40041 392.63178
9640.0000 -72.66436 -71.55357 1.11079 1.76391 -71.46962 374.97494
9645.0000 -73.24192 -71.84395 1.39797 1.76197 -71.48834 373.81284
9650.0000 -73.42682 -71.78082 1.64599 1.72651 -71.83076 348.57506
9655.0000 -72.73519 -71.71213 1.02306 1.72601 -71.83553 327.28347
9660.0000 -73.07432 -71.81060 1.26372 1.73337 -71.76446 324.98872
9665.0000 -73.19053 -71.53285 1.65767 1.73420 -71.75647 341.33183
9670.0000 -72.98448 -71.74534 1.23915 1.74574 -71.64508 346.05746
9675.0000 -72.90259 -71.29333 1.60926 1.77710 -71.34225 373.74234
9680.0000 -73.39880 -71.66369 1.73511 1.78433 -71.27248 404.49954
9685.0000 -72.91777 -71.31662 1.60116 1.78086 -71.30596 419.25590
9690.0000 -73.49248 -72.30189 1.19059 1.74088 -71.69195 375.05139
9695.0000 -73.19215 -71.76329 1.42886 1.71692 -71.92332 343.40024
9700.0000 -73.20840 -71.51258 1.69582 1.72360 -71.85885 342.39152
9705.0000 -73.37632 -71.99707 1.37925 1.71507 -71.94114 321.86448
9710.0000 -72.91421 -71.51617 1.39804 1.75004 -71.60352 373.81355
9715.0000 -72.97094 -71.32086 1.65008 1.74758 -71.62730 374.93542
9720.0000 -72.98936 -71.19692 1.79244 1.78399 -71.27572 407.30822
9725.0000 -72.48273 -71.29491 1.18782 1.77635 -71.34953 384.49401
9730.0000 -73.10094 -71.67395 1.42699 1.77608 -71.35218 380.40171
9735.0000 -72.45094 -71.03205 1.41888 1.78421 -71.27363 401.22129
9740.0000 -72.40947 -70.53916 1.87030 1.82864 -70.84467 433.14033
9745.0000 -72.67725 -71.10762 1.56963 1.79985 -71.12259 416.10369
9750.0000 -73.02834 -72.20190 0.82644 1.74613 -71.64132 347.65944
FREEZING PROCESS: loop number 40 T-loop= 347.00000000000000
main_MD> interactions number 40 at Temperature= 347.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.67299 -0.98044 1.70436
force_rgl> df(natom) -0.98686 -2.85251 -3.71098
9755.0000 -72.60882 -71.56200 1.04682 1.73300 -71.76806 340.81670
9760.0000 -72.94044 -71.12321 1.81723 1.77414 -71.37086 386.15313
9765.0000 -72.99822 -71.50501 1.49321 1.75168 -71.58775 363.85826
9770.0000 -73.16385 -72.00853 1.15532 1.73504 -71.74835 340.80436
9775.0000 -72.55198 -71.01576 1.53622 1.75903 -71.51678 372.45718
9780.0000 -73.09371 -71.78230 1.31141 1.73744 -71.72518 347.22277
9785.0000 -73.12042 -71.85472 1.26570 1.74244 -71.67693 350.82424
9790.0000 -73.15907 -72.01933 1.13974 1.71641 -71.92826 330.01158
9795.0000 -73.28100 -72.05251 1.22849 1.71609 -71.93132 343.81970
9800.0000 -73.26600 -71.85883 1.40717 1.72301 -71.86454 345.67656
9805.0000 -73.15150 -71.57133 1.58018 1.73811 -71.71870 383.13252
9810.0000 -73.05318 -71.82471 1.22847 1.74218 -71.67948 369.21967
9815.0000 -73.29656 -72.20814 1.08842 1.70037 -72.08307 301.33026
9820.0000 -73.22442 -72.12687 1.09755 1.69271 -72.15709 297.18403
9825.0000 -73.27336 -71.80033 1.47303 1.70017 -72.08505 316.69086
9830.0000 -73.13713 -72.10819 1.02894 1.72758 -71.82035 351.35775
9835.0000 -73.13812 -71.53827 1.59985 1.71708 -71.92178 326.84891
9840.0000 -73.32533 -71.99476 1.33057 1.70783 -72.01107 331.03772
9845.0000 -72.88778 -71.40640 1.48138 1.74220 -71.67924 360.04126
9850.0000 -73.14938 -71.54870 1.60068 1.76092 -71.49848 379.34692
9855.0000 -72.96759 -71.50755 1.46004 1.73377 -71.76066 359.35697
9860.0000 -72.92886 -71.52827 1.40059 1.73325 -71.76569 348.02188
9865.0000 -72.99429 -71.43724 1.55704 1.76030 -71.50452 372.93216
9870.0000 -73.07078 -71.73168 1.33910 1.73997 -71.70076 359.93244
9875.0000 -72.85424 -71.54916 1.30509 1.74750 -71.62806 380.72751
9880.0000 -73.00802 -71.71309 1.29494 1.77286 -71.38326 403.68053
9885.0000 -72.84391 -71.29143 1.55248 1.76516 -71.45755 389.56805
9890.0000 -73.45876 -72.00944 1.44932 1.75259 -71.57893 375.23266
9895.0000 -73.23431 -71.99462 1.23969 1.72626 -71.83314 348.67652
9900.0000 -73.41436 -71.99969 1.41467 1.72579 -71.83768 351.06490
9905.0000 -73.12592 -71.99014 1.13578 1.70556 -72.03301 316.55373
9910.0000 -73.03734 -71.27561 1.76173 1.74563 -71.64610 357.26456
9915.0000 -72.95997 -71.64290 1.31707 1.75633 -71.54282 384.02757
9920.0000 -72.86285 -71.79750 1.06535 1.72390 -71.85592 333.96307
9925.0000 -72.84092 -71.46815 1.37277 1.74398 -71.66206 350.51500
9930.0000 -72.49408 -71.59106 0.90303 1.74109 -71.68993 347.81988
9935.0000 -72.53332 -71.20877 1.32455 1.77647 -71.34836 382.08826
9940.0000 -72.73719 -71.26284 1.47435 1.78964 -71.22123 404.46537
9945.0000 -73.08481 -71.53575 1.54906 1.77527 -71.35992 405.28303
9950.0000 -73.49359 -72.12896 1.36464 1.74913 -71.61237 347.83069
9955.0000 -73.24766 -72.22094 1.02673 1.69561 -72.12903 289.19615
9960.0000 -73.13514 -72.11879 1.01636 1.69633 -72.12212 299.97200
9965.0000 -72.99895 -71.56160 1.43735 1.72069 -71.88696 332.10373
9970.0000 -73.15841 -71.95029 1.20811 1.75508 -71.55493 366.24808
9975.0000 -73.23770 -71.97515 1.26255 1.72293 -71.86534 323.92079
9980.0000 -73.17317 -71.88209 1.29108 1.71562 -71.93589 313.85295
9985.0000 -72.96241 -71.63806 1.32435 1.72908 -71.80595 325.70075
9990.0000 -73.01597 -71.74340 1.27257 1.71968 -71.89666 309.65158
9995.0000 -73.25588 -71.78419 1.47169 1.72967 -71.80025 338.49684
10000.0000 -73.15882 -71.57195 1.58687 1.73478 -71.75084 354.18934
FREEZING PROCESS: loop number 41 T-loop= 322.00000000000000
main_MD> interactions number 41 at Temperature= 322.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.03023 -0.06748 0.49800
force_rgl> df(natom) -2.97537 1.92711 1.87045
10005.0000 -73.26376 -71.90765 1.35611 1.71129 -71.97768 309.17177
10010.0000 -73.33922 -71.81423 1.52499 1.72956 -71.80125 339.26721
10015.0000 -73.51545 -72.33879 1.17666 1.69823 -72.10373 323.13285
10020.0000 -73.59389 -72.14704 1.44684 1.68369 -72.24415 303.96988
10025.0000 -73.21644 -72.24754 0.96891 1.67687 -72.30999 286.51364
10030.0000 -73.51568 -72.60189 0.91379 1.67467 -72.33125 279.46179
10035.0000 -73.13489 -71.45835 1.67654 1.70062 -72.08073 316.15672
10040.0000 -73.14805 -71.98487 1.16318 1.77329 -71.37906 395.52206
10045.0000 -73.04641 -71.70659 1.33983 1.72425 -71.85258 337.48559
10050.0000 -73.17521 -71.70807 1.46714 1.74947 -71.60907 351.47636
10055.0000 -72.92183 -71.72087 1.20096 1.74106 -71.69026 356.06583
10060.0000 -73.01959 -71.98160 1.03799 1.71124 -71.97816 324.01190
10065.0000 -72.73216 -71.55124 1.18092 1.73309 -71.76721 352.77695
10070.0000 -73.26302 -72.13911 1.12391 1.72969 -71.79999 329.73158
10075.0000 -73.30566 -71.90504 1.40062 1.70967 -71.99333 319.45360
10080.0000 -73.25829 -72.33509 0.92320 1.68852 -72.19755 290.29163
10085.0000 -73.29898 -72.07027 1.22871 1.68839 -72.19878 295.41156
10090.0000 -73.19764 -71.98702 1.21062 1.70089 -72.07812 310.80491
10095.0000 -73.24198 -71.97529 1.26669 1.72815 -71.81490 334.23170
10100.0000 -73.50488 -72.09951 1.40537 1.70979 -71.99220 321.87420
10105.0000 -73.45214 -72.04925 1.40289 1.69674 -72.11814 308.59059
10110.0000 -73.16693 -71.83584 1.33109 1.72024 -71.89123 342.61657
10115.0000 -73.24261 -72.12721 1.11540 1.70228 -72.06468 313.96265
10120.0000 -73.29442 -71.79993 1.49449 1.69696 -72.11606 316.74971
10125.0000 -73.18693 -71.95387 1.23306 1.72234 -71.87096 338.17473
10130.0000 -72.77703 -71.75526 1.02178 1.71735 -71.91918 324.50584
10135.0000 -73.28838 -71.68593 1.60246 1.74440 -71.65797 359.63537
10140.0000 -73.04214 -71.48569 1.55645 1.77095 -71.40163 379.60065
10145.0000 -73.26358 -71.71128 1.55229 1.76326 -71.47592 387.87529
10150.0000 -73.28841 -72.05592 1.23249 1.71412 -71.95038 319.59319
10155.0000 -73.37378 -71.94893 1.42485 1.71573 -71.93484 324.97072
10160.0000 -73.21748 -71.88654 1.33094 1.73004 -71.79669 332.55757
10165.0000 -73.46499 -72.15497 1.31003 1.69569 -72.12828 310.57746
10170.0000 -73.06701 -71.91420 1.15281 1.72701 -71.82593 348.55125
10175.0000 -73.26808 -72.04892 1.21916 1.70626 -72.02627 312.96586
10180.0000 -73.45868 -71.94961 1.50907 1.72573 -71.83823 337.74925
10185.0000 -73.21351 -72.17004 1.04346 1.70800 -72.00942 322.56009
10190.0000 -73.20798 -71.90523 1.30275 1.70092 -72.07784 329.51665
10195.0000 -73.10435 -71.60487 1.49948 1.74135 -71.68743 370.36374
10200.0000 -73.28366 -72.17283 1.11083 1.72464 -71.84874 345.28537
10205.0000 -73.09406 -71.52307 1.57099 1.73360 -71.76231 357.03699
10210.0000 -73.21360 -72.16619 1.04741 1.73088 -71.78854 367.12956
10215.0000 -73.27519 -71.78682 1.48837 1.72590 -71.83665 350.26835
10220.0000 -73.08892 -71.50988 1.57903 1.74294 -71.67212 372.27195
10225.0000 -73.31009 -71.98928 1.32081 1.73275 -71.77049 360.22725
10230.0000 -73.01221 -71.39064 1.62157 1.74176 -71.68345 362.26609
10235.0000 -73.57121 -72.12069 1.45052 1.74091 -71.69167 361.16022
10240.0000 -73.53464 -72.23188 1.30276 1.68233 -72.25728 298.13255
10245.0000 -72.93852 -71.77101 1.16751 1.69383 -72.14623 310.32082
10250.0000 -72.98399 -71.80527 1.17871 1.73393 -71.75908 357.71764
main_MD> EXECUTION TIME: 0 [day], 0 [hour], 6 [min], 47.2162261 [s].
main_MD> Deallocating global variables
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