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nanoparticlesims/growth_Melting_Silver_ICO_2451/freezeSims/run_58/freeze.log

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main_MD> Reading input file
read_input> Process type: freezing
Read_input> Process caloric with a T-change of 25.000000000000000 [K] and a rate of 9.9999999999999992E+022 [K/ns]
read_input> Input for metadynamics has been read
read_input> Metadynamics has not been chosen.
read_input> Reading initial positions fromtoFreeze_58.xyz
read_input> Finish reading initial positions
read_input> Validating positions
read_input> Initializing random number generator
read_input> Checking program
read_rgl> START READING FILE ../pot.pot
read_rgl>> END READING FILE ../pot.pot
READ_RGL>> atomic speciesAgAg imet1 4 imet2 4
READ_RGL>> atomic radius 1.4450000999999999 1.4450000999999999
read_rgl> PARAMETERS SELECTION
FOR IMET1 :: Ag 4
ECOH :: 2.9500000000000002 A :: 0.10308871000000000 QSI :: 1.1895434899999999
p :: 10.850000000000000 q :: 3.1800000000000002
ATOMIC RADIUS :: 1.4450000999999999
choice_pot> values:
frac = 0.12062503764379931 arete = 4.0870774781009569
choice_pot> mass is== 108.00000000000000 for elem1=
read_input> ntipo1 = 58 ntipo2 = 0
read_input> Finish reading input
main_MD> Allocating global variables
main_MD> Number of outputs that will be created: 2000
main_MD> Size of nv and nvoiz: 58 5800
main_MD> Size of nv and nvoiz: 58 5800
main_MD> Number of time-steps (npas) = 50000
main_MD> Number of CVs (num_cv) = 1
main_MD> Max allowed number of atoms = 2900
main_MD> Max number of atoms = 58
main_MD> Consider changing parameter nsiz in module_parameters.f90 for performance
main_MD> collvar_wanted = F
main_MD> INPUT AND POTENTIAL FILE READING IS DONE
main_MD> THERMALIZATION IS STARTING
init> 4.5852472010595152E-003 -0.11834822111154583 -0.10324957095454751 initial drift of cluster / NP1 for coalescence
init> 0.36603880881067730 0.34213114655775745 0.33860934028276152 scaling for velocity /for coalescence NP1
init.f90 > facguy = 3.8992852873117254E-003
preparo> IN BIGVOI : LIMIT 1.2247448652052084 1.2247448652052084 1.2247448652052084
preparo> END t=0 TIME STEP
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.26028 2.42813 2.12342
force_rgl> df(natom) -0.96006 -2.95085 -0.93187
preparo> THERMALIZATION PROCESS AT 1315.8312953423062
preparo> TOTAL ENERGY, KINETIC EN., POT. ENERGY, DELTA
5000 -124.15256397138837 8.9378986641184941 -133.09046263550687 6.7278902860609376E-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 40
FREEZING PROCESS: loop number 1 T-loop= 1294.0000000000000
main_MD> interactions number 1 at Temperature= 1294.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -8.27869 -6.38349 -6.83189
force_rgl> df(natom) 0.40743 1.32975 1.00631
5.0000 -134.51384 -124.28298 10.23086 3.25019 -122.40021 1366.06212
10.0000 -133.56326 -126.49351 7.06975 3.06277 -125.20835 1223.45343
15.0000 -136.29889 -127.98902 8.30988 2.92797 -127.22822 1121.07282
20.0000 -135.09834 -127.41953 7.67881 2.93571 -127.11226 1166.89760
25.0000 -134.79674 -126.07146 8.72528 3.00205 -126.11820 1203.07102
30.0000 -133.41273 -123.88796 9.52477 3.04970 -125.40423 1254.53066
35.0000 -133.04044 -123.61756 9.42288 3.19835 -123.17696 1355.19827
40.0000 -133.73112 -122.73213 10.99898 3.12318 -124.30325 1343.66640
45.0000 -133.18603 -122.28924 10.89679 3.28295 -121.90934 1383.75195
50.0000 -133.02425 -121.67684 11.34741 3.27059 -122.09447 1373.27967
55.0000 -132.06209 -122.61276 9.44933 3.29442 -121.73740 1409.95711
60.0000 -133.15553 -124.00193 9.15360 3.21391 -122.94385 1304.62762
65.0000 -132.18542 -121.54449 10.64093 3.22239 -122.81677 1347.46485
70.0000 -132.79010 -122.85895 9.93115 3.27474 -122.03234 1383.02524
75.0000 -133.52866 -123.32509 10.20358 3.13272 -124.16028 1308.32420
80.0000 -133.14447 -122.35258 10.79189 3.22337 -122.80198 1337.05045
85.0000 -134.98330 -123.42512 11.55818 3.20171 -123.12656 1329.84265
90.0000 -135.62181 -124.82357 10.79825 3.10502 -124.57531 1343.95650
95.0000 -132.85509 -122.98378 9.87131 3.18567 -123.36697 1363.45470
100.0000 -132.12439 -120.93880 11.18559 3.29684 -121.70112 1418.78685
105.0000 -135.74449 -125.43258 10.31191 3.22295 -122.80840 1350.24855
110.0000 -135.08611 -126.11348 8.97263 2.99694 -126.19474 1180.64032
115.0000 -134.68222 -123.79859 10.88362 3.10754 -124.53761 1298.96836
120.0000 -136.24989 -125.16112 11.08877 3.12018 -124.34826 1269.54876
125.0000 -135.69335 -124.81406 10.87929 3.08589 -124.86197 1272.28476
130.0000 -132.07724 -120.58374 11.49350 3.23799 -122.58291 1385.69754
135.0000 -130.89765 -120.07189 10.82575 3.38028 -120.45092 1479.14851
140.0000 -136.17131 -124.88941 11.28190 3.14391 -123.99270 1301.87324
145.0000 -135.22401 -127.91325 7.31076 3.03036 -125.69404 1222.88690
150.0000 -133.44829 -125.94967 7.49862 2.95503 -126.82278 1147.21305
155.0000 -134.36992 -124.13755 10.23238 3.05994 -125.25085 1229.23804
160.0000 -134.66655 -125.62355 9.04300 3.00491 -126.07536 1206.12567
165.0000 -132.53988 -122.98602 9.55386 3.08945 -124.80866 1282.33582
170.0000 -134.91874 -124.03979 10.87895 3.20614 -123.06026 1376.50388
175.0000 -134.99109 -126.94271 8.04837 3.08008 -124.94900 1216.34479
180.0000 -132.58822 -122.71284 9.87538 3.10011 -124.64890 1230.20298
185.0000 -133.63023 -123.70543 9.92480 3.19938 -123.16151 1350.59699
190.0000 -133.70119 -122.78785 10.91334 3.22133 -122.83262 1351.18224
195.0000 -133.20852 -122.95279 10.25573 3.20719 -123.04442 1340.28891
200.0000 -133.14677 -124.15787 8.98891 3.21005 -123.00157 1335.84205
205.0000 -131.03965 -121.23815 9.80150 3.18858 -123.32338 1302.10960
210.0000 -132.94915 -122.66162 10.28753 3.17760 -123.48789 1319.53151
215.0000 -131.29627 -121.97570 9.32057 3.28209 -121.92226 1405.79127
220.0000 -132.43411 -121.25176 11.18235 3.33415 -121.14209 1436.04290
225.0000 -133.07483 -122.33064 10.74418 3.31355 -121.45075 1426.94775
230.0000 -134.73709 -123.92712 10.80997 3.16825 -123.62793 1334.16657
235.0000 -132.44467 -122.22627 10.21840 3.17364 -123.54715 1322.99826
240.0000 -135.03452 -124.40400 10.63052 3.22227 -122.81859 1354.48635
245.0000 -133.16954 -123.01755 10.15199 3.11682 -124.39862 1315.64382
250.0000 -134.00239 -124.28367 9.71871 3.12995 -124.20178 1289.04705
FREEZING PROCESS: loop number 2 T-loop= 1269.0000000000000
main_MD> interactions number 2 at Temperature= 1269.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -2.54982 -0.76385 -0.18485
force_rgl> df(natom) -0.03127 2.53186 -1.35531
255.0000 -134.08321 -123.97602 10.10719 3.19707 -123.19618 1333.22794
260.0000 -133.18651 -123.60851 9.57800 3.08940 -124.80936 1264.93392
265.0000 -134.64022 -126.33809 8.30213 3.09436 -124.73504 1281.34530
270.0000 -132.65002 -122.82416 9.82586 3.12367 -124.29590 1325.40036
275.0000 -134.12602 -123.89128 10.23474 3.23268 -122.66254 1369.38312
280.0000 -135.76647 -125.13130 10.63516 3.13264 -124.16155 1271.87316
285.0000 -135.14312 -125.87969 9.26343 3.05738 -125.28912 1259.21674
290.0000 -133.71272 -123.50523 10.20749 3.12812 -124.22919 1300.42178
295.0000 -136.09582 -123.98422 12.11160 3.13007 -124.20007 1295.03421
300.0000 -133.82200 -125.46380 8.35819 3.20765 -123.03763 1336.04440
305.0000 -136.02767 -127.79976 8.22792 3.01795 -125.87999 1223.70504
310.0000 -133.97019 -123.63087 10.33932 3.12830 -124.22650 1306.51714
315.0000 -134.11121 -124.79910 9.31212 3.13690 -124.09773 1278.57906
320.0000 -135.34612 -126.99527 8.35085 3.07079 -125.08822 1210.94682
325.0000 -134.46438 -125.26278 9.20160 2.92438 -127.28202 1139.90183
330.0000 -134.51370 -124.94620 9.56750 3.12589 -124.26271 1278.01775
335.0000 -134.18216 -124.62489 9.55727 3.05271 -125.35915 1212.51520
340.0000 -135.26887 -126.17004 9.09883 3.15073 -123.89050 1318.15901
345.0000 -133.59360 -121.76875 11.82485 3.08023 -124.94679 1203.14740
350.0000 -133.38384 -121.89795 11.48589 3.30634 -121.55887 1449.83087
355.0000 -132.48662 -124.36915 8.11746 3.24273 -122.51195 1342.41654
360.0000 -133.08784 -124.83982 8.24802 3.12052 -124.34318 1282.98997
365.0000 -132.50994 -124.32204 8.18790 3.16378 -123.69494 1300.08097
370.0000 -134.79852 -127.20253 7.59599 3.04799 -125.42986 1233.11687
375.0000 -132.37283 -122.58563 9.78720 3.17985 -123.45405 1302.15379
380.0000 -132.04892 -120.66428 11.38464 3.36052 -120.74703 1457.69367
385.0000 -133.74935 -125.11882 8.63052 3.19532 -123.22238 1409.34685
390.0000 -134.19067 -125.73503 8.45564 3.08911 -124.81371 1287.68067
395.0000 -133.99595 -123.71340 10.28256 3.02725 -125.74060 1185.55023
400.0000 -133.50025 -124.24763 9.25261 3.16332 -123.70185 1325.27624
405.0000 -135.47453 -126.14683 9.32770 3.07951 -124.95757 1275.25081
410.0000 -132.30784 -121.41694 10.89090 3.10978 -124.50407 1298.00633
415.0000 -134.32619 -124.62256 9.70363 3.23428 -122.63861 1357.69329
420.0000 -132.25153 -121.86544 10.38608 3.21351 -122.94974 1367.89587
425.0000 -131.59148 -121.81639 9.77508 3.26212 -122.22147 1378.86877
430.0000 -134.01240 -123.63900 10.37340 3.15613 -123.80960 1351.65421
435.0000 -132.28741 -121.79251 10.49490 3.29241 -121.76762 1376.28884
440.0000 -133.15775 -123.23573 9.92202 3.16662 -123.65237 1369.00048
445.0000 -133.16471 -123.91793 9.24677 3.15289 -123.85814 1297.19273
450.0000 -134.48892 -126.13355 8.35537 3.01785 -125.88144 1186.81973
455.0000 -134.68545 -124.40455 10.28090 3.09103 -124.78492 1252.76648
460.0000 -135.25978 -125.95526 9.30452 3.06754 -125.13692 1258.89711
465.0000 -134.31679 -124.63197 9.68481 2.98607 -126.35760 1167.49376
470.0000 -133.39823 -122.90920 10.48903 3.10153 -124.62763 1248.13195
475.0000 -134.31289 -125.89786 8.41503 3.12891 -124.21743 1295.02931
480.0000 -134.03638 -124.74282 9.29356 3.00231 -126.11439 1178.69621
485.0000 -133.09125 -122.81233 10.27891 3.19081 -123.28985 1299.25334
490.0000 -133.31222 -123.61966 9.69256 3.23561 -122.61859 1363.52407
495.0000 -135.68567 -126.65045 9.03522 3.10580 -124.56362 1275.73352
500.0000 -133.81190 -126.42129 7.39061 2.96543 -126.66700 1124.88084
FREEZING PROCESS: loop number 3 T-loop= 1244.0000000000000
main_MD> interactions number 3 at Temperature= 1244.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 7.34165 -2.80735 -1.50395
force_rgl> df(natom) -1.61049 -4.62744 -1.15785
505.0000 -134.12570 -124.17575 9.94995 3.09259 -124.76164 1296.09864
510.0000 -134.86771 -124.78070 10.08701 3.04687 -125.44668 1197.35888
515.0000 -134.01596 -125.63646 8.37950 3.03205 -125.66874 1162.04661
520.0000 -136.40550 -127.52112 8.88438 3.02443 -125.78288 1203.67522
525.0000 -133.77782 -124.56831 9.20951 3.03602 -125.60923 1226.62150
530.0000 -134.32185 -126.52498 7.79687 2.95194 -126.86910 1120.06431
535.0000 -133.04938 -123.03513 10.01425 3.11129 -124.48136 1266.01693
540.0000 -132.25340 -123.17424 9.07916 3.24287 -122.50991 1410.73122
545.0000 -129.74655 -120.71189 9.03466 3.28212 -121.92169 1396.67774
550.0000 -133.22776 -124.35628 8.87147 3.22255 -122.81431 1301.53975
555.0000 -133.54172 -123.95104 9.59068 3.10704 -124.54515 1197.53375
560.0000 -133.24600 -123.37764 9.86836 3.16298 -123.70691 1309.74330
565.0000 -135.13769 -124.55087 10.58683 3.13076 -124.18975 1329.30412
570.0000 -132.24300 -122.19884 10.04415 3.24459 -122.48403 1390.22754
575.0000 -133.72032 -124.66683 9.05349 3.19522 -123.22388 1325.38502
580.0000 -135.13625 -123.63796 11.49830 3.12113 -124.33402 1296.69130
585.0000 -134.39962 -124.51939 9.88023 3.10018 -124.64791 1273.74692
590.0000 -134.84523 -124.10158 10.74365 3.14786 -123.93340 1341.46965
595.0000 -134.22527 -124.10280 10.12247 3.10540 -124.56960 1255.66646
600.0000 -133.00909 -123.38427 9.62481 3.14131 -124.03161 1286.92078
605.0000 -133.09820 -122.53637 10.56183 3.21516 -122.92511 1356.33870
610.0000 -135.18258 -125.19130 9.99127 3.14079 -124.03936 1296.13578
615.0000 -132.22058 -121.03782 11.18277 3.24213 -122.52101 1385.82661
620.0000 -135.41324 -127.19496 8.21828 3.14126 -124.03232 1298.94149
625.0000 -135.84413 -126.53101 9.31312 2.97832 -126.47381 1179.87240
630.0000 -136.61479 -126.21347 10.40132 3.04936 -125.40939 1214.37095
635.0000 -135.35743 -125.56363 9.79380 2.98201 -126.41851 1214.64004
640.0000 -134.77198 -125.19639 9.57559 3.05132 -125.37997 1250.08081
645.0000 -134.46483 -125.59355 8.87128 3.09834 -124.67550 1251.37535
650.0000 -136.16130 -126.08254 10.07876 2.99737 -126.18830 1196.95925
655.0000 -135.96783 -127.16823 8.79960 2.95801 -126.77814 1197.58674
660.0000 -135.73368 -126.44235 9.29132 3.01726 -125.89037 1215.58049
665.0000 -136.26394 -126.60656 9.65738 2.89929 -127.65801 1128.02517
670.0000 -134.64656 -126.23203 8.41453 3.01444 -125.93251 1238.32707
675.0000 -135.08784 -126.04788 9.03996 3.05363 -125.34539 1234.98751
680.0000 -135.52100 -126.73317 8.78783 2.97990 -126.45004 1178.27411
685.0000 -135.01280 -124.15366 10.85913 3.05237 -125.36418 1237.14289
690.0000 -133.71806 -123.97250 9.74556 3.12615 -124.25879 1276.38607
695.0000 -135.97918 -124.09214 11.88704 3.10075 -124.63929 1254.64679
700.0000 -135.58258 -127.42553 8.15705 3.04856 -125.42135 1196.37337
705.0000 -134.43550 -125.31933 9.11618 2.99523 -126.22036 1162.51083
710.0000 -133.08836 -123.22786 9.86050 3.09375 -124.74415 1288.19116
715.0000 -132.41189 -123.64034 8.77156 3.21127 -122.98327 1336.07276
720.0000 -137.24410 -128.67629 8.56780 3.05461 -125.33067 1239.46530
725.0000 -136.81954 -127.38280 9.43674 2.92580 -127.26066 1170.01307
730.0000 -135.66926 -126.32711 9.34215 2.96780 -126.63143 1211.24793
735.0000 -136.62429 -125.67886 10.94543 2.98535 -126.36847 1205.09925
740.0000 -134.38307 -126.45994 7.92314 3.03851 -125.57194 1236.81259
745.0000 -135.10532 -125.80220 9.30312 3.06492 -125.17623 1176.98932
750.0000 -133.00723 -123.77436 9.23286 3.02287 -125.80627 1194.21421
FREEZING PROCESS: loop number 4 T-loop= 1219.0000000000000
main_MD> interactions number 4 at Temperature= 1219.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 3.98808 -1.76739 -0.59260
force_rgl> df(natom) -3.40830 -1.22039 -2.81414
755.0000 -134.61151 -124.07532 10.53618 3.22533 -122.77273 1352.24945
760.0000 -135.53702 -125.58750 9.94953 3.08403 -124.88992 1281.36590
765.0000 -136.65561 -127.78387 8.87174 2.97883 -126.46621 1196.55336
770.0000 -134.49382 -125.92505 8.56877 3.03138 -125.67882 1203.54715
775.0000 -136.45400 -128.09318 8.36082 2.97115 -126.58124 1161.50377
780.0000 -133.16816 -123.13404 10.03412 3.09220 -124.76748 1280.76707
785.0000 -134.28079 -124.24035 10.04044 3.20051 -123.14458 1333.20985
790.0000 -137.38949 -128.32786 9.06163 3.05423 -125.33632 1221.48638
795.0000 -136.73746 -127.99559 8.74187 2.89154 -127.77404 1162.57054
800.0000 -137.80391 -128.97853 8.82539 2.87948 -127.95485 1096.99104
805.0000 -136.17738 -128.68084 7.49654 2.82220 -128.81304 1081.50347
810.0000 -134.23632 -127.71901 6.51731 2.81150 -128.97335 1067.98458
815.0000 -135.83953 -126.47110 9.36842 2.95164 -126.87357 1181.47737
820.0000 -134.82092 -125.89571 8.92521 3.00723 -126.04055 1208.43087
825.0000 -135.05516 -125.61459 9.44056 3.00391 -126.09034 1192.98726
830.0000 -133.91306 -124.46397 9.44909 3.08158 -124.92658 1281.36455
835.0000 -133.77110 -125.43187 8.33923 3.07849 -124.97290 1278.32277
840.0000 -134.71954 -123.72528 10.99426 3.09286 -124.75753 1273.74889
845.0000 -132.99348 -122.03413 10.95935 3.31706 -121.39818 1421.07363
850.0000 -132.98787 -123.57225 9.41562 3.27515 -122.02612 1385.29340
855.0000 -135.52886 -126.16755 9.36131 3.07081 -125.08796 1252.09228
860.0000 -135.83973 -126.87739 8.96234 2.96267 -126.70822 1179.08722
865.0000 -136.71109 -126.26964 10.44145 2.99825 -126.17510 1205.96764
870.0000 -135.77307 -127.58566 8.18741 2.95156 -126.87479 1180.43488
875.0000 -136.43474 -128.19842 8.23632 2.92871 -127.21709 1132.60089
880.0000 -134.35753 -125.78815 8.56938 2.96290 -126.70479 1181.02608
885.0000 -136.16789 -126.09847 10.06942 3.03416 -125.63705 1234.63373
890.0000 -134.22251 -125.17726 9.04525 3.05792 -125.28114 1228.82674
895.0000 -134.52240 -125.31586 9.20653 3.04761 -125.43560 1237.13069
900.0000 -134.49294 -125.02799 9.46495 3.04618 -125.45695 1238.85738
905.0000 -133.41430 -124.98674 8.42756 3.05983 -125.25249 1207.57717
910.0000 -133.72889 -123.97759 9.75130 3.12606 -124.26017 1260.11004
915.0000 -135.99348 -127.16211 8.83137 2.98361 -126.39448 1193.53415
920.0000 -136.03951 -126.74264 9.29687 2.92623 -127.25424 1155.28041
925.0000 -134.72016 -125.58584 9.13432 3.12211 -124.31923 1287.34174
930.0000 -135.91805 -126.94284 8.97522 3.02651 -125.75174 1244.35191
935.0000 -136.04733 -128.79972 7.24761 2.97852 -126.47083 1181.97197
940.0000 -134.40625 -126.19536 8.21089 2.91743 -127.38613 1146.86189
945.0000 -134.84958 -126.77682 8.07276 2.97075 -126.58721 1183.99443
950.0000 -134.86333 -126.83707 8.02626 2.98210 -126.41719 1183.57994
955.0000 -136.13416 -127.19978 8.93438 2.99880 -126.16696 1178.43326
960.0000 -134.35279 -125.11993 9.23286 3.02240 -125.81329 1193.34077
965.0000 -134.54403 -126.20079 8.34325 3.03256 -125.66108 1230.57379
970.0000 -133.97554 -124.04441 9.93112 3.05877 -125.26834 1228.61176
975.0000 -136.30327 -125.19710 11.10617 3.16769 -123.63634 1342.55856
980.0000 -134.03765 -125.25866 8.77899 3.04388 -125.49147 1288.69693
985.0000 -133.95914 -125.15954 8.79959 3.03608 -125.60839 1208.88877
990.0000 -133.96932 -124.98769 8.98164 3.07128 -125.08093 1251.47796
995.0000 -135.41966 -126.63419 8.78547 3.08428 -124.88614 1242.19775
1000.0000 -134.43152 -124.42199 10.00954 3.07888 -124.96701 1245.19664
FREEZING PROCESS: loop number 5 T-loop= 1194.0000000000000
main_MD> interactions number 5 at Temperature= 1194.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.52046 -0.91345 1.46851
force_rgl> df(natom) 0.96970 1.14243 1.63360
1005.0000 -135.37442 -125.86706 9.50735 3.11344 -124.44921 1256.54274
1010.0000 -136.19839 -126.61311 9.58527 3.00845 -126.02234 1190.53035
1015.0000 -133.70776 -125.08938 8.61838 3.06374 -125.19384 1208.77198
1020.0000 -133.18101 -124.34003 8.84098 3.08427 -124.88620 1279.89808
1025.0000 -134.17641 -124.82085 9.35557 3.11685 -124.39805 1242.24178
1030.0000 -134.45660 -125.91513 8.54147 3.08348 -124.89816 1277.65859
1035.0000 -135.80909 -126.10552 9.70358 3.00346 -126.09707 1196.05551
1040.0000 -135.34349 -125.76777 9.57572 2.98411 -126.38701 1174.38572
1045.0000 -134.07584 -126.03470 8.04114 3.03358 -125.64577 1212.66613
1050.0000 -135.65083 -127.52708 8.12375 2.97807 -126.47759 1188.58173
1055.0000 -135.25164 -127.79175 7.45989 2.86095 -128.23246 1072.60275
1060.0000 -134.78907 -126.68987 8.09920 2.92970 -127.20224 1130.05474
1065.0000 -135.11754 -128.20915 6.90839 2.92700 -127.24271 1112.98966
1070.0000 -136.56438 -127.79131 8.77307 2.87757 -127.98345 1103.67299
1075.0000 -135.88714 -126.49687 9.39027 2.93870 -127.06741 1144.38660
1080.0000 -135.18915 -125.43832 9.75083 2.98858 -126.32013 1148.17169
1085.0000 -137.52036 -128.52841 8.99194 2.97006 -126.59758 1138.24978
1090.0000 -136.69874 -128.41187 8.28687 2.82947 -128.70409 1100.98836
1095.0000 -137.02414 -127.64737 9.37677 2.88434 -127.88203 1122.49834
1100.0000 -134.41272 -127.26224 7.15048 2.85243 -128.36013 1078.81721
1105.0000 -135.34123 -127.13443 8.20680 2.88131 -127.92730 1113.67389
1110.0000 -133.40640 -125.10313 8.30326 2.99138 -126.27804 1208.30032
1115.0000 -135.04355 -127.57428 7.46927 3.01937 -125.85877 1239.36081
1120.0000 -135.53420 -125.29441 10.23979 2.97026 -126.59451 1168.60949
1125.0000 -135.06559 -126.14625 8.91934 3.04084 -125.53703 1247.94351
1130.0000 -135.07173 -127.28643 7.78530 2.91504 -127.42191 1108.01112
1135.0000 -135.83033 -127.46482 8.36551 2.92497 -127.27312 1082.97835
1140.0000 -135.38673 -125.84462 9.54211 3.02039 -125.84343 1206.67879
1145.0000 -135.42384 -126.74116 8.68269 3.02071 -125.83864 1223.61760
1150.0000 -135.05798 -127.17685 7.88113 2.95275 -126.85697 1166.73721
1155.0000 -134.53680 -127.02067 7.51613 2.98413 -126.38673 1175.17124
1160.0000 -133.38493 -125.04202 8.34291 2.96803 -126.62792 1153.21915
1165.0000 -135.65375 -125.23650 10.41725 3.07491 -125.02650 1259.03105
1170.0000 -135.27305 -125.47063 9.80243 3.00920 -126.01111 1212.63260
1175.0000 -134.53938 -124.14794 10.39144 3.08932 -124.81056 1268.42411
1180.0000 -135.82399 -127.24487 8.57912 3.04906 -125.41379 1245.53760
1185.0000 -137.36289 -129.42246 7.94043 2.79524 -129.21695 1085.16006
1190.0000 -136.15657 -129.78546 6.37111 2.77026 -129.59124 1009.51509
1195.0000 -135.91485 -126.60187 9.31298 2.86263 -128.20721 1051.11613
1200.0000 -134.99951 -124.79790 10.20161 3.06446 -125.18307 1233.53386
1205.0000 -133.03276 -123.68553 9.34723 3.02041 -125.84319 1227.87215
1210.0000 -135.92604 -126.19802 9.72802 3.00282 -126.10663 1219.60986
1215.0000 -136.09873 -127.08748 9.01125 2.94512 -126.97123 1165.31530
1220.0000 -136.30191 -127.89763 8.40428 2.90954 -127.50430 1109.89266
1225.0000 -136.73033 -126.59024 10.14009 2.93198 -127.16812 1089.07960
1230.0000 -137.04355 -128.37731 8.66624 2.91877 -127.36606 1154.11971
1235.0000 -135.99740 -128.26143 7.73597 2.83667 -128.59629 1104.44278
1240.0000 -134.60058 -126.03824 8.56234 2.97449 -126.53117 1206.15037
1245.0000 -135.96087 -127.75517 8.20569 2.91364 -127.44291 1147.32488
1250.0000 -137.13248 -129.68723 7.44526 2.78921 -129.30735 1024.51682
FREEZING PROCESS: loop number 6 T-loop= 1169.0000000000000
main_MD> interactions number 6 at Temperature= 1169.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.49201 0.07983 -2.65679
force_rgl> df(natom) -0.56818 1.22192 1.64385
1255.0000 -136.78014 -128.05205 8.72809 2.80364 -129.09106 1053.79152
1260.0000 -136.20806 -128.43223 7.77583 2.84599 -128.45665 1095.48536
1265.0000 -136.60608 -126.91280 9.69328 2.90230 -127.61289 1111.81033
1270.0000 -134.83082 -127.28031 7.55051 2.93333 -127.14784 1126.88814
1275.0000 -138.13214 -129.39374 8.73841 2.87933 -127.95709 1109.43296
1280.0000 -136.34169 -128.08193 8.25976 2.87734 -127.98684 1085.78490
1285.0000 -137.50876 -129.93905 7.56971 2.87286 -128.05390 1101.78723
1290.0000 -138.61161 -130.25106 8.36055 2.80766 -129.03090 1038.45633
1295.0000 -135.54008 -126.35281 9.18727 2.85314 -128.34940 1120.27347
1300.0000 -136.35007 -128.49496 7.85511 2.90895 -127.51321 1117.71696
1305.0000 -135.35037 -127.38317 7.96720 2.88644 -127.85042 1109.15526
1310.0000 -134.43539 -126.54859 7.88680 2.96461 -126.67925 1166.66746
1315.0000 -135.19974 -127.31354 7.88620 2.95954 -126.75523 1164.40080
1320.0000 -137.07656 -127.44272 9.63384 2.89616 -127.70492 1123.71736
1325.0000 -133.96313 -123.96961 9.99352 3.01812 -125.87738 1178.95667
1330.0000 -136.21137 -126.45051 9.76086 3.03574 -125.61348 1248.76375
1335.0000 -135.65733 -125.83215 9.82519 2.94510 -126.97160 1150.98698
1340.0000 -135.01744 -126.23261 8.78483 2.96946 -126.60658 1163.54498
1345.0000 -135.69135 -127.25278 8.43856 2.95595 -126.80891 1126.15166
1350.0000 -134.87815 -126.72217 8.15598 2.89714 -127.69021 1119.83969
1355.0000 -137.14949 -128.07036 9.07913 2.89486 -127.72433 1124.83787
1360.0000 -135.96114 -126.35943 9.60171 2.97611 -126.50689 1165.83604
1365.0000 -132.83840 -124.50803 8.33037 3.00722 -126.04082 1186.40467
1370.0000 -137.27127 -127.05996 10.21132 2.99701 -126.19370 1173.99197
1375.0000 -136.00354 -127.90201 8.10153 2.89445 -127.73050 1137.11859
1380.0000 -136.06116 -127.24732 8.81384 2.90642 -127.55115 1152.21305
1385.0000 -135.54135 -127.30563 8.23572 2.92997 -127.19827 1156.54725
1390.0000 -134.05810 -125.61762 8.44047 3.00195 -126.11972 1228.46455
1395.0000 -135.77007 -126.43956 9.33050 3.04837 -125.42415 1224.86961
1400.0000 -137.21202 -126.38409 10.82793 3.01458 -125.93042 1230.49026
1405.0000 -136.74883 -126.27006 10.47877 2.92482 -127.27541 1181.60433
1410.0000 -136.79284 -127.67936 9.11349 2.99933 -126.15897 1212.44876
1415.0000 -134.27229 -125.07440 9.19788 2.94341 -126.99684 1158.20352
1420.0000 -136.04894 -126.67438 9.37456 3.06338 -125.19923 1258.63427
1425.0000 -136.77414 -128.35974 8.41440 2.90438 -127.58165 1141.65967
1430.0000 -137.89145 -128.47856 9.41289 2.87369 -128.04152 1117.72533
1435.0000 -135.10381 -126.37044 8.73337 3.01251 -125.96151 1185.32272
1440.0000 -134.12801 -125.83271 8.29530 2.98055 -126.44036 1182.83223
1445.0000 -134.78706 -127.06597 7.72109 3.00903 -126.01363 1171.68942
1450.0000 -136.80154 -129.52674 7.27480 2.86960 -128.10287 1109.01618
1455.0000 -138.36245 -129.81689 8.54555 2.75033 -129.88995 1026.71401
1460.0000 -135.13025 -128.14246 6.98779 2.80168 -129.12050 1077.46727
1465.0000 -135.29557 -128.17097 7.12461 2.89351 -127.74458 1138.17225
1470.0000 -134.96934 -127.71996 7.24938 2.89630 -127.70270 1123.94771
1475.0000 -134.08788 -125.00834 9.07954 3.03251 -125.66185 1218.88019
1480.0000 -136.98057 -127.20307 9.77750 2.99534 -126.21870 1171.31864
1485.0000 -134.67969 -125.77238 8.90731 2.94429 -126.98373 1149.41015
1490.0000 -137.00926 -129.23309 7.77617 2.94686 -126.94522 1150.56846
1495.0000 -135.64815 -127.04439 8.60376 2.85207 -128.36552 1090.30923
1500.0000 -136.40338 -127.70001 8.70337 2.93231 -127.16315 1192.65174
FREEZING PROCESS: loop number 7 T-loop= 1144.0000000000000
main_MD> interactions number 7 at Temperature= 1144.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.44116 0.09233 0.14153
force_rgl> df(natom) -1.30963 -1.29758 -0.93261
1505.0000 -136.59939 -126.87876 9.72062 2.84976 -128.40007 1121.75927
1510.0000 -135.70722 -126.70768 8.99954 2.94601 -126.95784 1159.67686
1515.0000 -134.51857 -126.65396 7.86461 2.98078 -126.43694 1158.87831
1520.0000 -136.97805 -128.71168 8.26637 2.91752 -127.38473 1151.40143
1525.0000 -135.18621 -127.78607 7.40015 2.87255 -128.05861 1084.75389
1530.0000 -135.48326 -125.24216 10.24110 3.03672 -125.59867 1252.49860
1535.0000 -135.97948 -126.08194 9.89754 3.13771 -124.08548 1244.72501
1540.0000 -135.12433 -127.50455 7.61978 2.94874 -126.91700 1183.14517
1545.0000 -135.94008 -127.67372 8.26636 2.88956 -127.80368 1085.63950
1550.0000 -136.58165 -128.21803 8.36363 2.86100 -128.23160 1097.75369
1555.0000 -135.67675 -126.79200 8.88475 2.90961 -127.50326 1151.32589
1560.0000 -134.34939 -125.73566 8.61373 3.00312 -126.10220 1206.87396
1565.0000 -136.64890 -128.63478 8.01413 2.91451 -127.42993 1180.59717
1570.0000 -135.65970 -127.43641 8.22329 2.90513 -127.57042 1154.90757
1575.0000 -133.76508 -124.16137 9.60371 3.05713 -125.29292 1213.75041
1580.0000 -135.71186 -126.14121 9.57065 3.02083 -125.83684 1245.18666
1585.0000 -136.60667 -126.89809 9.70859 2.94326 -126.99918 1189.23172
1590.0000 -134.88069 -124.41202 10.46867 3.04891 -125.41608 1248.25772
1595.0000 -133.88423 -125.63824 8.24599 3.07415 -125.03790 1244.17380
1600.0000 -137.33625 -129.16598 8.17027 2.93950 -127.05544 1112.99588
1605.0000 -135.63179 -127.13162 8.50017 2.88290 -127.90351 1085.57540
1610.0000 -134.72965 -125.45338 9.27628 3.02338 -125.79863 1206.57661
1615.0000 -135.63151 -126.85471 8.77680 2.97758 -126.48484 1178.57716
1620.0000 -132.92755 -125.10601 7.82154 3.03773 -125.58362 1234.24027
1625.0000 -134.95931 -125.57763 9.38168 3.04744 -125.43815 1214.19423
1630.0000 -137.47865 -128.35146 9.12719 2.88287 -127.90395 1143.19681
1635.0000 -138.27980 -128.34680 9.93300 2.87506 -128.02100 1118.38285
1640.0000 -137.21840 -129.86760 7.35080 2.86019 -128.24379 1098.74726
1645.0000 -136.00611 -128.20156 7.80454 2.79107 -129.27956 1042.88755
1650.0000 -136.26751 -127.66092 8.60659 2.94171 -127.02235 1151.97068
1655.0000 -134.50485 -127.31662 7.18822 2.93965 -127.05326 1119.87908
1660.0000 -135.70455 -127.33106 8.37349 2.91153 -127.47462 1149.09092
1665.0000 -133.72895 -125.84039 7.88856 2.93324 -127.14925 1141.23051
1670.0000 -136.31883 -127.96645 8.35238 2.85259 -128.35769 1071.40373
1675.0000 -137.62366 -130.64932 6.97434 2.77249 -129.55781 1020.34961
1680.0000 -136.33689 -128.25453 8.08235 2.81749 -128.88365 1066.40760
1685.0000 -135.55490 -125.29935 10.25555 3.03559 -125.61564 1217.39001
1690.0000 -135.46194 -126.32561 9.13633 3.06024 -125.24636 1241.58770
1695.0000 -135.41183 -125.65365 9.75818 3.02686 -125.74647 1224.13122
1700.0000 -136.98629 -130.04692 6.93937 2.83876 -128.56498 1085.02626
1705.0000 -133.31696 -125.37985 7.93711 2.98728 -126.33953 1219.24785
1710.0000 -134.79127 -124.07699 10.71428 3.02353 -125.79642 1209.05891
1715.0000 -134.69132 -127.10925 7.58207 3.07168 -125.07485 1259.71517
1720.0000 -132.58500 -124.52648 8.05852 2.98095 -126.43444 1127.85064
1725.0000 -133.37682 -124.70614 8.67068 3.09726 -124.69158 1254.36500
1730.0000 -133.98205 -122.89144 11.09061 3.14540 -123.97035 1264.45125
1735.0000 -134.66567 -125.30364 9.36203 3.12480 -124.27897 1252.51723
1740.0000 -134.10690 -125.44000 8.66690 2.99381 -126.24173 1207.37227
1745.0000 -135.03733 -126.55210 8.48523 2.96288 -126.70514 1174.72602
1750.0000 -134.37031 -125.92127 8.44904 2.99600 -126.20882 1209.74526
FREEZING PROCESS: loop number 8 T-loop= 1119.0000000000000
main_MD> interactions number 8 at Temperature= 1119.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.24236 -4.29923 -3.59017
force_rgl> df(natom) -1.11916 -0.23145 -2.52556
1755.0000 -136.61727 -129.11241 7.50487 2.97681 -126.49642 1195.20414
1760.0000 -136.06560 -126.54933 9.51627 2.85487 -128.32353 1080.29206
1765.0000 -137.24616 -129.62347 7.62269 2.83562 -128.61196 1098.97707
1770.0000 -135.66445 -127.35260 8.31184 2.85052 -128.38874 1103.14343
1775.0000 -135.31930 -126.79442 8.52488 2.84465 -128.47659 1045.73948
1780.0000 -136.88055 -127.65210 9.22846 2.97223 -126.56498 1163.43024
1785.0000 -136.87356 -129.98234 6.89122 2.83281 -128.65408 1074.02546
1790.0000 -137.75682 -128.65206 9.10477 2.80397 -129.08623 1068.08760
1795.0000 -135.51020 -127.99931 7.51089 2.93540 -127.11690 1157.97962
1800.0000 -135.48532 -126.94867 8.53665 2.93399 -127.13805 1188.36719
1805.0000 -135.98166 -127.08348 8.89818 2.90777 -127.53088 1113.01415
1810.0000 -137.10466 -127.84214 9.26251 2.95042 -126.89177 1139.86053
1815.0000 -139.35124 -130.58645 8.76479 2.76651 -129.64742 1045.09476
1820.0000 -137.93778 -128.63702 9.30076 2.77890 -129.46185 1050.81123
1825.0000 -136.23115 -127.06659 9.16456 2.86921 -128.10860 1100.99084
1830.0000 -136.23572 -128.61957 7.61615 2.84559 -128.46264 1032.93779
1835.0000 -136.58388 -128.72508 7.85880 2.84922 -128.40819 1099.04799
1840.0000 -134.27852 -128.12402 6.15450 2.84394 -128.48726 1068.97795
1845.0000 -136.09860 -128.27321 7.82538 2.88134 -127.92690 1074.59220
1850.0000 -135.04606 -125.52244 9.52361 2.93389 -127.13959 1174.62009
1855.0000 -135.42881 -124.51931 10.90950 3.07925 -124.96148 1246.40449
1860.0000 -134.94102 -127.23131 7.70971 2.98635 -126.35351 1184.65331
1865.0000 -135.24437 -127.75692 7.48744 2.83255 -128.65795 1085.93154
1870.0000 -137.05362 -129.78460 7.26902 2.76956 -129.60186 1044.50110
1875.0000 -138.29622 -129.57382 8.72240 2.79344 -129.24404 1041.23035
1880.0000 -135.70369 -127.00993 8.69376 2.83445 -128.62951 1057.42483
1885.0000 -135.56678 -125.90871 9.65807 2.98007 -126.44761 1175.82156
1890.0000 -136.84174 -128.01661 8.82513 2.93705 -127.09215 1142.16676
1895.0000 -136.09099 -125.65470 10.43629 2.94489 -126.97473 1173.36495
1900.0000 -134.71397 -126.92397 7.78999 2.97510 -126.52208 1147.17198
1905.0000 -135.19200 -125.53493 9.65707 2.95746 -126.78630 1181.41860
1910.0000 -135.90003 -127.41508 8.48494 2.94747 -126.93600 1181.32090
1915.0000 -135.30631 -126.26730 9.03901 2.95981 -126.75115 1170.72865
1920.0000 -133.59787 -125.76418 7.83369 2.98318 -126.40100 1157.06167
1925.0000 -133.30038 -124.72748 8.57290 3.07467 -125.03017 1241.83882
1930.0000 -134.90829 -126.11140 8.79689 3.02878 -125.71775 1201.95165
1935.0000 -135.41544 -128.02005 7.39540 2.96595 -126.65921 1206.90732
1940.0000 -135.46009 -126.51407 8.94602 2.87579 -128.01004 1094.53874
1945.0000 -137.74397 -128.95620 8.78777 2.82622 -128.75287 1090.63052
1950.0000 -135.19874 -125.64706 9.55168 2.94963 -126.90368 1166.77508
1955.0000 -133.29478 -123.77757 9.51721 3.06265 -125.21014 1217.34721
1960.0000 -132.63411 -123.37307 9.26104 3.20435 -123.08707 1307.66948
1965.0000 -137.30085 -126.47255 10.82830 2.97785 -126.48079 1160.87279
1970.0000 -135.65709 -125.97443 9.68265 2.94223 -127.01449 1158.26145
1975.0000 -135.41002 -126.87191 8.53811 3.02388 -125.79119 1205.71608
1980.0000 -134.18681 -125.65189 8.53492 2.98875 -126.31755 1172.22851
1985.0000 -136.86479 -128.59223 8.27256 2.96206 -126.71745 1201.80653
1990.0000 -135.05582 -127.06680 7.98902 2.95268 -126.85795 1160.72632
1995.0000 -137.15913 -129.34499 7.81414 2.93905 -127.06223 1155.06837
2000.0000 -136.54487 -129.07789 7.46698 2.74109 -130.02842 1016.73600
FREEZING PROCESS: loop number 9 T-loop= 1094.0000000000000
main_MD> interactions number 9 at Temperature= 1094.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.54546 0.49206 1.22047
force_rgl> df(natom) 2.10991 -0.74086 4.04376
2005.0000 -135.86206 -128.03266 7.82939 2.84088 -128.53317 1042.74895
2010.0000 -134.96786 -124.91625 10.05161 2.89484 -127.72456 1119.09450
2015.0000 -136.18981 -128.45676 7.73305 2.87300 -128.05193 1096.76504
2020.0000 -137.52643 -129.07078 8.45565 2.89798 -127.67755 1161.55613
2025.0000 -136.93344 -129.06492 7.86852 2.80843 -129.01943 1076.26889
2030.0000 -134.16404 -127.50804 6.65600 2.86372 -128.19095 1076.89391
2035.0000 -138.72352 -130.76724 7.95629 2.77595 -129.50602 995.43885
2040.0000 -136.83167 -128.31776 8.51391 2.81153 -128.97297 1017.33299
2045.0000 -137.14072 -127.80312 9.33760 2.83354 -128.64315 1090.82760
2050.0000 -137.00768 -128.39793 8.60974 2.84983 -128.39897 1100.73372
2055.0000 -134.54454 -126.44113 8.10341 2.91796 -127.37820 1153.72726
2060.0000 -136.76326 -125.73637 11.02690 3.03427 -125.63551 1216.15573
2065.0000 -134.85864 -126.77225 8.08639 2.94888 -126.91492 1124.23194
2070.0000 -136.93203 -127.23609 9.69594 2.97267 -126.55843 1159.71343
2075.0000 -136.83241 -129.15218 7.68024 2.93519 -127.11998 1141.83352
2080.0000 -137.75275 -129.77131 7.98144 2.79162 -129.27130 1062.80739
2085.0000 -135.18331 -128.18342 6.99990 2.89841 -127.67121 1171.45116
2090.0000 -137.95839 -128.80444 9.15395 2.87754 -127.98385 1116.87212
2095.0000 -137.02946 -129.35183 7.67763 2.84916 -128.40909 1103.89153
2100.0000 -137.45053 -129.77601 7.67451 2.77636 -129.49989 1031.97659
2105.0000 -135.10666 -125.25946 9.84719 2.91359 -127.44366 1148.72691
2110.0000 -135.60427 -127.60101 8.00326 3.01687 -125.89622 1198.73088
2115.0000 -134.52601 -126.04690 8.47911 3.01050 -125.99162 1187.18964
2120.0000 -135.33744 -126.08492 9.25252 3.05294 -125.35578 1257.02759
2125.0000 -136.54343 -128.40683 8.13660 2.92829 -127.22343 1140.85119
2130.0000 -135.57018 -127.31339 8.25679 2.80200 -129.11570 1029.63249
2135.0000 -137.44971 -129.04561 8.40410 2.87473 -128.02594 1098.92245
2140.0000 -136.14384 -127.18485 8.95899 2.85250 -128.35904 1106.30878
2145.0000 -135.93501 -127.21506 8.71996 2.90984 -127.49982 1129.93900
2150.0000 -138.90862 -131.66360 7.24503 2.84140 -128.52534 1088.53357
2155.0000 -138.39281 -130.23246 8.16035 2.66735 -131.13321 943.46489
2160.0000 -135.23802 -127.76804 7.46998 2.79038 -129.28977 1043.64471
2165.0000 -138.39394 -130.07375 8.32019 2.79528 -129.21645 1055.03941
2170.0000 -136.53165 -129.36266 7.16899 2.80815 -129.02355 1042.81468
2175.0000 -138.21494 -129.67040 8.54454 2.77844 -129.46880 1017.17574
2180.0000 -136.02154 -128.85096 7.17059 2.86573 -128.16079 1069.84752
2185.0000 -136.70133 -128.61509 8.08625 2.82769 -128.73075 1043.82405
2190.0000 -138.72002 -131.00971 7.71031 2.76412 -129.68322 1059.05203
2195.0000 -137.22173 -127.48118 9.74055 2.77465 -129.52558 1053.40886
2200.0000 -135.10973 -127.13794 7.97180 2.93785 -127.08017 1189.33829
2205.0000 -136.47196 -129.78883 6.68313 2.85120 -128.37855 1095.13888
2210.0000 -136.75497 -130.06614 6.68882 2.72975 -130.19828 1013.66551
2215.0000 -136.21869 -129.28542 6.93327 2.82407 -128.78505 1095.17530
2220.0000 -137.48648 -128.97656 8.50992 2.77091 -129.58154 984.38527
2225.0000 -137.10036 -129.92748 7.17288 2.82708 -128.73992 1045.48465
2230.0000 -136.49454 -128.65714 7.83740 2.72819 -130.22165 1014.69834
2235.0000 -135.75174 -128.61337 7.13837 2.81760 -128.88199 1027.71696
2240.0000 -134.50082 -125.99202 8.50881 2.86807 -128.12571 1119.15344
2245.0000 -136.23266 -127.90731 8.32535 2.92330 -127.29814 1124.98483
2250.0000 -136.40772 -128.52382 7.88390 2.85833 -128.27162 1084.07916
FREEZING PROCESS: loop number 10 T-loop= 1069.0000000000000
main_MD> interactions number 10 at Temperature= 1069.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.04553 -0.12416 -2.33284
force_rgl> df(natom) -3.89058 6.38987 -0.48532
2255.0000 -138.85558 -130.29811 8.55747 2.76730 -129.63564 1066.54338
2260.0000 -136.84359 -130.51979 6.32380 2.71936 -130.35390 1029.20816
2265.0000 -136.66047 -129.12500 7.53547 2.73449 -130.12721 966.94561
2270.0000 -137.83735 -129.45890 8.37845 2.76631 -129.65051 1032.13562
2275.0000 -134.70660 -127.11738 7.58922 2.89379 -127.74040 1118.80701
2280.0000 -134.41663 -126.77926 7.63737 2.91246 -127.46064 1100.80604
2285.0000 -134.38148 -125.68931 8.69218 3.01284 -125.95661 1206.60531
2290.0000 -137.25592 -127.50647 9.74945 2.98446 -126.38184 1179.80353
2295.0000 -138.54339 -130.20081 8.34258 2.86609 -128.15545 1096.45088
2300.0000 -137.33533 -126.92407 10.41126 2.86442 -128.18048 1091.79101
2305.0000 -137.58433 -128.17738 9.40696 2.92890 -127.21423 1149.02984
2310.0000 -137.33192 -129.49547 7.83645 2.83703 -128.59089 1074.13554
2315.0000 -136.94286 -129.01195 7.93091 2.82129 -128.82663 1079.95073
2320.0000 -135.80325 -128.20185 7.60140 2.88606 -127.85619 1086.19600
2325.0000 -135.84956 -127.02068 8.82888 2.89592 -127.70840 1112.62309
2330.0000 -136.26970 -128.56310 7.70660 2.90032 -127.64256 1106.67575
2335.0000 -137.19046 -129.73146 7.45900 2.76196 -129.71571 1029.27516
2340.0000 -139.32806 -130.17843 9.14964 2.76915 -129.60800 1013.84012
2345.0000 -138.94685 -132.43324 6.51361 2.70331 -130.59446 998.78121
2350.0000 -137.38868 -129.64024 7.74844 2.75093 -129.88090 1016.19578
2355.0000 -135.55947 -127.75669 7.80278 2.88132 -127.92727 1122.89778
2360.0000 -135.19467 -127.19754 7.99713 2.86502 -128.17139 1078.27843
2365.0000 -136.57992 -127.83646 8.74346 2.83230 -128.66170 1100.73862
2370.0000 -136.19029 -127.76090 8.42939 2.88867 -127.81711 1126.88663
2375.0000 -136.98938 -128.88119 8.10818 2.85012 -128.39472 1113.75942
2380.0000 -137.48693 -130.05009 7.43684 2.80677 -129.04430 1082.06896
2385.0000 -135.88595 -127.47590 8.41004 2.84630 -128.45193 1051.48747
2390.0000 -135.65184 -126.33423 9.31760 2.94488 -126.97479 1176.28852
2395.0000 -134.11494 -126.00171 8.11323 3.03443 -125.63310 1219.71445
2400.0000 -138.51739 -130.77883 7.73857 2.89068 -127.78690 1117.57782
2405.0000 -137.35471 -129.92262 7.43209 2.72874 -130.21334 1015.01640
2410.0000 -136.84585 -128.60484 8.24101 2.75035 -129.88961 1043.75006
2415.0000 -137.42495 -128.91898 8.50596 2.84659 -128.44764 1105.43597
2420.0000 -136.23982 -127.90680 8.33302 2.81877 -128.86437 1053.35028
2425.0000 -137.42614 -130.17392 7.25222 2.82999 -128.69626 1081.92765
2430.0000 -138.66237 -129.84900 8.81337 2.76603 -129.65461 1020.38314
2435.0000 -137.68510 -131.43522 6.24988 2.69367 -130.73884 1001.72450
2440.0000 -139.56384 -132.66488 6.89897 2.63906 -131.55718 950.12250
2445.0000 -141.39947 -133.33292 8.06655 2.58865 -132.31254 909.31224
2450.0000 -137.53019 -127.91242 9.61776 2.69737 -130.68344 993.26431
2455.0000 -136.16705 -127.79473 8.37233 2.89319 -127.74935 1124.97327
2460.0000 -137.18813 -127.04027 10.14787 2.89060 -127.78811 1092.27098
2465.0000 -133.88291 -124.85692 9.02598 3.01430 -125.93461 1192.07374
2470.0000 -135.61747 -128.56092 7.05655 2.97637 -126.50298 1174.83251
2475.0000 -136.96612 -127.32707 9.63904 2.88542 -127.86571 1112.95653
2480.0000 -137.27063 -127.89037 9.38026 2.93436 -127.13243 1167.50401
2485.0000 -136.53411 -126.83934 9.69477 2.91974 -127.35147 1157.22118
2490.0000 -137.35147 -130.62093 6.73054 2.88552 -127.86431 1146.08565
2495.0000 -136.47428 -128.72409 7.75019 2.70483 -130.57174 967.16300
2500.0000 -136.64081 -129.59403 7.04678 2.75845 -129.76820 1009.53021
FREEZING PROCESS: loop number 11 T-loop= 1044.0000000000000
main_MD> interactions number 11 at Temperature= 1044.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.43314 0.54371 0.75157
force_rgl> df(natom) 0.19941 -2.68970 -1.17395
2505.0000 -136.62990 -128.59580 8.03410 2.85755 -128.28340 1105.88944
2510.0000 -138.04705 -129.31473 8.73232 2.79651 -129.19804 1074.66157
2515.0000 -139.75668 -130.51831 9.23836 2.75351 -129.84231 1022.15682
2520.0000 -135.99711 -128.03988 7.95723 2.79713 -129.18864 1078.64567
2525.0000 -135.56390 -127.52543 8.03847 2.91393 -127.43863 1132.94138
2530.0000 -136.80188 -131.02763 5.77425 2.77533 -129.51528 1033.58544
2535.0000 -138.29960 -131.01643 7.28317 2.70109 -130.62777 982.34995
2540.0000 -138.39299 -129.17074 9.22225 2.68512 -130.86705 979.34831
2545.0000 -135.07781 -128.11319 6.96462 2.84672 -128.44559 1080.43546
2550.0000 -137.82579 -129.41114 8.41466 2.85500 -128.32152 1120.25337
2555.0000 -135.49869 -126.58514 8.91355 2.76832 -129.62037 1056.46556
2560.0000 -135.85537 -127.27175 8.58362 2.95927 -126.75918 1167.15694
2565.0000 -138.01977 -130.22984 7.78993 2.82533 -128.76617 1080.36509
2570.0000 -136.83751 -130.57268 6.26483 2.67468 -131.02340 956.13098
2575.0000 -136.39814 -128.39975 7.99839 2.74147 -130.02263 985.52727
2580.0000 -136.55448 -129.37328 7.18121 2.79580 -129.20867 1022.34168
2585.0000 -136.67335 -127.72074 8.95261 2.84550 -128.46391 1090.27824
2590.0000 -136.27887 -128.57802 7.70085 2.92649 -127.25042 1123.34824
2595.0000 -135.75356 -128.05140 7.70217 2.87017 -128.09427 1099.69589
2600.0000 -138.85261 -130.02866 8.82395 2.80820 -129.02281 1093.92570
2605.0000 -137.99663 -130.52114 7.47549 2.73442 -130.12836 1010.47962
2610.0000 -138.78643 -130.76572 8.02071 2.64924 -131.40462 966.12662
2615.0000 -136.27021 -128.57677 7.69344 2.72658 -130.24584 1020.65698
2620.0000 -134.90579 -125.86844 9.03735 2.90659 -127.54860 1131.97564
2625.0000 -136.50481 -126.12195 10.38287 3.00610 -126.05757 1193.17321
2630.0000 -136.30376 -128.44236 7.86140 2.84053 -128.53837 1093.96881
2635.0000 -136.61298 -128.62876 7.98421 2.81232 -128.96110 1062.65754
2640.0000 -137.20982 -127.28744 9.92238 2.94205 -127.01720 1175.09044
2645.0000 -136.87404 -128.55911 8.31494 2.90544 -127.56581 1134.00498
2650.0000 -136.45392 -128.53755 7.91636 2.75251 -129.85724 1001.88199
2655.0000 -136.13849 -129.05912 7.07937 2.80792 -129.02708 1044.51237
2660.0000 -136.03411 -128.48167 7.55244 2.89715 -127.69002 1134.18828
2665.0000 -135.98146 -129.29485 6.68661 2.82663 -128.74667 1099.86786
2670.0000 -136.52945 -129.42415 7.10530 2.81776 -128.87964 1059.38768
2675.0000 -137.20567 -129.63619 7.56948 2.77785 -129.47754 1011.01899
2680.0000 -136.10886 -128.00335 8.10552 2.82246 -128.80911 1072.10189
2685.0000 -137.41360 -129.78905 7.62456 2.86681 -128.14467 1098.07175
2690.0000 -138.89648 -130.10752 8.78896 2.74424 -129.98116 1026.52564
2695.0000 -138.43613 -131.66791 6.76822 2.69226 -130.76009 953.96004
2700.0000 -136.55752 -128.41927 8.13826 2.73901 -130.05950 1034.36408
2705.0000 -135.58398 -128.76735 6.81662 2.88576 -127.86063 1124.31403
2710.0000 -137.41704 -130.02772 7.38932 2.79364 -129.24097 1027.25481
2715.0000 -138.74410 -130.25610 8.48800 2.71890 -130.36080 992.53154
2720.0000 -138.03270 -130.01875 8.01394 2.74740 -129.93376 1028.89195
2725.0000 -137.20761 -129.45562 7.75200 2.76613 -129.65312 1064.04935
2730.0000 -136.64203 -129.64210 6.99993 2.74200 -130.01466 994.88415
2735.0000 -135.02425 -128.19471 6.82954 2.79629 -129.20127 1066.69583
2740.0000 -137.72406 -129.53695 8.18711 2.81520 -128.91800 1081.23288
2745.0000 -138.35331 -130.76422 7.58909 2.77159 -129.57130 1023.75227
2750.0000 -136.50571 -129.46620 7.03950 2.79420 -129.23264 1049.84383
FREEZING PROCESS: loop number 12 T-loop= 1019.0000000000000
main_MD> interactions number 12 at Temperature= 1019.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.60173 1.42560 -1.13749
force_rgl> df(natom) -2.88430 4.26920 -0.47396
2755.0000 -139.26481 -132.17381 7.09100 2.74574 -129.95864 1009.38163
2760.0000 -137.46712 -130.90386 6.56326 2.59639 -132.19646 912.10552
2765.0000 -136.74634 -129.24272 7.50362 2.73207 -130.16346 1031.82553
2770.0000 -136.17626 -128.22349 7.95277 2.85140 -128.37547 1127.65614
2775.0000 -138.34247 -130.92104 7.42144 2.75192 -129.86615 997.66645
2780.0000 -137.92525 -130.32186 7.60340 2.67955 -130.95043 946.89004
2785.0000 -136.25334 -129.70561 6.54773 2.70407 -130.58304 961.13463
2790.0000 -138.23872 -130.22192 8.01680 2.73977 -130.04810 976.45993
2795.0000 -136.75703 -130.37530 6.38174 2.61897 -131.85811 924.08317
2800.0000 -138.19189 -130.17848 8.01342 2.72745 -130.23280 1014.22826
2805.0000 -138.66157 -131.57432 7.08725 2.72132 -130.32459 985.31484
2810.0000 -137.56269 -131.00759 6.55511 2.65252 -131.35552 957.74948
2815.0000 -138.79873 -131.88980 6.90894 2.70647 -130.54717 974.28101
2820.0000 -139.48635 -132.41467 7.07168 2.59566 -132.20737 904.10771
2825.0000 -140.58627 -134.18106 6.40521 2.51676 -133.38961 862.69669
2830.0000 -138.12762 -130.58168 7.54594 2.60785 -132.02476 883.77481
2835.0000 -138.90767 -130.90839 7.99928 2.71947 -130.35238 1033.58451
2840.0000 -137.40376 -130.70258 6.70117 2.67961 -130.94961 953.12863
2845.0000 -138.19452 -131.37193 6.82259 2.71725 -130.38562 981.66746
2850.0000 -136.79325 -128.69576 8.09748 2.73488 -130.12146 995.23384
2855.0000 -135.84555 -128.60283 7.24272 2.81944 -128.85439 1078.24094
2860.0000 -134.98325 -126.72531 8.25793 2.91499 -127.42271 1151.72613
2865.0000 -135.90978 -127.57171 8.33807 2.90849 -127.52011 1127.41069
2870.0000 -137.78798 -130.34251 7.44547 2.84021 -128.54316 1084.87740
2875.0000 -138.38678 -130.53630 7.85047 2.75267 -129.85490 1013.11083
2880.0000 -138.72728 -131.28665 7.44063 2.66195 -131.21416 956.61154
2885.0000 -138.63816 -130.83037 7.80779 2.72307 -130.29840 997.10206
2890.0000 -138.26595 -130.83531 7.43065 2.71311 -130.44766 980.51763
2895.0000 -138.11107 -130.96507 7.14600 2.69663 -130.69450 972.53127
2900.0000 -138.76982 -130.25979 8.51004 2.70510 -130.56767 1002.61274
2905.0000 -136.93604 -128.81533 8.12071 2.73871 -130.06404 1021.94303
2910.0000 -135.99223 -127.44233 8.54991 2.87134 -128.07669 1123.20536
2915.0000 -136.66663 -127.77261 8.89402 2.94337 -126.99750 1105.02094
2920.0000 -136.57075 -128.53718 8.03357 2.85311 -128.34990 1058.84509
2925.0000 -137.68144 -128.57805 9.10340 2.84344 -128.49476 1081.86441
2930.0000 -138.18685 -129.84209 8.34475 2.80990 -128.99729 1050.46443
2935.0000 -137.62423 -129.65054 7.97369 2.75091 -129.88119 994.10907
2940.0000 -134.76109 -126.41137 8.34972 2.84264 -128.50683 1075.22368
2945.0000 -137.77852 -129.47120 8.30732 2.81511 -128.91929 1054.15329
2950.0000 -137.26331 -130.00521 7.25811 2.76245 -129.70838 1032.29351
2955.0000 -137.56237 -129.27259 8.28978 2.78359 -129.39153 1056.87643
2960.0000 -138.93387 -131.22757 7.70631 2.71721 -130.38610 992.86992
2965.0000 -138.75025 -130.58975 8.16050 2.75193 -129.86589 1047.99713
2970.0000 -138.98647 -131.94721 7.03926 2.68918 -130.80619 954.93527
2975.0000 -138.21097 -129.41912 8.79185 2.72449 -130.27713 982.66462
2980.0000 -135.56089 -127.33672 8.22416 2.82909 -128.70986 1074.46248
2985.0000 -136.47039 -128.80896 7.66144 2.89878 -127.66565 1108.87115
2990.0000 -137.35891 -128.87859 8.48032 2.80342 -129.09451 1079.98674
2995.0000 -136.47988 -128.50752 7.97235 2.77593 -129.50636 990.94890
3000.0000 -136.98557 -129.81991 7.16566 2.80059 -129.13691 1030.30685
FREEZING PROCESS: loop number 13 T-loop= 994.00000000000000
main_MD> interactions number 13 at Temperature= 994.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -2.43424 3.71677 -4.10908
force_rgl> df(natom) 0.95989 2.73515 0.13344
3005.0000 -139.62107 -132.29489 7.32618 2.63468 -131.62274 957.15744
3010.0000 -136.57560 -130.30614 6.26946 2.64786 -131.42524 935.59721
3015.0000 -137.65183 -130.59777 7.05405 2.77640 -129.49928 1013.38460
3020.0000 -138.69147 -131.69370 6.99777 2.67880 -130.96164 978.49476
3025.0000 -137.80889 -130.28245 7.52644 2.75647 -129.79791 1040.63785
3030.0000 -138.53391 -131.11871 7.41520 2.75764 -129.78042 1007.40292
3035.0000 -136.35979 -129.05626 7.30353 2.70743 -130.53274 970.59203
3040.0000 -136.98780 -129.14116 7.84665 2.78977 -129.29899 1067.75819
3045.0000 -135.76677 -128.30288 7.46390 2.82257 -128.80743 1047.61922
3050.0000 -136.33219 -128.71712 7.61506 2.79146 -129.27363 1060.46488
3055.0000 -136.92077 -129.10028 7.82048 2.82439 -128.78024 1096.94231
3060.0000 -136.91958 -129.20619 7.71339 2.73513 -130.11763 1044.11358
3065.0000 -139.01169 -131.69477 7.31692 2.72890 -130.21096 974.02668
3070.0000 -138.39173 -131.54410 6.84763 2.62303 -131.79729 918.11628
3075.0000 -137.55209 -130.65493 6.89715 2.67366 -131.03866 986.56122
3080.0000 -138.32448 -130.24555 8.07893 2.74753 -129.93194 1035.18020
3085.0000 -135.49262 -127.77098 7.72163 2.78686 -129.34252 1033.61518
3090.0000 -137.09848 -129.67262 7.42586 2.80215 -129.11353 1071.57794
3095.0000 -137.07865 -129.72673 7.35192 2.74878 -129.91318 979.24380
3100.0000 -137.96633 -130.47799 7.48834 2.73976 -130.04834 1003.42580
3105.0000 -138.34532 -132.21750 6.12782 2.63806 -131.57214 939.62328
3110.0000 -139.68876 -132.05532 7.63344 2.56683 -132.63942 903.27152
3115.0000 -138.69468 -130.88533 7.80935 2.64789 -131.42488 930.08816
3120.0000 -139.11622 -131.49985 7.61638 2.63095 -131.67865 945.66878
3125.0000 -135.50540 -127.93361 7.57180 2.79660 -129.19660 1066.52386
3130.0000 -138.10757 -130.42682 7.68075 2.82716 -128.73867 1065.16516
3135.0000 -136.08537 -129.31333 6.77204 2.67430 -131.02914 959.96334
3140.0000 -137.36612 -129.60487 7.76125 2.81416 -128.93357 1041.18928
3145.0000 -137.11976 -130.82450 6.29527 2.74214 -130.01257 1004.49636
3150.0000 -138.18461 -131.38589 6.79872 2.70725 -130.53540 990.06398
3155.0000 -137.68856 -131.19357 6.49499 2.62877 -131.71131 900.56271
3160.0000 -137.27686 -129.81852 7.45833 2.71497 -130.41976 990.49975
3165.0000 -138.82387 -132.29829 6.52558 2.66142 -131.22215 946.81272
3170.0000 -138.59373 -130.93855 7.65518 2.64325 -131.49433 924.49398
3175.0000 -138.17575 -130.82659 7.34916 2.65122 -131.37495 935.41441
3180.0000 -139.11435 -131.39508 7.71927 2.67638 -130.99790 947.39705
3185.0000 -139.25566 -131.22794 8.02772 2.68967 -130.79887 982.24003
3190.0000 -138.28669 -129.72478 8.56192 2.73381 -130.13738 972.49779
3195.0000 -138.11564 -129.98736 8.12828 2.72676 -130.24309 915.77500
3200.0000 -139.18263 -131.91112 7.27151 2.69904 -130.65840 971.03224
3205.0000 -138.38201 -129.96848 8.41352 2.70718 -130.53650 997.42731
3210.0000 -135.29615 -129.09478 6.20137 2.80157 -129.12221 1039.18012
3215.0000 -137.36655 -129.58686 7.77969 2.77312 -129.54851 1010.93877
3220.0000 -138.06104 -130.43676 7.62428 2.76097 -129.73044 1020.49822
3225.0000 -138.95069 -129.77282 9.17788 2.78121 -129.42719 1057.86899
3230.0000 -138.66470 -132.09524 6.56946 2.65454 -131.32517 963.83628
3235.0000 -138.51773 -130.64786 7.86987 2.68125 -130.92502 978.71321
3240.0000 -137.99943 -131.19380 6.80563 2.70391 -130.58548 999.87691
3245.0000 -138.61226 -131.40179 7.21047 2.65079 -131.38146 927.11634
3250.0000 -139.98964 -131.54704 8.44260 2.65805 -131.27263 948.33394
FREEZING PROCESS: loop number 14 T-loop= 969.00000000000000
main_MD> interactions number 14 at Temperature= 969.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.24173 2.05649 -2.32111
force_rgl> df(natom) -0.08152 -2.00700 2.95145
3255.0000 -138.87343 -130.85853 8.01491 2.62277 -131.80117 952.82498
3260.0000 -138.62261 -131.07694 7.54567 2.68833 -130.81898 1003.68255
3265.0000 -138.44683 -130.90180 7.54503 2.64220 -131.51010 936.55101
3270.0000 -139.85167 -131.67906 8.17260 2.67182 -131.06631 936.45356
3275.0000 -137.85020 -131.87069 5.97951 2.64722 -131.43487 944.72968
3280.0000 -136.91217 -130.76843 6.14374 2.65501 -131.31818 940.21331
3285.0000 -139.41470 -131.60578 7.80892 2.66998 -131.09390 922.85673
3290.0000 -138.60811 -132.68985 5.91826 2.60666 -132.04267 936.94841
3295.0000 -138.82856 -132.27932 6.54924 2.58504 -132.36653 879.55473
3300.0000 -138.67978 -131.74874 6.93104 2.57417 -132.52938 905.66690
3305.0000 -139.39503 -132.00038 7.39465 2.66884 -131.11100 950.12716
3310.0000 -140.25935 -133.17001 7.08933 2.58967 -132.29716 914.63505
3315.0000 -138.60840 -131.95823 6.65018 2.61840 -131.86666 926.31191
3320.0000 -138.30891 -131.63057 6.67834 2.65188 -131.36501 944.69961
3325.0000 -138.11163 -130.51906 7.59257 2.68606 -130.85293 988.19911
3330.0000 -137.22658 -129.83486 7.39172 2.69957 -130.65043 961.75974
3335.0000 -137.22262 -130.96615 6.25646 2.74274 -130.00363 1006.20611
3340.0000 -138.47890 -130.70170 7.77720 2.74046 -130.03776 984.60062
3345.0000 -138.47006 -130.14159 8.32848 2.73582 -130.10733 992.43034
3350.0000 -137.40176 -130.32218 7.07958 2.78365 -129.39061 1030.42964
3355.0000 -137.21358 -129.79879 7.41479 2.74571 -129.95915 972.57051
3360.0000 -138.00951 -131.82171 6.18780 2.67448 -131.02644 967.16372
3365.0000 -137.31433 -129.21845 8.09588 2.75597 -129.80539 973.54438
3370.0000 -137.48658 -130.28857 7.19802 2.74238 -130.00911 1019.07031
3375.0000 -137.74703 -129.65880 8.08823 2.74087 -130.03167 951.11166
3380.0000 -137.96834 -130.32827 7.64007 2.74095 -130.03044 1004.02206
3385.0000 -139.05775 -131.32866 7.72909 2.64346 -131.49117 945.43139
3390.0000 -140.08828 -132.30293 7.78536 2.63351 -131.64033 940.26443
3395.0000 -138.40204 -131.50523 6.89681 2.62927 -131.70388 935.79687
3400.0000 -138.07191 -130.88975 7.18216 2.73247 -130.15754 996.64380
3405.0000 -137.01013 -130.32128 6.68885 2.68457 -130.87518 932.01781
3410.0000 -138.39562 -131.07389 7.32173 2.72583 -130.25699 993.25753
3415.0000 -139.51209 -131.17335 8.33874 2.65600 -131.30338 942.64408
3420.0000 -136.46342 -130.46315 6.00026 2.69524 -130.71540 994.28116
3425.0000 -135.14459 -127.14306 8.00153 2.81737 -128.88547 1060.24941
3430.0000 -136.78419 -129.54618 7.23801 2.84750 -128.43399 1042.53141
3435.0000 -136.72932 -129.26702 7.46231 2.76534 -129.66503 1015.74889
3440.0000 -137.52901 -129.60402 7.92499 2.81289 -128.95249 1066.71847
3445.0000 -137.73464 -129.66381 8.07082 2.79066 -129.28570 1035.76026
3450.0000 -137.40398 -130.71437 6.68961 2.71732 -130.38453 988.41929
3455.0000 -138.16320 -129.47172 8.69148 2.69696 -130.68959 972.46595
3460.0000 -137.90922 -130.20118 7.70803 2.72506 -130.26859 1017.16504
3465.0000 -140.52839 -132.80105 7.72734 2.59414 -132.23016 938.73695
3470.0000 -136.61097 -130.32603 6.28494 2.65732 -131.28353 996.73800
3475.0000 -137.95893 -130.44955 7.50938 2.67637 -130.99815 976.93382
3480.0000 -136.21629 -129.09027 7.12602 2.77657 -129.49681 1007.81114
3485.0000 -139.11220 -130.93702 8.17518 2.72339 -130.29353 1027.47208
3490.0000 -138.54115 -130.90143 7.63972 2.71289 -130.45087 1002.39801
3495.0000 -139.51002 -133.23327 6.27675 2.58622 -132.34884 927.13012
3500.0000 -139.12520 -131.88435 7.24085 2.60800 -132.02251 917.54548
FREEZING PROCESS: loop number 15 T-loop= 944.00000000000000
main_MD> interactions number 15 at Temperature= 944.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -5.21427 -0.86030 -4.52540
force_rgl> df(natom) -0.90084 0.01515 4.75986
3505.0000 -138.14208 -131.46170 6.68038 2.61844 -131.86617 932.58997
3510.0000 -138.38619 -129.84791 8.53828 2.67661 -130.99452 970.61656
3515.0000 -137.98766 -129.56847 8.41919 2.81427 -128.93182 1094.33245
3520.0000 -138.45327 -131.07953 7.37375 2.66563 -131.15911 912.92320
3525.0000 -138.61229 -131.75893 6.85336 2.70106 -130.62810 950.26266
3530.0000 -139.69685 -133.00545 6.69140 2.58574 -132.35603 904.83381
3535.0000 -139.78383 -133.06052 6.72331 2.49622 -133.69739 836.39404
3540.0000 -139.51736 -132.75654 6.76082 2.51513 -133.41408 856.56286
3545.0000 -140.07995 -133.60444 6.47551 2.50725 -133.53215 856.25154
3550.0000 -139.20171 -131.50887 7.69283 2.57363 -132.53749 924.89390
3555.0000 -138.78325 -131.64040 7.14285 2.61748 -131.88048 909.56912
3560.0000 -138.15569 -130.51903 7.63666 2.68346 -130.89191 933.47948
3565.0000 -137.65797 -130.81449 6.84348 2.70469 -130.57371 941.11698
3570.0000 -137.10897 -129.51250 7.59646 2.74502 -129.96953 1000.88156
3575.0000 -137.51216 -130.78242 6.72974 2.70280 -130.60211 972.47867
3580.0000 -138.38783 -131.19809 7.18974 2.72120 -130.32641 983.58680
3585.0000 -139.38354 -132.46470 6.91884 2.63510 -131.61654 915.42979
3590.0000 -139.50571 -132.97940 6.52632 2.55994 -132.74260 865.19619
3595.0000 -138.46058 -131.88192 6.57866 2.57459 -132.52321 863.23860
3600.0000 -137.56703 -131.01801 6.54902 2.69041 -130.78781 991.05314
3605.0000 -138.69747 -131.24077 7.45670 2.68509 -130.86745 971.78637
3610.0000 -138.19567 -130.83429 7.36138 2.63366 -131.63801 899.02450
3615.0000 -138.72221 -131.27102 7.45118 2.67294 -131.04948 908.20200
3620.0000 -138.36357 -132.50923 5.85433 2.62846 -131.71591 924.93819
3625.0000 -137.74458 -130.97430 6.77028 2.63897 -131.55853 929.44551
3630.0000 -136.38642 -129.42757 6.95886 2.76951 -129.60254 1018.97154
3635.0000 -137.60187 -129.49725 8.10462 2.76535 -129.66481 984.95526
3640.0000 -138.48938 -131.11832 7.37106 2.76803 -129.62478 1037.84793
3645.0000 -139.63900 -131.68041 7.95859 2.62196 -131.81330 933.66253
3650.0000 -138.36650 -131.69351 6.67298 2.65956 -131.24996 954.60541
3655.0000 -138.17252 -131.79909 6.37343 2.59055 -132.28406 893.10473
3660.0000 -138.84390 -132.41709 6.42681 2.60655 -132.04424 928.99467
3665.0000 -138.28919 -130.97765 7.31154 2.61287 -131.94955 877.29105
3670.0000 -138.13835 -130.78150 7.35685 2.66050 -131.23583 928.93357
3675.0000 -138.85697 -131.91206 6.94491 2.64856 -131.41481 932.08861
3680.0000 -138.71498 -131.61150 7.10348 2.62159 -131.81899 936.80422
3685.0000 -138.71526 -131.41805 7.29722 2.60287 -132.09947 903.34397
3690.0000 -138.56999 -131.14295 7.42704 2.64809 -131.42187 960.39226
3695.0000 -136.60618 -131.21281 5.39336 2.67192 -131.06482 970.72249
3700.0000 -139.10755 -132.20487 6.90269 2.60701 -132.03735 938.57621
3705.0000 -139.37534 -132.01136 7.36398 2.60729 -132.03324 904.90664
3710.0000 -137.48687 -129.08644 8.40044 2.74320 -129.99671 1032.00067
3715.0000 -138.58388 -131.75075 6.83313 2.74896 -129.91040 1042.52825
3720.0000 -139.62318 -133.30625 6.31693 2.58684 -132.33957 863.65319
3725.0000 -140.19064 -133.18839 7.00225 2.55530 -132.81219 904.53012
3730.0000 -138.73231 -132.47815 6.25416 2.58728 -132.33308 905.34786
3735.0000 -138.91635 -131.74656 7.16979 2.61034 -131.98747 911.27306
3740.0000 -138.32251 -131.13314 7.18937 2.67388 -131.03547 945.83601
3745.0000 -138.85215 -130.94647 7.90568 2.68772 -130.82811 977.60898
3750.0000 -137.10199 -129.98278 7.11921 2.69287 -130.75082 966.71674
FREEZING PROCESS: loop number 16 T-loop= 919.00000000000000
main_MD> interactions number 16 at Temperature= 919.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 6.66847 1.15629 -0.11949
force_rgl> df(natom) -2.32467 -0.04523 3.21777
3755.0000 -137.71685 -131.00090 6.71594 2.71085 -130.48144 999.53496
3760.0000 -138.44694 -131.25203 7.19491 2.67318 -131.04597 967.80970
3765.0000 -140.33571 -134.55513 5.78059 2.56913 -132.60504 882.22858
3770.0000 -140.41437 -134.54696 5.86741 2.49936 -133.65039 840.92968
3775.0000 -140.32259 -132.95426 7.36832 2.51000 -133.49089 888.14468
3780.0000 -139.26350 -131.52648 7.73701 2.61202 -131.96238 922.75671
3785.0000 -138.39397 -131.67413 6.71984 2.62778 -131.72620 940.22331
3790.0000 -140.21604 -134.70498 5.51106 2.55103 -132.87610 866.85630
3795.0000 -139.48557 -134.35909 5.12648 2.44870 -134.40941 801.99907
3800.0000 -139.80354 -133.31002 6.49353 2.52236 -133.30573 869.08937
3805.0000 -138.90055 -130.71800 8.18255 2.62322 -131.79454 942.05638
3810.0000 -138.59259 -132.96464 5.62795 2.63126 -131.67407 930.04217
3815.0000 -139.60774 -132.19717 7.41057 2.54678 -132.93988 851.66366
3820.0000 -139.33960 -131.77579 7.56381 2.60347 -132.09036 905.67124
3825.0000 -139.81581 -132.73494 7.08087 2.57675 -132.49080 918.12401
3830.0000 -138.13263 -131.54336 6.58928 2.57794 -132.47296 909.72053
3835.0000 -139.01942 -132.93480 6.08462 2.56676 -132.64053 878.32498
3840.0000 -138.10510 -131.44332 6.66178 2.57611 -132.50041 887.57471
3845.0000 -139.22367 -132.80301 6.42066 2.61218 -131.95992 908.75540
3850.0000 -139.66354 -133.56202 6.10153 2.52983 -133.19386 854.87319
3855.0000 -138.48096 -131.62655 6.85440 2.58526 -132.36328 917.12837
3860.0000 -138.14489 -131.19049 6.95440 2.73169 -130.16922 1015.91807
3865.0000 -137.30986 -130.06459 7.24526 2.70166 -130.61921 988.63676
3870.0000 -137.63938 -131.58224 6.05714 2.69584 -130.70635 951.76999
3875.0000 -138.06840 -131.90709 6.16131 2.61297 -131.94804 910.34570
3880.0000 -139.77816 -133.60885 6.16931 2.55992 -132.74297 833.84667
3885.0000 -140.00741 -134.97820 5.02921 2.46112 -134.22331 805.24817
3890.0000 -140.28454 -133.52579 6.75875 2.44848 -134.41281 757.00549
3895.0000 -138.05938 -131.82696 6.23242 2.61635 -131.89747 936.33891
3900.0000 -140.57147 -132.64410 7.92737 2.60121 -132.12434 905.73951
3905.0000 -140.24174 -133.60784 6.63390 2.49561 -133.70655 862.28854
3910.0000 -138.54069 -132.74722 5.79348 2.52249 -133.30383 882.00265
3915.0000 -139.14894 -131.94809 7.20085 2.62789 -131.72458 930.03184
3920.0000 -137.93788 -131.97449 5.96339 2.64307 -131.49706 926.69835
3925.0000 -137.19015 -129.88636 7.30378 2.63545 -131.61122 896.34826
3930.0000 -137.40377 -129.97272 7.43106 2.75355 -129.84173 1004.64689
3935.0000 -136.28299 -128.93008 7.35291 2.76791 -129.62648 998.39570
3940.0000 -137.21668 -129.16329 8.05339 2.83596 -128.60689 1045.71385
3945.0000 -137.41681 -129.77706 7.63975 2.71980 -130.34730 973.10458
3950.0000 -138.92307 -132.37758 6.54549 2.65468 -131.32306 933.10207
3955.0000 -138.92617 -131.63470 7.29147 2.61784 -131.87513 938.48941
3960.0000 -137.95332 -131.69906 6.25426 2.65261 -131.35405 950.60330
3965.0000 -138.94097 -131.67675 7.26422 2.58596 -132.35281 857.01093
3970.0000 -141.14656 -134.75771 6.38885 2.52704 -133.23558 882.52896
3975.0000 -139.37210 -133.49242 5.87968 2.45202 -134.35968 828.12164
3980.0000 -138.32545 -132.18866 6.13679 2.58999 -132.29235 930.76565
3985.0000 -140.62695 -133.61609 7.01086 2.49567 -133.70572 848.65492
3990.0000 -138.96167 -132.38355 6.57811 2.53059 -133.18247 874.36752
3995.0000 -139.10291 -132.52821 6.57470 2.57231 -132.55739 890.92749
4000.0000 -139.83914 -132.79790 7.04124 2.52586 -133.25323 838.22916
FREEZING PROCESS: loop number 17 T-loop= 894.00000000000000
main_MD> interactions number 17 at Temperature= 894.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.33301 3.31797 1.51683
force_rgl> df(natom) 1.16761 0.32240 -1.80434
4005.0000 -137.95698 -130.76425 7.19273 2.66810 -131.12207 943.90737
4010.0000 -136.53843 -129.60084 6.93759 2.70794 -130.52506 982.08463
4015.0000 -139.78565 -132.65062 7.13502 2.62804 -131.72227 909.76209
4020.0000 -137.93197 -132.10488 5.82708 2.59927 -132.15336 902.48176
4025.0000 -139.41606 -133.57447 5.84159 2.59485 -132.21965 924.10517
4030.0000 -140.73829 -133.36777 7.37052 2.53566 -133.10653 856.48283
4035.0000 -137.43706 -131.78847 5.64859 2.53885 -133.05861 864.52766
4040.0000 -138.22352 -131.78491 6.43860 2.60153 -132.11945 926.24404
4045.0000 -139.37351 -132.68070 6.69281 2.60718 -132.03483 903.83116
4050.0000 -139.29987 -131.49456 7.80531 2.60920 -132.00455 936.25394
4055.0000 -138.93639 -131.13521 7.80118 2.66723 -131.13499 981.93185
4060.0000 -138.57294 -131.95230 6.62064 2.66400 -131.18346 948.42012
4065.0000 -137.59477 -130.23724 7.35753 2.69683 -130.69159 976.72712
4070.0000 -137.88689 -130.66140 7.22549 2.70880 -130.51225 988.67836
4075.0000 -140.02875 -132.47263 7.55611 2.69190 -130.76538 957.45828
4080.0000 -139.81724 -132.46146 7.35578 2.53002 -133.19096 873.60560
4085.0000 -138.82510 -131.06339 7.76171 2.62597 -131.75329 924.10095
4090.0000 -139.25177 -132.94996 6.30181 2.57180 -132.56496 879.66339
4095.0000 -138.02128 -131.48740 6.53389 2.61469 -131.92237 877.73723
4100.0000 -138.98761 -131.96043 7.02718 2.63929 -131.55365 941.88564
4105.0000 -138.40489 -132.35536 6.04953 2.60630 -132.04799 871.34485
4110.0000 -139.62283 -131.88400 7.73882 2.55625 -132.79790 880.21693
4115.0000 -139.52199 -132.28530 7.23670 2.59362 -132.23800 938.08512
4120.0000 -139.23005 -134.17404 5.05601 2.53728 -133.08221 871.20807
4125.0000 -139.14869 -132.43477 6.71392 2.48724 -133.83201 844.10342
4130.0000 -140.13746 -133.54107 6.59639 2.53358 -133.13760 865.60913
4135.0000 -138.76247 -132.84122 5.92124 2.53509 -133.11506 851.72423
4140.0000 -139.87500 -134.30366 5.57134 2.52330 -133.29173 849.21862
4145.0000 -139.37215 -132.62627 6.74588 2.53861 -133.06222 867.39860
4150.0000 -139.22366 -132.97465 6.24901 2.52703 -133.23582 855.26532
4155.0000 -138.97480 -133.32729 5.64751 2.58844 -132.31570 915.58559
4160.0000 -139.46327 -131.30009 8.16319 2.56609 -132.65053 875.89320
4165.0000 -138.90153 -132.31810 6.58343 2.59265 -132.25249 932.45828
4170.0000 -139.18354 -132.44547 6.73807 2.61433 -131.92775 917.43027
4175.0000 -138.44594 -133.69962 4.74632 2.57501 -132.51690 902.80211
4180.0000 -138.65113 -132.06901 6.58212 2.53400 -133.13140 844.78251
4185.0000 -137.86594 -132.11838 5.74756 2.64907 -131.40717 936.74280
4190.0000 -138.96649 -131.83469 7.13180 2.62951 -131.70029 919.11812
4195.0000 -137.56133 -129.82157 7.73976 2.71684 -130.39167 974.89679
4200.0000 -138.57606 -131.06109 7.51497 2.69885 -130.66127 942.68818
4205.0000 -138.22583 -131.36435 6.86148 2.67033 -131.08866 975.82024
4210.0000 -139.36109 -132.91737 6.44372 2.62687 -131.73974 934.48004
4215.0000 -139.20726 -132.60188 6.60537 2.63785 -131.57521 934.57511
4220.0000 -139.53955 -133.99435 5.54520 2.59747 -132.18029 920.34624
4225.0000 -139.94206 -133.94927 5.99279 2.47585 -134.00262 833.82364
4230.0000 -139.32953 -133.55290 5.77663 2.50957 -133.49735 846.47377
4235.0000 -139.40993 -134.37767 5.03226 2.48727 -133.83159 829.46761
4240.0000 -137.95453 -132.26631 5.68822 2.54603 -132.95102 877.22817
4245.0000 -139.04644 -133.10968 5.93676 2.57311 -132.54533 886.22981
4250.0000 -139.55029 -133.32702 6.22327 2.52011 -133.33946 822.48191
FREEZING PROCESS: loop number 18 T-loop= 869.00000000000000
main_MD> interactions number 18 at Temperature= 869.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.80283 5.59903 0.40706
force_rgl> df(natom) 0.88145 -0.17354 2.35919
4255.0000 -140.03180 -133.43273 6.59907 2.50393 -133.58192 801.54989
4260.0000 -139.16452 -132.31023 6.85429 2.54581 -132.95433 861.86438
4265.0000 -139.90759 -132.84282 7.06477 2.54411 -132.97984 862.41953
4270.0000 -138.77921 -131.42604 7.35316 2.59771 -132.17674 914.18022
4275.0000 -139.14529 -133.58458 5.56071 2.52793 -133.22233 838.93906
4280.0000 -138.84877 -131.93148 6.91729 2.54500 -132.96658 862.13218
4285.0000 -139.73650 -130.82511 8.91139 2.62632 -131.74807 924.71704
4290.0000 -138.59604 -131.33894 7.25710 2.68988 -130.79567 984.62514
4295.0000 -138.94811 -131.10443 7.84368 2.70957 -130.50069 980.20288
4300.0000 -139.36578 -132.80824 6.55754 2.57360 -132.53805 908.42723
4305.0000 -140.02073 -133.34611 6.67462 2.54288 -132.99829 862.11015
4310.0000 -141.05229 -135.42007 5.63222 2.47720 -133.98240 843.48235
4315.0000 -138.84773 -133.42942 5.41831 2.46046 -134.23329 832.95464
4320.0000 -140.48491 -133.53062 6.95428 2.48624 -133.84698 810.83171
4325.0000 -142.60783 -134.03468 8.57315 2.50732 -133.53104 828.94611
4330.0000 -139.66995 -132.04553 7.62442 2.50584 -133.55335 852.81795
4335.0000 -138.16480 -130.95161 7.21319 2.64706 -131.43729 961.91545
4340.0000 -138.73797 -130.79194 7.94602 2.70698 -130.53939 985.57331
4345.0000 -138.58933 -132.17278 6.41656 2.59038 -132.28657 876.99438
4350.0000 -139.54549 -132.64828 6.89721 2.56958 -132.59821 896.98375
4355.0000 -139.63692 -133.62722 6.00970 2.49962 -133.64647 832.08604
4360.0000 -139.47789 -132.47871 6.99919 2.52617 -133.24860 818.05103
4365.0000 -139.49014 -132.57572 6.91442 2.54820 -132.91855 875.58263
4370.0000 -140.07093 -133.03489 7.03605 2.52711 -133.23464 868.13666
4375.0000 -138.73856 -132.13308 6.60548 2.52713 -133.23433 838.94486
4380.0000 -139.36892 -132.22394 7.14498 2.62982 -131.69557 894.42315
4385.0000 -138.57135 -132.56780 6.00355 2.58022 -132.43886 894.45128
4390.0000 -140.97675 -133.73640 7.24035 2.52093 -133.32723 853.60428
4395.0000 -140.40895 -134.15880 6.25016 2.50540 -133.55984 867.96620
4400.0000 -138.65900 -132.12887 6.53013 2.51994 -133.34196 859.06495
4405.0000 -140.78367 -134.73252 6.05115 2.50483 -133.56848 843.13674
4410.0000 -139.87408 -133.34586 6.52822 2.54977 -132.89501 871.76546
4415.0000 -139.33251 -131.86909 7.46341 2.61757 -131.87911 945.46553
4420.0000 -138.72319 -132.01727 6.70591 2.61093 -131.97864 920.39382
4425.0000 -139.67021 -132.71621 6.95400 2.56446 -132.67497 890.73509
4430.0000 -139.63097 -133.95447 5.67650 2.49633 -133.69577 853.99351
4435.0000 -139.80569 -132.97268 6.83300 2.49332 -133.74086 813.61668
4440.0000 -139.98636 -133.43111 6.55525 2.52921 -133.20315 855.61544
4445.0000 -139.40102 -131.89113 7.50989 2.51861 -133.36189 839.64744
4450.0000 -138.24396 -131.73702 6.50694 2.60309 -132.09618 925.25170
4455.0000 -139.71610 -132.69597 7.02013 2.58413 -132.38021 907.58788
4460.0000 -138.42077 -131.71891 6.70187 2.57327 -132.54299 890.63029
4465.0000 -139.72166 -132.71730 7.00436 2.59289 -132.24902 925.90479
4470.0000 -140.59770 -132.75897 7.83873 2.58088 -132.42896 883.23322
4475.0000 -140.61040 -134.37505 6.23534 2.49343 -133.73930 841.32965
4480.0000 -139.70605 -132.98870 6.71735 2.49130 -133.77118 842.00417
4485.0000 -140.50229 -133.98124 6.52105 2.50616 -133.54852 865.19062
4490.0000 -141.32141 -135.47435 5.84705 2.41690 -134.88591 766.91525
4495.0000 -140.41331 -135.68572 4.72758 2.41102 -134.97407 792.13513
4500.0000 -140.65770 -134.53872 6.11897 2.38168 -135.41362 773.92627
FREEZING PROCESS: loop number 19 T-loop= 844.00000000000000
main_MD> interactions number 19 at Temperature= 844.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -5.23468 -2.69597 0.67306
force_rgl> df(natom) -0.76328 -6.36162 -1.32134
4505.0000 -140.49744 -134.10448 6.39296 2.49478 -133.71894 843.13909
4510.0000 -140.69388 -134.41893 6.27496 2.45489 -134.31663 772.17193
4515.0000 -140.51013 -133.64952 6.86061 2.47053 -134.08241 784.94960
4520.0000 -139.06568 -132.60817 6.45751 2.49899 -133.65598 851.57471
4525.0000 -139.47479 -132.85782 6.61697 2.60538 -132.06176 928.29827
4530.0000 -140.18172 -133.68357 6.49815 2.52202 -133.31084 850.78292
4535.0000 -139.28052 -133.36350 5.91702 2.53784 -133.07375 873.28670
4540.0000 -138.67524 -132.52218 6.15306 2.56532 -132.66212 871.86294
4545.0000 -140.31843 -132.66318 7.65525 2.59380 -132.23526 907.08267
4550.0000 -139.28368 -132.58826 6.69542 2.54083 -133.02907 828.38083
4555.0000 -138.64913 -132.70572 5.94341 2.51827 -133.36706 849.39325
4560.0000 -138.92798 -132.28706 6.64093 2.56387 -132.68381 885.37778
4565.0000 -139.15642 -132.36478 6.79164 2.61079 -131.98075 895.92016
4570.0000 -137.97238 -132.02380 5.94858 2.60350 -132.08999 905.55756
4575.0000 -139.76748 -133.22912 6.53836 2.59679 -132.19050 913.94344
4580.0000 -139.42691 -133.01839 6.40852 2.57025 -132.58822 883.68159
4585.0000 -139.23950 -133.44831 5.79119 2.52830 -133.21677 828.21764
4590.0000 -141.26461 -133.72455 7.54006 2.50273 -133.59991 820.28784
4595.0000 -140.94016 -134.42035 6.51981 2.53093 -133.17730 872.02204
4600.0000 -140.81522 -134.07830 6.73692 2.46467 -134.17010 809.82045
4605.0000 -140.91137 -135.34824 5.56313 2.40447 -135.07213 786.83154
4610.0000 -139.48759 -133.89817 5.58942 2.44698 -134.43529 793.03428
4615.0000 -140.37155 -133.88476 6.48679 2.45893 -134.25622 798.52977
4620.0000 -139.39231 -133.75117 5.64114 2.51119 -133.47313 813.62177
4625.0000 -139.79437 -133.18813 6.60624 2.48176 -133.91411 819.39718
4630.0000 -140.01634 -133.16421 6.85213 2.53981 -133.04433 861.50304
4635.0000 -139.73001 -132.71602 7.01399 2.55738 -132.78099 889.04090
4640.0000 -141.49106 -135.40408 6.08698 2.46088 -134.22695 818.58384
4645.0000 -140.10298 -133.10475 6.99823 2.45750 -134.27756 791.85965
4650.0000 -140.31078 -133.30853 7.00225 2.55051 -132.88391 900.52766
4655.0000 -139.60944 -133.99778 5.61166 2.47173 -134.06444 796.29529
4660.0000 -140.17884 -133.38979 6.78905 2.48696 -133.83616 830.98390
4665.0000 -139.20317 -133.18144 6.02173 2.51346 -133.43904 833.69359
4670.0000 -140.38695 -133.54392 6.84303 2.51200 -133.46096 855.15108
4675.0000 -138.45159 -133.20177 5.24982 2.50268 -133.60055 857.21442
4680.0000 -139.18711 -133.38009 5.80702 2.50242 -133.60458 855.97681
4685.0000 -139.84358 -133.34393 6.49965 2.53852 -133.06364 870.59479
4690.0000 -140.22300 -133.97531 6.24769 2.50836 -133.51548 859.80001
4695.0000 -140.31557 -134.22588 6.08969 2.52746 -133.22933 851.82699
4700.0000 -139.88518 -133.70889 6.17629 2.46154 -134.21703 821.98338
4705.0000 -139.37984 -132.49417 6.88566 2.52504 -133.26562 865.23424
4710.0000 -138.78878 -131.82430 6.96447 2.59665 -132.19260 908.55111
4715.0000 -138.17987 -131.57440 6.60547 2.59923 -132.15403 931.47315
4720.0000 -140.28332 -133.30352 6.97981 2.54644 -132.94500 854.72570
4725.0000 -139.25233 -134.08727 5.16505 2.44197 -134.51024 790.33685
4730.0000 -140.84510 -135.67180 5.17331 2.39185 -135.26124 736.35863
4735.0000 -140.78911 -133.59476 7.19436 2.39324 -135.24050 751.78552
4740.0000 -139.25768 -133.12122 6.13645 2.52400 -133.28116 863.00262
4745.0000 -140.68307 -132.92817 7.75490 2.56254 -132.70364 905.41487
4750.0000 -140.79942 -134.01240 6.78701 2.55770 -132.77624 905.53809
FREEZING PROCESS: loop number 20 T-loop= 819.00000000000000
main_MD> interactions number 20 at Temperature= 819.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.85684 2.77679 1.40337
force_rgl> df(natom) -0.60611 1.37225 2.22750
4755.0000 -139.73864 -133.40612 6.33252 2.56495 -132.66762 893.00456
4760.0000 -139.15040 -132.93041 6.22000 2.52738 -133.23057 864.33086
4765.0000 -138.85335 -132.38718 6.46617 2.56632 -132.64709 899.28794
4770.0000 -140.73529 -134.26337 6.47192 2.52693 -133.23721 849.86247
4775.0000 -139.87066 -133.02111 6.84955 2.47939 -133.94958 819.97193
4780.0000 -139.37757 -132.19712 7.18045 2.55773 -132.77572 881.88150
4785.0000 -139.78387 -132.61701 7.16686 2.53965 -133.04664 834.58244
4790.0000 -140.52454 -134.60475 5.91979 2.53525 -133.11255 884.03056
4795.0000 -140.70678 -134.03377 6.67301 2.47858 -133.96170 821.09728
4800.0000 -140.87967 -135.67297 5.20670 2.38911 -135.30240 767.53613
4805.0000 -140.44747 -133.80926 6.63821 2.38337 -135.38835 743.74459
4810.0000 -141.34613 -134.18367 7.16246 2.51767 -133.37607 858.60671
4815.0000 -140.67238 -135.16841 5.50398 2.47118 -134.07255 824.14520
4820.0000 -139.78045 -134.26037 5.52008 2.43332 -134.63996 809.69107
4825.0000 -141.79546 -135.36742 6.42804 2.38619 -135.34612 776.67621
4830.0000 -140.13026 -134.58259 5.54767 2.38776 -135.32253 733.57503
4835.0000 -140.68389 -134.99315 5.69075 2.43096 -134.67531 806.86901
4840.0000 -141.55359 -135.77495 5.77864 2.40211 -135.10755 782.38083
4845.0000 -141.90958 -135.72162 6.18796 2.39559 -135.20527 784.61909
4850.0000 -139.66322 -135.26240 4.40082 2.37641 -135.49266 732.02022
4855.0000 -140.97224 -135.35068 5.62156 2.41370 -134.93392 768.71798
4860.0000 -140.48748 -134.23104 6.25644 2.42750 -134.72717 810.49052
4865.0000 -142.02727 -136.23075 5.79652 2.37994 -135.43970 732.26460
4870.0000 -140.25849 -133.81808 6.44041 2.42126 -134.82058 781.39609
4875.0000 -139.49033 -132.97283 6.51750 2.53526 -133.11249 865.34296
4880.0000 -140.62880 -134.76359 5.86521 2.50937 -133.50035 867.40769
4885.0000 -140.07267 -134.28617 5.78650 2.42459 -134.77071 798.07418
4890.0000 -139.86366 -133.33871 6.52495 2.44852 -134.41211 835.68365
4895.0000 -140.72742 -133.90286 6.82456 2.45011 -134.38838 821.04824
4900.0000 -140.20237 -134.47433 5.72804 2.41383 -134.93189 786.94893
4905.0000 -140.56686 -134.83982 5.72704 2.38272 -135.39814 764.84325
4910.0000 -140.39069 -135.01577 5.37492 2.41669 -134.88900 765.58688
4915.0000 -139.30829 -133.85070 5.45758 2.44586 -134.45207 809.02221
4920.0000 -140.54006 -135.05429 5.48578 2.44667 -134.43980 777.91773
4925.0000 -139.90596 -134.10671 5.79925 2.45673 -134.28919 824.52746
4930.0000 -141.74832 -135.32201 6.42631 2.41488 -134.91622 762.56161
4935.0000 -141.19894 -135.91759 5.28135 2.36098 -135.72382 745.77468
4940.0000 -140.30656 -135.70538 4.60118 2.36421 -135.67548 738.13551
4945.0000 -140.01007 -133.91959 6.09048 2.38781 -135.32184 713.69020
4950.0000 -139.31892 -133.99819 5.32073 2.52810 -133.21975 830.38441
4955.0000 -139.84389 -133.64677 6.19712 2.45719 -134.28220 800.85074
4960.0000 -140.45293 -133.95281 6.50012 2.43911 -134.55321 798.14717
4965.0000 -141.07571 -133.66997 7.40574 2.46261 -134.20107 856.70554
4970.0000 -140.39819 -133.62377 6.77442 2.51100 -133.47599 852.69672
4975.0000 -139.20793 -132.19409 7.01383 2.53434 -133.12617 847.86911
4980.0000 -138.21140 -132.30681 5.90459 2.61317 -131.94511 890.66308
4985.0000 -138.56656 -132.14358 6.42298 2.55780 -132.77468 880.61488
4990.0000 -140.38476 -134.63470 5.75006 2.49588 -133.70258 821.51466
4995.0000 -139.70160 -133.50554 6.19606 2.47834 -133.96526 806.37245
5000.0000 -139.58134 -132.90296 6.67838 2.47190 -134.06190 819.36285
FREEZING PROCESS: loop number 21 T-loop= 794.00000000000000
main_MD> interactions number 21 at Temperature= 794.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.53052 2.89892 0.92841
force_rgl> df(natom) 2.51691 0.34331 -0.44661
5005.0000 -139.21607 -131.87817 7.33790 2.54339 -132.99064 853.27591
5010.0000 -138.04316 -132.92549 5.11766 2.52681 -133.23909 861.45809
5015.0000 -140.49667 -134.33894 6.15773 2.48698 -133.83586 838.99385
5020.0000 -140.83638 -134.88177 5.95461 2.42570 -134.75411 777.84900
5025.0000 -141.12033 -134.20765 6.91267 2.46671 -134.13965 838.19029
5030.0000 -140.27874 -133.46737 6.81137 2.42758 -134.72590 794.90980
5035.0000 -140.18097 -134.14096 6.04001 2.44121 -134.52167 789.59435
5040.0000 -139.15644 -132.39331 6.76312 2.48872 -133.80986 856.72625
5045.0000 -139.95410 -134.50445 5.44966 2.50148 -133.61856 858.50467
5050.0000 -140.17681 -134.77265 5.40416 2.46123 -134.22165 786.53393
5055.0000 -139.59848 -134.05348 5.54500 2.48418 -133.87777 814.02005
5060.0000 -140.86394 -134.03705 6.82689 2.52256 -133.30270 858.19558
5065.0000 -140.90894 -135.44511 5.46384 2.38674 -135.33788 774.64930
5070.0000 -140.71873 -135.65810 5.06063 2.37078 -135.57705 748.12156
5075.0000 -140.74898 -133.92055 6.82843 2.42457 -134.77104 776.46167
5080.0000 -142.20548 -135.05770 7.14778 2.45415 -134.32783 834.64732
5085.0000 -140.05732 -134.27174 5.78558 2.46212 -134.20844 815.67749
5090.0000 -141.30359 -136.18106 5.12253 2.36838 -135.61290 738.35688
5095.0000 -140.54958 -135.51565 5.03393 2.33609 -136.09669 738.56434
5100.0000 -140.19584 -135.23740 4.95844 2.38359 -135.38497 754.55621
5105.0000 -140.89326 -135.33834 5.55492 2.42206 -134.80864 793.33916
5110.0000 -141.56172 -136.26694 5.29478 2.34051 -136.03050 731.83972
5115.0000 -140.41040 -134.62926 5.78114 2.36952 -135.59592 768.34141
5120.0000 -141.88475 -135.82657 6.05818 2.39513 -135.21217 782.82507
5125.0000 -140.58674 -134.81103 5.77571 2.39965 -135.14436 761.16655
5130.0000 -140.61863 -133.22171 7.39692 2.39388 -135.23083 771.74730
5135.0000 -139.95247 -132.88494 7.06753 2.55762 -132.77748 886.49008
5140.0000 -141.26181 -134.88087 6.38094 2.48906 -133.80475 832.11742
5145.0000 -142.07390 -134.96769 7.10621 2.40734 -135.02919 783.50473
5150.0000 -139.36901 -134.13246 5.23655 2.44005 -134.53902 786.42380
5155.0000 -141.26468 -134.86020 6.40448 2.41030 -134.98477 773.63580
5160.0000 -141.20610 -134.92226 6.28384 2.45617 -134.29758 797.79126
5165.0000 -141.10947 -135.60621 5.50326 2.43410 -134.62823 769.21981
5170.0000 -139.18985 -133.64509 5.54476 2.45086 -134.37708 781.39951
5175.0000 -139.58758 -133.17343 6.41416 2.50576 -133.55452 829.93844
5180.0000 -139.61496 -133.69319 5.92178 2.51439 -133.42515 833.31621
5185.0000 -140.01500 -133.99242 6.02259 2.47263 -134.05085 823.67394
5190.0000 -139.90149 -133.03955 6.86193 2.53121 -133.17310 867.84709
5195.0000 -140.66434 -133.03715 7.62720 2.53635 -133.09606 882.28238
5200.0000 -139.21726 -132.82704 6.39023 2.48543 -133.85914 857.10022
5205.0000 -140.67296 -134.52718 6.14578 2.49845 -133.66402 828.15614
5210.0000 -138.67038 -133.64318 5.02720 2.45248 -134.35274 801.50492
5215.0000 -140.34156 -132.96541 7.37616 2.55605 -132.80093 885.30756
5220.0000 -139.29932 -133.59184 5.70748 2.51235 -133.45574 847.31809
5225.0000 -139.81331 -132.08715 7.72616 2.54751 -132.92885 873.81687
5230.0000 -140.49355 -133.63491 6.85864 2.50650 -133.54345 816.82788
5235.0000 -140.52052 -133.43662 7.08391 2.49234 -133.75549 816.20924
5240.0000 -139.20799 -132.64011 6.56788 2.54450 -132.97400 864.44544
5245.0000 -141.19163 -135.18828 6.00336 2.48810 -133.81913 829.61783
5250.0000 -140.16650 -134.39045 5.77605 2.38945 -135.29719 748.11473
FREEZING PROCESS: loop number 22 T-loop= 769.00000000000000
main_MD> interactions number 22 at Temperature= 769.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.55692 -0.17760 2.63280
force_rgl> df(natom) -1.11399 -2.28040 0.68319
5255.0000 -142.11447 -135.05386 7.06061 2.45476 -134.31859 799.93269
5260.0000 -140.94752 -135.13545 5.81207 2.40521 -135.06104 757.21123
5265.0000 -141.26712 -134.96153 6.30558 2.43860 -134.56072 801.21908
5270.0000 -140.33008 -134.17429 6.15580 2.43389 -134.63135 809.46718
5275.0000 -140.48637 -134.10349 6.38288 2.46723 -134.13175 819.42704
5280.0000 -141.34285 -135.15439 6.18845 2.42308 -134.79326 819.66101
5285.0000 -140.72185 -134.73633 5.98551 2.34872 -135.90753 731.61675
5290.0000 -141.81528 -135.47103 6.34425 2.42060 -134.83048 798.57694
5295.0000 -141.54359 -135.49674 6.04685 2.36541 -135.65749 783.14793
5300.0000 -141.48066 -135.23072 6.24994 2.41965 -134.84475 810.06123
5305.0000 -141.05211 -135.23382 5.81829 2.36576 -135.65220 760.93191
5310.0000 -139.64008 -132.82639 6.81369 2.43611 -134.59816 783.34972
5315.0000 -141.03684 -134.76444 6.27241 2.51453 -133.42302 859.05324
5320.0000 -140.75735 -135.13766 5.61970 2.42084 -134.82695 792.53465
5325.0000 -141.25142 -135.11519 6.13623 2.40734 -135.02911 764.05884
5330.0000 -139.51936 -133.72531 5.79406 2.44359 -134.48608 784.46507
5335.0000 -140.22537 -134.66574 5.55963 2.42437 -134.77394 798.98219
5340.0000 -141.22446 -135.15893 6.06554 2.38770 -135.32342 750.16759
5345.0000 -139.94157 -134.32585 5.61572 2.40833 -135.01440 782.25606
5350.0000 -140.32649 -134.28542 6.04107 2.48932 -133.80079 818.23730
5355.0000 -141.07463 -134.26323 6.81140 2.46721 -134.13212 801.51698
5360.0000 -141.24850 -135.71352 5.53498 2.41769 -134.87404 801.64368
5365.0000 -141.39985 -135.50529 5.89457 2.37562 -135.50440 756.12793
5370.0000 -141.13401 -133.80618 7.32784 2.39663 -135.18968 758.79189
5375.0000 -140.23407 -134.98647 5.24760 2.44807 -134.41882 791.67617
5380.0000 -140.88890 -135.67891 5.20999 2.36517 -135.66105 735.92680
5385.0000 -141.52680 -136.11742 5.40938 2.33376 -136.13173 689.69310
5390.0000 -139.67319 -134.11541 5.55779 2.40019 -135.13636 765.59106
5395.0000 -139.94628 -134.57130 5.37497 2.44477 -134.46837 773.32330
5400.0000 -141.02974 -134.54791 6.48183 2.41334 -134.93925 763.46975
5405.0000 -140.99292 -135.31340 5.67952 2.43732 -134.57994 801.52131
5410.0000 -140.82474 -135.66183 5.16291 2.38073 -135.42789 759.38997
5415.0000 -142.03367 -136.56937 5.46431 2.38606 -135.34801 757.25301
5420.0000 -142.21779 -137.35022 4.86757 2.24873 -137.40577 667.06658
5425.0000 -141.74350 -136.58903 5.15447 2.26959 -137.09319 691.01420
5430.0000 -140.39213 -134.86977 5.52235 2.32539 -136.25711 706.09411
5435.0000 -140.69914 -135.14484 5.55431 2.37858 -135.46018 735.62648
5440.0000 -140.76917 -135.51340 5.25577 2.40619 -135.04638 761.00017
5445.0000 -141.02537 -136.01105 5.01432 2.36422 -135.67525 747.53337
5450.0000 -141.09383 -136.05528 5.03855 2.35134 -135.86823 760.76858
5455.0000 -140.92823 -134.36520 6.56303 2.41418 -134.92667 813.90556
5460.0000 -140.95110 -134.72683 6.22426 2.43588 -134.60153 825.13345
5465.0000 -141.14276 -134.89734 6.24542 2.44186 -134.51199 794.88639
5470.0000 -140.19733 -133.79348 6.40385 2.42438 -134.77382 777.97538
5475.0000 -138.25009 -131.10306 7.14703 2.56295 -132.69753 884.93506
5480.0000 -140.31003 -134.54763 5.76241 2.57914 -132.45501 880.16684
5485.0000 -141.13389 -135.27795 5.85594 2.41787 -134.87142 762.27249
5490.0000 -140.93425 -135.63371 5.30054 2.38673 -135.33794 736.02415
5495.0000 -142.05284 -136.18485 5.86799 2.29044 -136.78083 713.43541
5500.0000 -141.42956 -135.75741 5.67215 2.36498 -135.66382 753.12184
FREEZING PROCESS: loop number 23 T-loop= 744.00000000000000
main_MD> interactions number 23 at Temperature= 744.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 3.59407 0.92954 -3.86933
force_rgl> df(natom) -0.47587 -1.21995 1.01820
5505.0000 -140.87365 -135.14607 5.72759 2.37921 -135.45063 788.43884
5510.0000 -142.07011 -135.83860 6.23150 2.38552 -135.35606 770.72895
5515.0000 -140.81110 -134.91071 5.90040 2.40508 -135.06303 749.50431
5520.0000 -141.59578 -136.14816 5.44762 2.35377 -135.83181 737.06161
5525.0000 -141.84868 -135.89493 5.95375 2.32300 -136.29297 710.80749
5530.0000 -140.58899 -135.42028 5.16871 2.35086 -135.87545 734.01591
5535.0000 -140.98897 -136.05969 4.92928 2.38171 -135.41328 751.45082
5540.0000 -141.50246 -136.27687 5.22559 2.37419 -135.52584 737.53190
5545.0000 -142.03265 -136.67474 5.35790 2.29280 -136.74535 709.65511
5550.0000 -142.33900 -136.06986 6.26914 2.31479 -136.41596 718.74739
5555.0000 -141.51922 -135.96939 5.54982 2.31737 -136.37724 731.00011
5560.0000 -141.27359 -136.22137 5.05222 2.34195 -136.00891 726.64308
5565.0000 -141.99166 -136.87810 5.11356 2.30367 -136.58251 731.59039
5570.0000 -141.22475 -136.76579 4.45896 2.28926 -136.79852 698.93875
5575.0000 -142.69054 -137.10202 5.58852 2.26767 -137.12200 661.64797
5580.0000 -142.14195 -136.64353 5.49842 2.23552 -137.60373 661.18555
5585.0000 -142.16253 -135.97979 6.18273 2.33021 -136.18486 713.56746
5590.0000 -140.44447 -135.46187 4.98260 2.37827 -135.46475 726.18264
5595.0000 -141.63280 -136.49705 5.13575 2.34887 -135.90524 732.93797
5600.0000 -142.11098 -137.33270 4.77828 2.27243 -137.05061 668.79298
5605.0000 -140.88066 -136.11899 4.76167 2.33203 -136.15761 717.36578
5610.0000 -140.83040 -135.47212 5.35828 2.38752 -135.32621 780.95442
5615.0000 -140.68778 -136.18532 4.50246 2.40750 -135.02685 775.39750
5620.0000 -140.61131 -135.25462 5.35669 2.40503 -135.06375 764.29696
5625.0000 -141.52934 -135.82595 5.70339 2.39278 -135.24730 748.94405
5630.0000 -141.27207 -135.48170 5.79037 2.37969 -135.44352 742.38296
5635.0000 -140.81908 -135.02985 5.78923 2.37745 -135.47697 734.26198
5640.0000 -140.48113 -135.30823 5.17290 2.39492 -135.21528 794.09876
5645.0000 -141.72529 -135.14412 6.58117 2.37427 -135.52474 775.34554
5650.0000 -141.48640 -135.42832 6.05808 2.38092 -135.42509 738.61798
5655.0000 -142.04147 -136.58527 5.45620 2.29316 -136.73999 691.20993
5660.0000 -140.18972 -135.40840 4.78132 2.32260 -136.29887 715.78332
5665.0000 -140.71477 -135.32639 5.38838 2.40797 -135.01969 775.05163
5670.0000 -141.99816 -136.62035 5.37782 2.30752 -136.52484 681.21680
5675.0000 -142.03383 -135.94416 6.08967 2.32019 -136.33500 712.73415
5680.0000 -142.02847 -136.37147 5.65700 2.33114 -136.17094 704.52123
5685.0000 -140.36004 -135.49795 4.86209 2.29532 -136.70766 688.51848
5690.0000 -142.15039 -136.18021 5.97018 2.37731 -135.47919 722.35213
5695.0000 -141.06840 -136.27337 4.79502 2.30627 -136.54363 687.83323
5700.0000 -141.02884 -135.03435 5.99449 2.36468 -135.66834 721.27554
5705.0000 -140.69557 -135.33282 5.36276 2.41107 -134.97326 763.45551
5710.0000 -141.44060 -136.22047 5.22013 2.36203 -135.70806 728.07605
5715.0000 -141.95246 -136.75971 5.19275 2.29876 -136.65612 692.08099
5720.0000 -141.48658 -135.94180 5.54479 2.31718 -136.38017 730.19529
5725.0000 -142.15383 -136.03952 6.11432 2.32540 -136.25689 713.67128
5730.0000 -140.17829 -133.96967 6.20862 2.35761 -135.77425 734.01636
5735.0000 -139.46739 -133.12584 6.34155 2.49792 -133.67188 822.02545
5740.0000 -142.92979 -136.27840 6.65138 2.37618 -135.49611 759.49743
5745.0000 -140.55922 -135.80073 4.75849 2.30136 -136.61713 719.03718
5750.0000 -141.32601 -136.03063 5.29538 2.34285 -135.99550 729.41579
FREEZING PROCESS: loop number 24 T-loop= 719.00000000000000
main_MD> interactions number 24 at Temperature= 719.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.04718 1.75989 1.61204
force_rgl> df(natom) -1.83047 -0.21085 0.90705
5755.0000 -142.20436 -135.54232 6.66204 2.35791 -135.76978 748.99608
5760.0000 -142.22519 -137.22041 5.00478 2.32951 -136.19538 726.67060
5765.0000 -141.29657 -136.65811 4.63846 2.27643 -136.99071 701.21055
5770.0000 -141.79697 -137.18858 4.60839 2.29872 -136.65663 692.40682
5775.0000 -142.18299 -136.27986 5.90313 2.26741 -137.12578 693.18526
5780.0000 -141.70187 -135.76543 5.93644 2.34632 -135.94345 739.66605
5785.0000 -140.57732 -134.92234 5.65498 2.38874 -135.30780 777.52159
5790.0000 -140.88274 -135.80352 5.07922 2.38637 -135.34344 767.75821
5795.0000 -142.10195 -136.70862 5.39333 2.30637 -136.54202 688.19635
5800.0000 -142.40726 -136.72926 5.67800 2.28664 -136.83765 690.89840
5805.0000 -141.09254 -134.94785 6.14469 2.38601 -135.34872 737.63273
5810.0000 -141.79069 -135.21822 6.57247 2.40120 -135.12112 760.30632
5815.0000 -140.66518 -136.12976 4.53542 2.36582 -135.65129 733.74370
5820.0000 -140.14021 -134.91702 5.22320 2.36956 -135.59519 728.86335
5825.0000 -140.40021 -135.33790 5.06231 2.40708 -135.03312 781.29006
5830.0000 -140.83551 -135.54924 5.28627 2.38661 -135.33980 740.68185
5835.0000 -141.33424 -136.23544 5.09880 2.35093 -135.87435 745.17183
5840.0000 -141.38044 -136.45942 4.92102 2.35409 -135.82712 720.16039
5845.0000 -142.44670 -135.40524 7.04146 2.34461 -135.96906 725.21495
5850.0000 -140.83996 -135.64077 5.19919 2.38379 -135.38206 777.79564
5855.0000 -141.07276 -136.22210 4.85065 2.34606 -135.94741 725.96126
5860.0000 -141.31943 -136.34836 4.97107 2.32453 -136.26992 686.08544
5865.0000 -141.00952 -135.48697 5.52255 2.32752 -136.22511 723.40757
5870.0000 -140.92710 -135.25853 5.66857 2.40793 -135.02040 779.56608
5875.0000 -142.97155 -136.31996 6.65159 2.34662 -135.93903 769.75111
5880.0000 -141.32448 -136.33428 4.99020 2.32037 -136.33237 720.34438
5885.0000 -142.10857 -136.45683 5.65174 2.31151 -136.46499 694.47747
5890.0000 -142.20564 -136.37181 5.83383 2.32021 -136.33474 703.02961
5895.0000 -141.94922 -136.68097 5.26825 2.31878 -136.35618 704.69212
5900.0000 -141.35054 -135.75888 5.59167 2.32817 -136.21541 686.63396
5905.0000 -141.36852 -136.20921 5.15931 2.35469 -135.81805 772.31686
5910.0000 -142.03958 -135.85282 6.18676 2.29202 -136.75707 688.02950
5915.0000 -141.76546 -136.22046 5.54499 2.32179 -136.31102 696.31995
5920.0000 -142.78143 -137.29827 5.48317 2.33732 -136.07827 720.95082
5925.0000 -142.20629 -136.85659 5.34971 2.28099 -136.92234 681.83449
5930.0000 -140.44337 -133.83093 6.61244 2.36197 -135.70892 733.18843
5935.0000 -141.06949 -135.68070 5.38879 2.41946 -134.84754 782.88575
5940.0000 -141.23623 -135.90061 5.33562 2.34248 -136.00106 736.38800
5945.0000 -141.57064 -136.92807 4.64257 2.29893 -136.65357 698.55397
5950.0000 -141.52414 -136.35701 5.16713 2.29911 -136.65089 703.61790
5955.0000 -141.57084 -135.65956 5.91127 2.35536 -135.80802 723.01667
5960.0000 -141.01152 -136.96343 4.04809 2.28589 -136.84892 686.65609
5965.0000 -141.65143 -135.59818 6.05325 2.31938 -136.34721 709.26444
5970.0000 -141.80096 -136.12242 5.67854 2.34044 -136.03158 707.17373
5975.0000 -141.27931 -136.35061 4.92869 2.31886 -136.35495 702.24619
5980.0000 -140.72474 -135.68880 5.03595 2.35738 -135.77777 737.85954
5985.0000 -141.18831 -135.35123 5.83709 2.35463 -135.81893 732.39307
5990.0000 -140.16463 -135.24821 4.91642 2.40432 -135.07445 778.95623
5995.0000 -141.96401 -136.57582 5.38820 2.36819 -135.61581 743.30408
6000.0000 -140.89138 -135.21351 5.67787 2.32757 -136.22443 710.83283
FREEZING PROCESS: loop number 25 T-loop= 694.00000000000000
main_MD> interactions number 25 at Temperature= 694.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.29052 -0.69735 -0.00821
force_rgl> df(natom) -1.00761 2.21428 0.14522
6005.0000 -140.42682 -134.74345 5.68337 2.45133 -134.37003 814.41260
6010.0000 -141.34124 -136.05881 5.28243 2.34793 -135.91932 735.98200
6015.0000 -141.98223 -136.31373 5.66851 2.31133 -136.46775 704.70556
6020.0000 -142.94952 -137.58067 5.36885 2.27016 -137.08464 677.24797
6025.0000 -141.83509 -135.79575 6.03934 2.29043 -136.78085 698.32791
6030.0000 -141.88529 -136.47662 5.40866 2.32342 -136.28654 710.18327
6035.0000 -141.64641 -136.47018 5.17623 2.30449 -136.57028 680.29769
6040.0000 -141.61912 -136.85951 4.75961 2.27401 -137.02690 678.82903
6045.0000 -142.57883 -137.22557 5.35325 2.28243 -136.90081 719.10375
6050.0000 -142.52279 -137.78149 4.74131 2.28272 -136.89640 694.61851
6055.0000 -142.18882 -137.87158 4.31724 2.22349 -137.78390 676.65925
6060.0000 -141.50044 -136.87128 4.62916 2.21532 -137.90636 635.05129
6065.0000 -142.32299 -136.28467 6.03832 2.30712 -136.53079 683.03400
6070.0000 -141.43754 -136.95191 4.48563 2.33912 -136.05131 709.60170
6075.0000 -142.03447 -136.47959 5.55489 2.29931 -136.64792 724.33925
6080.0000 -141.76809 -136.65813 5.10995 2.34217 -136.00559 731.84275
6085.0000 -141.24647 -136.52802 4.71846 2.32989 -136.18970 727.94513
6090.0000 -142.45643 -137.02736 5.42907 2.26469 -137.16661 684.85737
6095.0000 -141.39318 -136.44907 4.94411 2.25618 -137.29414 671.91263
6100.0000 -141.08289 -135.59547 5.48741 2.35012 -135.88651 733.24741
6105.0000 -141.22964 -135.23721 5.99243 2.28613 -136.84528 685.96643
6110.0000 -142.20164 -137.57285 4.62879 2.28824 -136.81375 665.56446
6115.0000 -141.08840 -135.27128 5.81711 2.30158 -136.61378 703.99467
6120.0000 -142.12855 -136.99086 5.13769 2.33889 -136.05483 726.93150
6125.0000 -143.32664 -137.57698 5.74966 2.28980 -136.79038 716.57969
6130.0000 -143.35920 -138.29772 5.06148 2.14487 -138.96188 615.08576
6135.0000 -141.21902 -136.82492 4.39411 2.21814 -137.86412 664.73203
6140.0000 -142.33660 -136.15885 6.17775 2.30740 -136.52660 708.80446
6145.0000 -142.95136 -136.68864 6.26272 2.32807 -136.21686 721.87273
6150.0000 -141.65156 -136.71975 4.93181 2.30646 -136.54071 718.12045
6155.0000 -142.19865 -136.97570 5.22294 2.28310 -136.89075 690.78875
6160.0000 -142.97440 -137.70841 5.26599 2.26601 -137.14676 708.71837
6165.0000 -141.73400 -137.62028 4.11372 2.22160 -137.81227 635.29009
6170.0000 -141.17783 -135.93179 5.24604 2.30958 -136.49400 696.78547
6175.0000 -142.29048 -136.81078 5.47970 2.32391 -136.27921 680.62062
6180.0000 -141.60287 -136.80279 4.80008 2.29719 -136.67960 693.67085
6185.0000 -142.85799 -138.36959 4.48839 2.26660 -137.13804 675.45834
6190.0000 -142.93754 -137.64029 5.29726 2.21458 -137.91741 640.57899
6195.0000 -142.64050 -137.10202 5.53848 2.27704 -136.98156 675.35596
6200.0000 -142.78652 -137.70072 5.08580 2.26499 -137.16212 694.57716
6205.0000 -141.78839 -137.53035 4.25804 2.25631 -137.29216 661.86975
6210.0000 -143.19730 -138.41619 4.78111 2.23748 -137.57423 633.02112
6215.0000 -142.51660 -137.30047 5.21613 2.20009 -138.13458 610.35466
6220.0000 -141.17712 -135.44352 5.73361 2.30918 -136.50000 698.50356
6225.0000 -142.38348 -138.17144 4.21203 2.29251 -136.74975 693.46591
6230.0000 -142.90237 -137.73952 5.16284 2.19402 -138.22546 626.70479
6235.0000 -140.95226 -136.17488 4.77738 2.26549 -137.15464 677.50074
6240.0000 -141.20185 -135.24810 5.95376 2.38457 -135.37032 749.83405
6245.0000 -140.79722 -135.81486 4.98237 2.37988 -135.44060 775.71173
6250.0000 -141.51662 -137.24383 4.27280 2.30654 -136.53952 687.09575
FREEZING PROCESS: loop number 26 T-loop= 669.00000000000000
main_MD> interactions number 26 at Temperature= 669.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.08096 -0.34381 0.10323
force_rgl> df(natom) 0.78745 -3.29345 -0.01547
6255.0000 -142.78826 -137.31520 5.47306 2.24410 -137.47512 650.47441
6260.0000 -142.80465 -137.90874 4.89591 2.22185 -137.80856 655.68802
6265.0000 -142.54381 -137.60943 4.93439 2.22909 -137.69994 664.95791
6270.0000 -142.74058 -137.41508 5.32550 2.24433 -137.47173 647.30610
6275.0000 -143.03598 -136.77642 6.25956 2.29027 -136.78333 672.41938
6280.0000 -142.53783 -138.67818 3.85965 2.21714 -137.87909 653.22618
6285.0000 -142.48600 -137.83263 4.65337 2.19482 -138.21354 615.84575
6290.0000 -142.82368 -138.17947 4.64422 2.19394 -138.22664 643.48912
6295.0000 -142.68773 -138.38199 4.30574 2.19986 -138.13795 641.80674
6300.0000 -142.53234 -138.48661 4.04573 2.17462 -138.51614 597.13832
6305.0000 -142.25814 -137.64947 4.60868 2.19232 -138.25099 618.47073
6310.0000 -141.95365 -138.17132 3.78233 2.23964 -137.54195 629.04913
6315.0000 -142.27662 -138.39052 3.88610 2.20187 -138.10783 597.28503
6320.0000 -141.79851 -136.94624 4.85227 2.23656 -137.58804 627.64128
6325.0000 -142.92133 -137.58338 5.33794 2.22360 -137.78233 652.39223
6330.0000 -141.59721 -136.13703 5.46018 2.28697 -136.83274 733.98025
6335.0000 -141.73854 -136.27883 5.45972 2.31961 -136.34366 721.81086
6340.0000 -142.21802 -137.40097 4.81705 2.28356 -136.88391 684.05378
6345.0000 -142.30778 -136.91121 5.39657 2.25497 -137.31217 627.05998
6350.0000 -142.66313 -138.27751 4.38561 2.23856 -137.55810 657.76026
6355.0000 -142.39629 -138.01301 4.38328 2.15727 -138.77607 568.19285
6360.0000 -141.60010 -136.34968 5.25042 2.28796 -136.81796 680.58230
6365.0000 -142.63162 -136.94335 5.68827 2.30086 -136.62463 686.25205
6370.0000 -143.15996 -138.30525 4.85471 2.21397 -137.92650 636.73844
6375.0000 -143.59478 -138.46217 5.13261 2.18960 -138.29166 616.71005
6380.0000 -143.06319 -138.47676 4.58643 2.17189 -138.55703 609.26316
6385.0000 -143.33342 -137.64978 5.68364 2.21507 -137.91003 627.73984
6390.0000 -142.58986 -138.09526 4.49460 2.24541 -137.45551 658.71415
6395.0000 -143.04752 -138.93107 4.11645 2.17173 -138.55947 621.79731
6400.0000 -143.14916 -138.05472 5.09444 2.20420 -138.07300 645.55484
6405.0000 -142.49544 -137.84748 4.64796 2.21258 -137.94741 619.15718
6410.0000 -141.90796 -137.12623 4.78173 2.22794 -137.71724 633.30973
6415.0000 -141.26260 -137.37052 3.89207 2.24766 -137.42183 665.10916
6420.0000 -142.61125 -137.44742 5.16383 2.25608 -137.29564 672.85691
6425.0000 -141.69954 -136.61892 5.08062 2.30531 -136.55796 697.17020
6430.0000 -142.33005 -137.08509 5.24496 2.29921 -136.64937 727.87510
6435.0000 -141.33710 -137.07044 4.26666 2.29594 -136.69841 692.57671
6440.0000 -141.00848 -136.03435 4.97413 2.31748 -136.37568 705.59228
6445.0000 -143.23080 -138.40328 4.82752 2.25458 -137.31810 662.73347
6450.0000 -143.35865 -137.74062 5.61802 2.19043 -138.27925 624.03263
6455.0000 -142.29272 -136.75143 5.54129 2.27205 -137.05631 701.58305
6460.0000 -140.65137 -135.60756 5.04381 2.31928 -136.34860 715.26958
6465.0000 -142.46008 -136.51929 5.94078 2.33554 -136.10496 704.13820
6470.0000 -142.28536 -137.70276 4.58260 2.30750 -136.52520 718.07877
6475.0000 -142.95305 -136.51518 6.43787 2.26970 -137.09146 677.70415
6480.0000 -141.93540 -137.06597 4.86942 2.29227 -136.75330 710.86648
6485.0000 -141.88413 -136.26282 5.62131 2.29512 -136.71067 678.26114
6490.0000 -142.89080 -137.28696 5.60384 2.28704 -136.83175 701.37898
6495.0000 -141.96059 -137.50913 4.45146 2.22620 -137.74339 634.61672
6500.0000 -141.88813 -137.09220 4.79593 2.26007 -137.23582 666.69991
FREEZING PROCESS: loop number 27 T-loop= 644.00000000000000
main_MD> interactions number 27 at Temperature= 644.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.03756 0.45020 0.06216
force_rgl> df(natom) -1.17237 -0.08048 0.64396
6505.0000 -143.29492 -137.40673 5.88820 2.27120 -137.06907 688.03282
6510.0000 -143.06549 -137.83974 5.22575 2.23360 -137.63250 661.19890
6515.0000 -142.11397 -138.13826 3.97570 2.25442 -137.32051 667.54468
6520.0000 -142.77963 -137.51755 5.26209 2.23036 -137.68103 656.00930
6525.0000 -141.97582 -137.31183 4.66399 2.22816 -137.71390 639.89926
6530.0000 -142.35179 -137.53687 4.81492 2.27267 -137.04706 654.21822
6535.0000 -142.49410 -137.10246 5.39163 2.24028 -137.53237 651.71680
6540.0000 -141.54358 -137.14289 4.40069 2.27883 -136.95479 671.27780
6545.0000 -142.89531 -137.98284 4.91247 2.25401 -137.32662 662.87404
6550.0000 -142.22642 -136.80442 5.42200 2.24519 -137.45875 670.72606
6555.0000 -142.84190 -137.96207 4.87983 2.25233 -137.35178 652.59450
6560.0000 -143.30175 -137.48286 5.81889 2.25949 -137.24445 669.34838
6565.0000 -141.76895 -136.80397 4.96498 2.29902 -136.65228 690.83267
6570.0000 -141.70289 -137.26334 4.43954 2.23391 -137.62778 654.95723
6575.0000 -142.93412 -138.65406 4.28006 2.18812 -138.31383 617.45983
6580.0000 -141.88204 -137.43845 4.44359 2.22429 -137.77199 633.86101
6585.0000 -141.98822 -137.71905 4.26917 2.25547 -137.30470 655.17323
6590.0000 -143.06065 -137.32341 5.73724 2.26449 -137.16959 671.07264
6595.0000 -142.34581 -137.42101 4.92480 2.26959 -137.09317 654.13966
6600.0000 -142.72624 -137.78375 4.94250 2.25972 -137.24100 661.30631
6605.0000 -142.83003 -138.25542 4.57461 2.19482 -138.21355 637.44114
6610.0000 -142.58956 -137.96531 4.62425 2.18657 -138.33714 617.98399
6615.0000 -142.03050 -137.59110 4.43941 2.21331 -137.93649 645.63611
6620.0000 -143.41173 -139.18533 4.22640 2.15862 -138.75585 569.42732
6625.0000 -143.14656 -139.09635 4.05022 2.15368 -138.82996 580.42475
6630.0000 -141.52104 -136.91309 4.60796 2.23161 -137.66230 639.25030
6635.0000 -142.24076 -138.23016 4.01060 2.21101 -137.97096 630.54866
6640.0000 -143.91253 -138.00286 5.90968 2.16534 -138.65528 620.68381
6645.0000 -141.43897 -136.71281 4.72616 2.26538 -137.15631 654.62235
6650.0000 -142.09379 -137.97766 4.11613 2.23463 -137.61704 647.34125
6655.0000 -142.23979 -137.68677 4.55302 2.20407 -138.07486 616.42101
6660.0000 -141.78000 -137.17504 4.60496 2.23493 -137.61255 636.47752
6665.0000 -141.70742 -137.04108 4.66634 2.25285 -137.34401 645.93409
6670.0000 -142.29594 -137.24928 5.04666 2.27466 -137.01721 673.87818
6675.0000 -142.44506 -138.53463 3.91043 2.22901 -137.70121 659.41421
6680.0000 -143.50976 -138.46831 5.04145 2.22003 -137.83582 652.46934
6685.0000 -142.25354 -136.96451 5.28903 2.21857 -137.85769 644.02875
6690.0000 -142.62999 -137.85219 4.77780 2.25670 -137.28635 674.59612
6695.0000 -141.46622 -136.61908 4.84714 2.23902 -137.55128 668.91859
6700.0000 -143.11629 -138.92523 4.19106 2.24708 -137.43040 632.27611
6705.0000 -143.04098 -139.18520 3.85578 2.16631 -138.64075 585.76840
6710.0000 -142.62884 -137.94606 4.68278 2.17814 -138.46346 606.05017
6715.0000 -142.04062 -136.85585 5.18476 2.23832 -137.56166 642.88985
6720.0000 -141.70955 -136.81522 4.89433 2.30663 -136.53819 687.05838
6725.0000 -142.07725 -137.64712 4.43013 2.29274 -136.74637 684.53487
6730.0000 -143.50615 -138.99392 4.51224 2.18742 -138.32434 608.08238
6735.0000 -142.43081 -138.00163 4.42919 2.16167 -138.71016 598.39750
6740.0000 -143.15645 -138.89020 4.26625 2.17904 -138.44998 627.37477
6745.0000 -143.82083 -139.12788 4.69296 2.12263 -139.29525 604.68609
6750.0000 -143.09115 -137.64243 5.44872 2.19308 -138.23960 649.31485
FREEZING PROCESS: loop number 28 T-loop= 619.00000000000000
main_MD> interactions number 28 at Temperature= 619.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.63758 4.73520 -1.39513
force_rgl> df(natom) 0.31551 -0.77831 0.29251
6755.0000 -142.22561 -137.07436 5.15125 2.23372 -137.63067 658.88379
6760.0000 -142.51671 -137.15427 5.36243 2.23732 -137.57671 647.76329
6765.0000 -142.91623 -139.38138 3.53485 2.22131 -137.81664 628.07226
6770.0000 -143.79668 -139.12511 4.67158 2.11339 -139.43364 555.54210
6775.0000 -142.93363 -138.03762 4.89602 2.16383 -138.67792 590.41343
6780.0000 -143.01947 -138.45093 4.56854 2.19486 -138.21291 624.63295
6785.0000 -142.22896 -137.42234 4.80661 2.20931 -137.99643 646.88627
6790.0000 -142.41856 -137.62296 4.79560 2.23074 -137.67522 640.40668
6795.0000 -142.07331 -137.38882 4.68449 2.22605 -137.74561 632.46336
6800.0000 -141.82901 -137.44689 4.38212 2.27222 -137.05372 663.24432
6805.0000 -142.18087 -137.25710 4.92377 2.28960 -136.79340 700.41195
6810.0000 -142.34123 -136.86870 5.47253 2.24741 -137.42545 658.10604
6815.0000 -143.00424 -137.53206 5.47218 2.26128 -137.21768 659.99621
6820.0000 -142.89988 -137.77755 5.12233 2.22340 -137.78528 628.82944
6825.0000 -143.60132 -138.43971 5.16161 2.16760 -138.62140 578.44421
6830.0000 -144.00605 -140.58927 3.41678 2.11217 -139.45192 560.45709
6835.0000 -143.66469 -139.47536 4.18933 2.05009 -140.38204 510.24156
6840.0000 -143.02906 -138.74530 4.28376 2.11786 -139.36671 562.35174
6845.0000 -143.76301 -139.73638 4.02664 2.10531 -139.55477 544.42981
6850.0000 -142.40310 -138.39886 4.00424 2.13238 -139.14916 573.92770
6855.0000 -143.59727 -138.95008 4.64720 2.14275 -138.99370 571.13970
6860.0000 -143.76746 -139.80415 3.96332 2.13822 -139.06158 565.44029
6865.0000 -144.54030 -140.93364 3.60667 2.05534 -140.30342 527.19339
6870.0000 -144.03147 -140.32523 3.70624 2.06281 -140.19144 524.75123
6875.0000 -143.72887 -139.19385 4.53501 2.10174 -139.60825 535.87583
6880.0000 -144.27672 -139.18352 5.09320 2.12605 -139.24392 583.65307
6885.0000 -143.00688 -139.33067 3.67621 2.14785 -138.91725 582.97526
6890.0000 -142.90683 -139.57139 3.33545 2.13068 -139.17450 556.20318
6895.0000 -143.78228 -139.85893 3.92335 2.11255 -139.44625 533.57587
6900.0000 -143.31626 -139.48457 3.83169 2.10347 -139.58230 541.35166
6905.0000 -142.39280 -137.73873 4.65407 2.18731 -138.32599 605.49647
6910.0000 -143.34353 -138.66064 4.68289 2.21910 -137.84968 664.28679
6915.0000 -142.97647 -138.79580 4.18067 2.17637 -138.48997 600.42420
6920.0000 -143.91871 -139.40702 4.51169 2.15581 -138.79802 595.65067
6925.0000 -144.89343 -140.72236 4.17107 2.03223 -140.64970 513.69539
6930.0000 -142.82879 -137.97725 4.85154 2.13237 -139.14923 594.87014
6935.0000 -143.30018 -138.56104 4.73914 2.19989 -138.13749 616.62746
6940.0000 -142.28715 -137.73190 4.55525 2.19864 -138.15631 620.10422
6945.0000 -142.98527 -138.18569 4.79958 2.23508 -137.61032 632.26782
6950.0000 -142.33304 -137.64833 4.68471 2.21086 -137.97313 620.50919
6955.0000 -142.21902 -138.53506 3.68396 2.23895 -137.55230 633.63650
6960.0000 -143.84324 -139.08913 4.75411 2.12710 -139.22823 571.14685
6965.0000 -141.90852 -137.30875 4.59977 2.18453 -138.36768 607.29004
6970.0000 -144.03467 -139.20422 4.83045 2.17537 -138.50490 602.64106
6975.0000 -144.08515 -139.61167 4.47347 2.13513 -139.10786 591.61411
6980.0000 -143.11010 -138.77785 4.33226 2.11440 -139.41848 571.80993
6985.0000 -143.45106 -138.55838 4.89268 2.16735 -138.62511 618.22724
6990.0000 -143.76411 -138.90941 4.85470 2.18807 -138.31470 624.22890
6995.0000 -143.11970 -138.36136 4.75834 2.16800 -138.61540 619.84099
7000.0000 -142.30532 -137.41772 4.88760 2.19506 -138.20998 628.86937
FREEZING PROCESS: loop number 29 T-loop= 594.00000000000000
main_MD> interactions number 29 at Temperature= 594.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.46773 2.55624 -1.83328
force_rgl> df(natom) 3.03283 -0.91029 -0.76061
7005.0000 -142.76166 -138.01375 4.74791 2.22510 -137.75985 631.67069
7010.0000 -142.34178 -137.74008 4.60169 2.20987 -137.98807 603.06223
7015.0000 -143.31901 -138.81853 4.50048 2.21389 -137.92783 630.25953
7020.0000 -143.93644 -139.90689 4.02955 2.11094 -139.47031 542.87227
7025.0000 -143.92113 -139.16704 4.75409 2.10424 -139.57078 547.05499
7030.0000 -144.10579 -139.31860 4.78720 2.14983 -138.88765 584.79442
7035.0000 -143.41306 -138.84234 4.57071 2.16467 -138.66524 601.37813
7040.0000 -142.76707 -137.80859 4.95849 2.16692 -138.63158 588.77315
7045.0000 -142.52371 -137.46365 5.06006 2.23720 -137.57847 659.18998
7050.0000 -144.11758 -139.80671 4.31087 2.16975 -138.58921 608.49085
7055.0000 -143.49460 -138.11011 5.38449 2.13571 -139.09927 573.79142
7060.0000 -142.69281 -137.93258 4.76023 2.24905 -137.40101 668.64677
7065.0000 -141.88596 -136.94994 4.93602 2.23238 -137.65073 651.78717
7070.0000 -142.57162 -136.82802 5.74360 2.29375 -136.73124 691.99654
7075.0000 -142.11481 -137.36127 4.75355 2.23957 -137.54292 623.66190
7080.0000 -142.38502 -137.37066 5.01437 2.25635 -137.29151 666.95322
7085.0000 -142.42023 -137.69462 4.72561 2.23434 -137.62142 631.93351
7090.0000 -142.36729 -137.93501 4.43228 2.23355 -137.63321 653.55266
7095.0000 -143.33019 -138.46664 4.86355 2.20612 -138.04413 654.04344
7100.0000 -143.67893 -139.53946 4.13947 2.15143 -138.86360 578.87604
7105.0000 -143.63852 -138.90738 4.73115 2.14873 -138.90410 612.16417
7110.0000 -143.41367 -138.52362 4.89005 2.17597 -138.49594 630.13046
7115.0000 -142.64657 -137.88288 4.76369 2.16707 -138.62923 649.16759
7120.0000 -143.42431 -138.78588 4.63842 2.19516 -138.20846 628.48412
7125.0000 -142.89890 -138.25613 4.64277 2.17363 -138.53107 638.81071
7130.0000 -142.90049 -138.55863 4.34186 2.14932 -138.89522 591.85966
7135.0000 -143.24687 -138.34952 4.89735 2.18885 -138.30299 627.14392
7140.0000 -144.57380 -140.08616 4.48763 2.13182 -139.15747 598.47157
7145.0000 -144.36876 -139.65508 4.71368 2.07588 -139.99567 573.92317
7150.0000 -144.58523 -140.12151 4.46372 2.05012 -140.38169 555.12914
7155.0000 -143.92229 -139.39717 4.52513 2.11452 -139.41673 608.73334
7160.0000 -143.73063 -138.82918 4.90145 2.14266 -138.99510 617.84751
7165.0000 -143.75626 -138.76220 4.99405 2.13736 -139.07452 582.41618
7170.0000 -143.91415 -138.91037 5.00378 2.11722 -139.37628 560.45015
7175.0000 -143.69084 -139.36038 4.33045 2.16175 -138.70897 607.76665
7180.0000 -142.70455 -137.99010 4.71445 2.12580 -139.24767 579.32543
7185.0000 -142.39957 -136.97643 5.42314 2.20526 -138.05703 630.21037
7190.0000 -142.66662 -137.45765 5.20898 2.24197 -137.50704 666.15523
7195.0000 -143.08950 -139.51281 3.57669 2.18349 -138.38322 610.82830
7200.0000 -143.78521 -138.98758 4.79763 2.09539 -139.70328 548.56452
7205.0000 -144.41123 -139.97542 4.43580 2.14253 -138.99695 594.57191
7210.0000 -143.70654 -139.02570 4.68083 2.11601 -139.39440 593.79723
7215.0000 -143.81122 -139.65441 4.15681 2.08575 -139.84780 546.05162
7220.0000 -144.34613 -140.10404 4.24209 2.04870 -140.40289 540.43734
7225.0000 -143.30406 -138.75388 4.55018 2.14622 -138.94170 609.45593
7230.0000 -143.68680 -139.58654 4.10027 2.13085 -139.17205 586.21954
7235.0000 -143.49076 -139.45804 4.03272 2.12080 -139.32253 574.42049
7240.0000 -143.35461 -139.37105 3.98355 2.12347 -139.28254 585.92860
7245.0000 -143.13549 -138.90078 4.23471 2.13751 -139.07227 599.60773
7250.0000 -143.27184 -138.85294 4.41890 2.13751 -139.07225 595.78204
FREEZING PROCESS: loop number 30 T-loop= 569.00000000000000
main_MD> interactions number 30 at Temperature= 569.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.45854 -1.48403 -2.14894
force_rgl> df(natom) -1.86784 0.17678 -1.01131
7255.0000 -143.43659 -139.83461 3.60198 2.16754 -138.62227 601.07284
7260.0000 -143.59166 -139.46225 4.12942 2.10368 -139.57911 557.47930
7265.0000 -142.98120 -138.81831 4.16289 2.11780 -139.36761 560.68785
7270.0000 -143.66420 -139.76872 3.89547 2.12003 -139.33408 558.66419
7275.0000 -144.27631 -140.02968 4.24663 2.10807 -139.51331 554.31627
7280.0000 -144.39777 -140.86009 3.53768 2.05981 -140.23644 538.45737
7285.0000 -144.47976 -140.82138 3.65839 2.02146 -140.81113 501.70500
7290.0000 -144.33964 -140.36719 3.97245 2.05847 -140.25659 520.04179
7295.0000 -143.61869 -139.71048 3.90820 2.10132 -139.61449 557.95058
7300.0000 -144.37900 -140.20731 4.17169 2.07243 -140.04740 554.55175
7305.0000 -144.62056 -140.75236 3.86821 2.02671 -140.73239 511.81061
7310.0000 -144.89840 -140.72883 4.16956 2.06314 -140.18650 521.67345
7315.0000 -144.62637 -140.27648 4.34989 2.00816 -141.01037 497.60719
7320.0000 -144.76990 -140.85025 3.91964 2.03627 -140.58922 516.86398
7325.0000 -144.05219 -140.59704 3.45515 2.04543 -140.45187 525.04391
7330.0000 -143.86324 -139.48689 4.37636 2.04572 -140.44758 522.52723
7335.0000 -143.29026 -138.82020 4.47005 2.12936 -139.19437 549.39423
7340.0000 -143.22989 -138.90720 4.32269 2.15330 -138.83568 589.27981
7345.0000 -143.74294 -139.29584 4.44711 2.14414 -138.97294 590.99163
7350.0000 -143.50188 -138.08429 5.41759 2.13847 -139.05781 568.76946
7355.0000 -144.11511 -138.54552 5.56960 2.20012 -138.13409 626.19892
7360.0000 -142.92865 -139.15289 3.77576 2.13654 -139.08673 581.49745
7365.0000 -143.21624 -139.55513 3.66111 2.14564 -138.95035 603.26167
7370.0000 -143.38561 -139.36659 4.01902 2.10451 -139.56665 545.01171
7375.0000 -143.64540 -139.85753 3.78787 2.08846 -139.80722 530.94933
7380.0000 -143.34437 -139.40635 3.93802 2.08714 -139.82698 521.49543
7385.0000 -143.26114 -139.56577 3.69537 2.10872 -139.50359 542.12843
7390.0000 -143.69788 -139.52766 4.17022 2.09198 -139.75449 556.15558
7395.0000 -142.59330 -138.17798 4.41532 2.16444 -138.66877 590.77388
7400.0000 -142.75614 -137.23231 5.52383 2.20556 -138.05251 640.66011
7405.0000 -143.77212 -139.30159 4.47054 2.18603 -138.34526 615.00770
7410.0000 -144.05960 -138.72559 5.33401 2.13893 -139.05098 576.74215
7415.0000 -143.36162 -138.49981 4.86181 2.18657 -138.33709 642.17623
7420.0000 -142.92825 -138.18816 4.74009 2.16228 -138.70112 633.73551
7425.0000 -143.82264 -140.06799 3.75465 2.12109 -139.31829 595.62576
7430.0000 -143.92872 -139.85800 4.07072 2.08048 -139.92670 540.90769
7435.0000 -142.50055 -138.54972 3.95083 2.10331 -139.58469 559.76384
7440.0000 -143.92238 -139.75535 4.16703 2.13924 -139.04629 578.15149
7445.0000 -144.06203 -139.07092 4.99110 2.11255 -139.44616 562.84335
7450.0000 -143.63973 -139.52952 4.11021 2.10216 -139.60192 550.41188
7455.0000 -144.17130 -140.44592 3.72538 2.12023 -139.33112 575.45840
7460.0000 -144.51929 -140.75509 3.76420 2.05072 -140.37270 530.00415
7465.0000 -143.62494 -139.21745 4.40749 2.08243 -139.89754 562.01334
7470.0000 -144.25354 -139.70585 4.54769 2.13696 -139.08043 611.44345
7475.0000 -144.41291 -140.96882 3.44409 2.02559 -140.74924 519.96584
7480.0000 -145.11476 -141.10005 4.01471 2.00027 -141.12862 514.97569
7485.0000 -143.79770 -139.68543 4.11227 2.05746 -140.27160 570.21114
7490.0000 -145.10149 -140.51631 4.58518 2.08119 -139.91617 590.76021
7495.0000 -143.55666 -140.01987 3.53679 2.05944 -140.24206 561.65200
7500.0000 -144.49888 -139.71579 4.78309 2.07763 -139.96938 600.21067
FREEZING PROCESS: loop number 31 T-loop= 544.00000000000000
main_MD> interactions number 31 at Temperature= 544.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 3.09273 -3.04290 2.78377
force_rgl> df(natom) -2.19226 -1.41544 -2.66092
7505.0000 -144.50473 -139.33966 5.16507 2.09826 -139.66039 594.42110
7510.0000 -144.58516 -140.17145 4.41371 2.07587 -139.99579 604.81556
7515.0000 -144.80933 -140.39126 4.41806 2.06715 -140.12643 620.58195
7520.0000 -145.98923 -142.00441 3.98482 1.97931 -141.44260 529.86509
7525.0000 -145.36403 -141.11219 4.25183 1.97585 -141.49451 516.89464
7530.0000 -145.78419 -142.02751 3.75668 1.96218 -141.69933 523.88008
7535.0000 -145.66501 -141.09597 4.56904 1.98504 -141.35683 542.66513
7540.0000 -145.96232 -141.08388 4.87844 2.01711 -140.87626 579.56162
7545.0000 -145.42544 -140.94703 4.47841 1.98831 -141.30783 534.35865
7550.0000 -144.43783 -141.13147 3.30636 1.99602 -141.19229 516.37064
7555.0000 -145.28440 -141.83208 3.45232 1.98500 -141.35741 501.62104
7560.0000 -143.95630 -140.57045 3.38586 1.99996 -141.13326 509.52713
7565.0000 -144.48504 -141.20742 3.27762 2.02555 -140.74976 494.25428
7570.0000 -144.62401 -140.40498 4.21904 2.03239 -140.64735 514.84970
7575.0000 -144.53631 -139.83481 4.70150 2.05378 -140.32679 548.45211
7580.0000 -144.86947 -140.86322 4.00625 2.07302 -140.03845 538.55311
7585.0000 -144.20495 -140.31992 3.88503 2.06158 -140.21000 561.38650
7590.0000 -144.87085 -141.33202 3.53883 2.01986 -140.83502 528.66715
7595.0000 -144.95626 -140.91337 4.04289 1.98034 -141.42724 496.10394
7600.0000 -144.63365 -140.27835 4.35529 2.06173 -140.20766 567.81996
7605.0000 -144.49657 -139.53786 4.95870 2.09007 -139.78307 594.33380
7610.0000 -143.88692 -139.36955 4.51737 2.11309 -139.43815 627.51298
7615.0000 -144.89002 -140.75061 4.13941 2.07052 -140.07598 576.67396
7620.0000 -145.17481 -141.57346 3.60135 2.01243 -140.94645 532.96992
7625.0000 -143.96558 -140.24835 3.71723 2.00292 -141.08886 514.56401
7630.0000 -144.02361 -140.28839 3.73523 2.06005 -140.23279 537.49514
7635.0000 -144.85377 -140.03848 4.81530 2.07373 -140.02786 558.55301
7640.0000 -143.60626 -139.84130 3.76496 2.07723 -139.97550 569.89160
7645.0000 -142.89612 -138.19369 4.70243 2.13515 -139.10754 588.23081
7650.0000 -143.48564 -139.30054 4.18510 2.16536 -138.65489 584.90770
7655.0000 -144.30941 -139.63051 4.67890 2.13365 -139.13012 584.46771
7660.0000 -143.20994 -139.10088 4.10906 2.10566 -139.54943 576.61317
7665.0000 -144.01857 -139.97980 4.03877 2.09025 -139.78040 591.59576
7670.0000 -144.44061 -140.52973 3.91089 2.09227 -139.75006 603.13955
7675.0000 -144.64150 -140.63995 4.00155 2.05409 -140.32210 566.19100
7680.0000 -145.67265 -141.88980 3.78285 1.99248 -141.24530 511.87706
7685.0000 -144.71501 -139.64459 5.07042 2.03957 -140.53978 558.04670
7690.0000 -144.87885 -140.83853 4.04033 2.04792 -140.41457 561.32568
7695.0000 -145.74630 -141.78333 3.96298 1.97408 -141.52106 507.74388
7700.0000 -145.06800 -141.61276 3.45523 1.98244 -141.39573 518.01961
7705.0000 -144.86820 -140.79117 4.07704 1.98746 -141.32057 521.16194
7710.0000 -144.91631 -140.15479 4.76152 2.05719 -140.27567 553.51677
7715.0000 -143.65181 -140.44951 3.20230 2.05700 -140.27851 544.15073
7720.0000 -144.26023 -140.37600 3.88424 2.07677 -139.98226 552.37432
7725.0000 -144.61269 -140.72629 3.88640 2.04405 -140.47257 522.27403
7730.0000 -144.78305 -140.43018 4.35288 2.04918 -140.39575 544.79720
7735.0000 -144.29933 -140.30974 3.98959 2.03277 -140.64155 508.85292
7740.0000 -144.25344 -139.99953 4.25391 2.05797 -140.26398 512.98225
7745.0000 -144.15225 -140.40814 3.74410 2.07000 -140.08383 535.42718
7750.0000 -143.14432 -138.81776 4.32656 2.08573 -139.84810 549.73725
FREEZING PROCESS: loop number 32 T-loop= 519.00000000000000
main_MD> interactions number 32 at Temperature= 519.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.99386 5.20559 -2.69719
force_rgl> df(natom) -1.10211 0.44841 -1.60293
7755.0000 -142.98977 -138.81316 4.17661 2.15682 -138.78283 591.27745
7760.0000 -143.94408 -139.81381 4.13027 2.11332 -139.43470 557.72578
7765.0000 -144.11564 -140.43089 3.68475 2.08735 -139.82376 538.68042
7770.0000 -144.52222 -140.16721 4.35501 2.07033 -140.07880 543.88149
7775.0000 -143.85678 -140.13001 3.72677 2.06249 -140.19631 532.41732
7780.0000 -144.63777 -141.13884 3.49893 2.05063 -140.37396 524.09750
7785.0000 -145.04532 -141.22161 3.82371 2.00645 -141.03604 484.44653
7790.0000 -145.04037 -140.69488 4.34548 2.01967 -140.83791 511.68324
7795.0000 -144.00213 -140.57205 3.43008 2.03002 -140.68278 512.32822
7800.0000 -144.31840 -140.55832 3.76008 2.03372 -140.62743 519.33677
7805.0000 -144.03458 -139.77114 4.26344 2.04533 -140.45339 551.63884
7810.0000 -143.80272 -139.65548 4.14723 2.07799 -139.96412 569.47785
7815.0000 -143.70326 -139.94087 3.76239 2.08986 -139.78616 554.59170
7820.0000 -144.46277 -140.82350 3.63928 2.03197 -140.65355 497.69930
7825.0000 -143.43950 -139.85286 3.58664 2.04564 -140.44876 514.06896
7830.0000 -144.35877 -140.36177 3.99700 2.09260 -139.74514 557.38577
7835.0000 -145.18055 -141.21354 3.96701 2.01947 -140.84090 538.79285
7840.0000 -145.09208 -141.41393 3.67815 1.99480 -141.21052 507.09752
7845.0000 -145.12356 -141.66917 3.45439 1.99831 -141.15791 524.00136
7850.0000 -145.94961 -142.25194 3.69767 1.92989 -142.18320 471.35902
7855.0000 -145.29450 -142.08906 3.20544 1.89829 -142.65658 446.85804
7860.0000 -145.11028 -141.09001 4.02027 1.95410 -141.82033 488.34168
7865.0000 -145.62977 -141.84070 3.78906 1.98544 -141.35084 535.39544
7870.0000 -145.37154 -141.48495 3.88659 1.96331 -141.68241 489.13391
7875.0000 -144.83810 -141.31996 3.51813 1.98267 -141.39233 505.00356
7880.0000 -144.94832 -141.31877 3.62955 1.99963 -141.13815 502.65633
7885.0000 -145.28345 -142.06411 3.21934 1.97369 -141.52687 497.79829
7890.0000 -145.94262 -142.44875 3.49387 1.92908 -142.19532 447.30858
7895.0000 -144.18530 -140.78334 3.40196 1.98860 -141.30343 494.20767
7900.0000 -144.61160 -141.34728 3.26432 2.00706 -141.02677 506.13330
7905.0000 -145.27084 -141.68927 3.58157 1.98081 -141.42020 497.59345
7910.0000 -144.53082 -140.55884 3.97199 2.03882 -140.55100 532.13744
7915.0000 -144.33696 -140.83097 3.50598 2.02205 -140.80225 525.34296
7920.0000 -143.78691 -139.90982 3.87709 2.05301 -140.33839 556.31588
7925.0000 -145.54424 -141.33786 4.20638 2.03449 -140.61587 518.18106
7930.0000 -144.93660 -140.61795 4.31865 2.00227 -141.09861 514.04670
7935.0000 -145.13650 -141.27703 3.85947 1.98134 -141.41226 516.69070
7940.0000 -145.57157 -141.28195 4.28963 2.00451 -141.06500 505.65934
7945.0000 -145.24175 -141.48719 3.75457 1.98506 -141.35651 504.17470
7950.0000 -145.28998 -141.11910 4.17088 1.96554 -141.64900 506.57602
7955.0000 -144.90683 -141.31945 3.58738 2.00337 -141.08217 528.66497
7960.0000 -144.09951 -140.15027 3.94924 2.04439 -140.46744 558.57931
7965.0000 -143.89686 -140.25859 3.63827 2.05653 -140.28556 535.13247
7970.0000 -144.03416 -139.79306 4.24110 2.10263 -139.59491 556.23773
7975.0000 -143.24797 -140.05715 3.19082 2.08474 -139.86287 516.85465
7980.0000 -143.95096 -139.44425 4.50671 2.10627 -139.54030 551.00842
7985.0000 -144.36879 -140.34081 4.02798 2.07827 -139.95989 528.33933
7990.0000 -143.50852 -139.77666 3.73186 2.09546 -139.70226 561.49554
7995.0000 -144.99257 -140.83907 4.15350 2.03740 -140.57230 526.87272
8000.0000 -145.16983 -141.60344 3.56639 1.99591 -141.19398 507.99578
FREEZING PROCESS: loop number 33 T-loop= 494.00000000000000
main_MD> interactions number 33 at Temperature= 494.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.03410 0.58810 -0.00413
force_rgl> df(natom) -1.57046 3.75751 -0.89831
8005.0000 -144.95670 -141.26908 3.68763 1.97205 -141.55148 457.54427
8010.0000 -144.40374 -140.80443 3.59931 2.00568 -141.04750 490.60215
8015.0000 -143.80835 -139.90371 3.90464 2.07257 -140.04530 526.57076
8020.0000 -144.40996 -140.39822 4.01174 2.06840 -140.10775 537.53121
8025.0000 -144.72961 -140.33238 4.39723 2.05888 -140.25033 550.88259
8030.0000 -143.69182 -139.57647 4.11535 2.07499 -140.00902 551.92452
8035.0000 -143.65601 -139.59000 4.06600 2.06964 -140.08921 533.97587
8040.0000 -143.64509 -139.88772 3.75737 2.08923 -139.79563 554.19057
8045.0000 -144.82420 -141.17789 3.64630 2.05395 -140.32430 525.34128
8050.0000 -144.93463 -141.39394 3.54070 1.99806 -141.16169 475.31031
8055.0000 -145.17374 -141.37238 3.80136 1.98065 -141.42249 471.36857
8060.0000 -144.87440 -140.78923 4.08517 2.01003 -140.98240 492.09303
8065.0000 -143.65890 -140.23956 3.41934 2.04186 -140.50539 514.56690
8070.0000 -144.85703 -141.26499 3.59204 2.03032 -140.67834 485.25130
8075.0000 -144.13344 -140.52235 3.61108 2.04766 -140.41846 507.37671
8080.0000 -144.49294 -140.71546 3.77748 2.06349 -140.18132 523.75496
8085.0000 -144.42393 -140.05679 4.36714 2.05621 -140.29043 514.29009
8090.0000 -144.27008 -139.65424 4.61583 2.05060 -140.37447 504.18341
8095.0000 -144.38496 -140.35912 4.02584 2.07229 -140.04951 524.73672
8100.0000 -145.09797 -141.35590 3.74207 2.00755 -141.01950 488.65095
8105.0000 -144.86583 -141.25634 3.60949 1.97799 -141.46242 460.11363
8110.0000 -144.51909 -140.44845 4.07064 2.04619 -140.44055 504.82145
8115.0000 -144.90091 -140.87195 4.02896 2.03708 -140.57700 515.97720
8120.0000 -144.73154 -141.30378 3.42776 1.98715 -141.32513 472.66724
8125.0000 -143.37048 -139.17551 4.19498 2.06943 -140.09233 528.91488
8130.0000 -143.67969 -139.92391 3.75578 2.11365 -139.42974 571.85723
8135.0000 -144.51266 -140.12594 4.38672 2.08703 -139.82853 555.92155
8140.0000 -144.52279 -140.46090 4.06189 2.05688 -140.28037 546.13222
8145.0000 -145.18035 -141.39089 3.78946 2.00964 -140.98821 518.09181
8150.0000 -144.72088 -140.80672 3.91416 1.97888 -141.44915 482.07756
8155.0000 -145.49037 -141.29751 4.19286 2.01422 -140.91963 526.23236
8160.0000 -145.76776 -142.09466 3.67310 1.97719 -141.47445 481.12356
8165.0000 -145.73003 -142.19411 3.53592 1.93286 -142.13859 455.95835
8170.0000 -144.95988 -140.74554 4.21434 1.97087 -141.56906 498.43377
8175.0000 -144.92374 -140.96595 3.95779 1.99164 -141.25795 497.35110
8180.0000 -145.52197 -142.18278 3.33918 1.98986 -141.28457 513.60344
8185.0000 -145.34413 -141.62962 3.71451 1.93700 -142.07664 481.11695
8190.0000 -146.47711 -142.44467 4.03244 1.93679 -142.07976 453.50597
8195.0000 -145.92547 -142.01336 3.91210 1.92620 -142.23849 464.31599
8200.0000 -145.66126 -142.69769 2.96356 1.89596 -142.69157 444.84986
8205.0000 -146.24309 -143.08838 3.15471 1.87160 -143.05655 422.95413
8210.0000 -145.86580 -142.56960 3.29620 1.88519 -142.85295 436.79896
8215.0000 -145.95131 -142.50663 3.44468 1.90189 -142.60275 459.07831
8220.0000 -145.82691 -142.13491 3.69200 1.92411 -142.26974 503.75680
8225.0000 -145.26946 -141.94933 3.32012 1.92864 -142.20185 500.98039
8230.0000 -146.01600 -142.90752 3.10847 1.90090 -142.61750 453.15290
8235.0000 -145.65284 -141.59428 4.05857 1.92113 -142.31443 468.55753
8240.0000 -145.37943 -142.12133 3.25809 1.95276 -141.84045 498.77159
8245.0000 -145.59489 -142.27757 3.31732 1.89826 -142.65702 443.99571
8250.0000 -145.88812 -141.51347 4.37465 1.98153 -141.40936 517.57501
FREEZING PROCESS: loop number 34 T-loop= 469.00000000000000
main_MD> interactions number 34 at Temperature= 469.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.47225 -0.20276 -3.05880
force_rgl> df(natom) -0.35401 1.04302 2.34409
8255.0000 -145.80573 -142.70829 3.09745 1.94781 -141.91461 474.76370
8260.0000 -146.28145 -142.91379 3.36766 1.88990 -142.78233 431.83249
8265.0000 -144.68337 -141.71916 2.96421 1.93307 -142.13544 454.13940
8270.0000 -145.73888 -141.86034 3.87854 1.96560 -141.64808 490.79735
8275.0000 -145.29793 -142.72073 2.57719 1.90158 -142.60726 445.82170
8280.0000 -145.34467 -141.96376 3.38092 1.93821 -142.05854 482.07098
8285.0000 -145.60837 -141.96590 3.64247 1.91744 -142.36968 462.50131
8290.0000 -145.80349 -142.64233 3.16116 1.91930 -142.34181 462.64655
8295.0000 -145.96937 -142.56556 3.40381 1.90019 -142.62812 446.93888
8300.0000 -145.73562 -142.45176 3.28386 1.92488 -142.25824 467.87705
8305.0000 -146.64574 -143.43704 3.20869 1.89732 -142.67115 469.89773
8310.0000 -146.45336 -142.77900 3.67436 1.88000 -142.93071 451.89792
8315.0000 -146.16600 -142.69136 3.47464 1.89219 -142.74798 465.67520
8320.0000 -146.21827 -142.49819 3.72009 1.87165 -143.05580 448.70455
8325.0000 -146.41746 -143.04966 3.36780 1.91784 -142.36375 488.43588
8330.0000 -145.77320 -142.52683 3.24637 1.89183 -142.75348 470.24762
8335.0000 -145.80605 -142.16186 3.64420 1.92361 -142.27719 497.47067
8340.0000 -145.96915 -142.64522 3.32393 1.93494 -142.10748 473.30940
8345.0000 -145.50001 -141.96436 3.53565 1.88872 -142.80002 443.47420
8350.0000 -145.88076 -142.67213 3.20863 1.92490 -142.25789 467.48102
8355.0000 -144.95668 -141.16053 3.79614 1.92533 -142.25147 471.56097
8360.0000 -145.95960 -141.77230 4.18730 1.99010 -141.28089 534.90015
8365.0000 -145.34180 -141.73041 3.61139 1.96506 -141.65619 500.61847
8370.0000 -146.09473 -142.98912 3.10561 1.92293 -142.28748 470.12936
8375.0000 -145.79639 -142.16939 3.62701 1.88772 -142.81492 439.97491
8380.0000 -146.13864 -142.51823 3.62041 1.93068 -142.17123 475.42784
8385.0000 -145.86552 -142.84632 3.01921 1.90258 -142.59235 438.75200
8390.0000 -145.91388 -142.41927 3.49461 1.91308 -142.43501 448.36478
8395.0000 -146.64065 -142.88063 3.76002 1.89299 -142.73599 439.81742
8400.0000 -146.07231 -142.91530 3.15701 1.88226 -142.89675 443.12157
8405.0000 -146.12671 -142.16180 3.96491 1.89225 -142.74719 448.09276
8410.0000 -145.97643 -142.94100 3.03543 1.90142 -142.60978 454.16621
8415.0000 -145.51547 -141.99111 3.52436 1.91572 -142.39548 454.20134
8420.0000 -145.58994 -141.66244 3.92749 1.93244 -142.14486 469.59444
8425.0000 -144.44576 -140.84696 3.59880 1.98064 -141.42275 495.76920
8430.0000 -144.67500 -141.09363 3.58137 2.00486 -141.05980 510.83669
8435.0000 -145.66756 -142.39988 3.26768 1.97627 -141.48818 495.75450
8440.0000 -145.56863 -141.92777 3.64086 1.95982 -141.73463 482.93911
8445.0000 -146.31436 -142.30945 4.00492 1.95056 -141.87347 481.02922
8450.0000 -145.86967 -142.30086 3.56881 1.91389 -142.42282 453.38277
8455.0000 -145.25598 -141.30201 3.95397 1.97977 -141.43570 517.43291
8460.0000 -145.00893 -141.79071 3.21821 1.94177 -142.00506 474.22659
8465.0000 -145.59537 -141.49991 4.09546 1.97198 -141.55242 510.43143
8470.0000 -145.81575 -141.66412 4.15164 1.96728 -141.62287 507.19278
8475.0000 -145.03830 -141.42895 3.60935 1.98332 -141.38259 520.30388
8480.0000 -145.33578 -141.99186 3.34392 1.98064 -141.42276 509.37156
8485.0000 -145.90458 -142.65546 3.24913 1.92326 -142.28250 466.00919
8490.0000 -144.76564 -141.17274 3.59290 1.93704 -142.07595 483.29304
8495.0000 -145.10764 -141.27800 3.82965 1.99746 -141.17072 528.22494
8500.0000 -145.69020 -141.42333 4.26687 1.96951 -141.58947 513.42405
FREEZING PROCESS: loop number 35 T-loop= 444.00000000000000
main_MD> interactions number 35 at Temperature= 444.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.61846 -1.51872 2.00281
force_rgl> df(natom) 1.25239 1.06880 -0.03437
8505.0000 -146.10386 -141.85184 4.25202 1.96520 -141.65410 501.14138
8510.0000 -146.22159 -143.28728 2.93430 1.89769 -142.66567 444.80281
8515.0000 -146.67139 -142.88131 3.79008 1.85992 -143.23153 415.94239
8520.0000 -146.15873 -142.39771 3.76102 1.91385 -142.42347 470.09292
8525.0000 -146.62211 -142.80489 3.81722 1.89393 -142.72199 461.74997
8530.0000 -146.24607 -143.56817 2.67790 1.84540 -143.44915 400.63403
8535.0000 -146.53326 -142.92250 3.61076 1.87026 -143.07659 416.57433
8540.0000 -145.95486 -142.47263 3.48223 1.91729 -142.37194 457.79809
8545.0000 -145.88913 -142.35930 3.52983 1.93361 -142.12746 480.56772
8550.0000 -145.97874 -142.91595 3.06279 1.90571 -142.54542 441.49856
8555.0000 -146.28909 -143.07502 3.21407 1.86016 -143.22802 400.86455
8560.0000 -145.87537 -142.86073 3.01464 1.87302 -143.03529 418.02668
8565.0000 -146.95091 -143.33285 3.61806 1.85222 -143.34689 402.00485
8570.0000 -146.29025 -142.77905 3.51120 1.87527 -143.00158 428.35101
8575.0000 -146.74716 -143.74655 3.00060 1.85413 -143.31828 415.33863
8580.0000 -147.33747 -143.86841 3.46906 1.82096 -143.81536 385.08479
8585.0000 -147.12374 -143.72748 3.39626 1.80576 -144.04313 363.13074
8590.0000 -146.58428 -143.87048 2.71380 1.85272 -143.33942 401.94676
8595.0000 -146.62165 -143.49052 3.13113 1.83699 -143.57519 397.65571
8600.0000 -145.69864 -142.57746 3.12119 1.86884 -143.09793 413.43570
8605.0000 -145.54534 -142.61610 2.92923 1.90962 -142.48692 448.98319
8610.0000 -145.83124 -142.37687 3.45437 1.87659 -142.98178 415.21158
8615.0000 -145.97734 -142.94844 3.02890 1.89954 -142.63788 434.34878
8620.0000 -145.93772 -141.91531 4.02241 1.92728 -142.22228 489.56018
8625.0000 -146.18294 -142.94239 3.24055 1.89304 -142.73527 472.59748
8630.0000 -146.86278 -143.64149 3.22129 1.85920 -143.24240 435.35180
8635.0000 -146.65753 -143.16025 3.49728 1.86800 -143.11053 448.60338
8640.0000 -146.72592 -143.58529 3.14062 1.85669 -143.27994 434.25659
8645.0000 -145.91953 -142.59450 3.32503 1.86902 -143.09521 443.37048
8650.0000 -146.35618 -142.58684 3.76934 1.87400 -143.02051 447.40933
8655.0000 -146.22329 -142.98733 3.23596 1.86799 -143.11058 444.91049
8660.0000 -146.60267 -142.96042 3.64225 1.87377 -143.02407 458.96907
8665.0000 -145.60957 -142.46849 3.14108 1.88081 -142.91858 458.17040
8670.0000 -146.55468 -143.48331 3.07137 1.87937 -142.94013 455.35611
8675.0000 -146.77128 -143.55505 3.21623 1.85047 -143.37309 420.24722
8680.0000 -145.77890 -143.06078 2.71812 1.87342 -143.02929 427.99244
8685.0000 -146.81760 -143.07643 3.74117 1.90768 -142.51599 460.61899
8690.0000 -145.80669 -142.19132 3.61536 1.91247 -142.44416 457.43316
8695.0000 -146.36268 -143.18644 3.17624 1.91019 -142.47828 460.57542
8700.0000 -146.29373 -143.40139 2.89234 1.84996 -143.38078 413.59682
8705.0000 -146.03483 -143.04413 2.99070 1.87925 -142.94194 437.94969
8710.0000 -145.41196 -142.20352 3.20844 1.90135 -142.61072 456.97943
8715.0000 -144.85354 -141.30388 3.54966 1.96839 -141.60619 499.54169
8720.0000 -145.24955 -141.54248 3.70707 1.98209 -141.40096 495.89149
8725.0000 -145.11544 -141.56941 3.54604 1.95588 -141.79364 492.28480
8730.0000 -145.46861 -141.61976 3.84885 1.96269 -141.69165 503.57128
8735.0000 -145.41232 -141.46593 3.94639 1.98166 -141.40748 507.37938
8740.0000 -145.89200 -142.44584 3.44616 1.94189 -142.00327 492.37408
8745.0000 -145.53715 -141.95830 3.57885 1.94297 -141.98722 495.11800
8750.0000 -145.25820 -141.75835 3.49985 1.94568 -141.94652 493.59025
FREEZING PROCESS: loop number 36 T-loop= 419.00000000000000
main_MD> interactions number 36 at Temperature= 419.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.53531 1.38622 -0.56510
force_rgl> df(natom) 0.88964 2.61754 -0.61323
8755.0000 -145.26726 -141.83322 3.43404 1.93307 -142.13542 464.70158
8760.0000 -145.89477 -142.63899 3.25578 1.92690 -142.22800 465.93808
8765.0000 -147.23741 -144.02301 3.21441 1.85243 -143.34371 426.82549
8770.0000 -147.36784 -144.48298 2.88486 1.79060 -144.27018 378.14706
8775.0000 -146.99297 -143.78542 3.20755 1.82190 -143.80128 403.59261
8780.0000 -146.51689 -143.41169 3.10520 1.82849 -143.70244 406.90815
8785.0000 -146.90178 -144.24116 2.66062 1.82837 -143.70429 406.18038
8790.0000 -147.03377 -143.94059 3.09318 1.81816 -143.85731 400.41957
8795.0000 -146.76059 -144.01019 2.75041 1.82698 -143.72516 392.55519
8800.0000 -146.71965 -143.70844 3.01121 1.84119 -143.51212 400.82937
8805.0000 -146.20540 -142.98165 3.22374 1.84806 -143.40929 398.33656
8810.0000 -146.05822 -142.94732 3.11090 1.90587 -142.54307 448.37808
8815.0000 -145.70827 -142.55889 3.14939 1.88875 -142.79950 426.72542
8820.0000 -146.01997 -142.98734 3.03263 1.90636 -142.53574 443.19794
8825.0000 -145.75261 -142.40282 3.34979 1.89806 -142.66013 443.04622
8830.0000 -146.32141 -143.33194 2.98946 1.89045 -142.77404 435.28717
8835.0000 -145.83864 -142.94017 2.89847 1.88206 -142.89980 412.37255
8840.0000 -146.33858 -143.57204 2.76654 1.89861 -142.65176 441.01392
8845.0000 -146.31662 -142.66564 3.65098 1.87505 -143.00491 419.04601
8850.0000 -146.92068 -143.77269 3.14799 1.85459 -143.31140 431.34786
8855.0000 -146.25453 -142.97993 3.27459 1.85837 -143.25475 436.21227
8860.0000 -146.45570 -142.78248 3.67321 1.87415 -143.01839 453.41333
8865.0000 -145.91177 -142.54119 3.37057 1.89965 -142.63618 473.50001
8870.0000 -147.23355 -143.84745 3.38610 1.86258 -143.19165 444.83959
8875.0000 -146.90259 -143.75988 3.14270 1.84450 -143.46255 430.62405
8880.0000 -147.61220 -144.27984 3.33236 1.81713 -143.87271 396.63572
8885.0000 -147.39596 -144.03032 3.36563 1.79697 -144.17476 382.78288
8890.0000 -146.76072 -143.65086 3.10986 1.82992 -143.68110 413.04201
8895.0000 -146.59793 -143.43055 3.16738 1.85952 -143.23761 437.92468
8900.0000 -145.92326 -142.88570 3.03756 1.85858 -143.25155 416.40631
8905.0000 -145.84705 -142.87994 2.96711 1.88636 -142.83534 427.55961
8910.0000 -146.26699 -143.18306 3.08393 1.85790 -143.26186 411.47470
8915.0000 -146.58210 -143.28652 3.29558 1.88101 -142.91554 438.69463
8920.0000 -146.27815 -143.01855 3.25960 1.86745 -143.11876 428.82122
8925.0000 -146.40431 -142.63521 3.76910 1.85417 -143.31771 420.37229
8930.0000 -146.37436 -143.18720 3.18716 1.86738 -143.11971 429.99172
8935.0000 -146.04285 -142.80806 3.23479 1.87310 -143.03404 428.02264
8940.0000 -146.60684 -143.67760 2.92925 1.88680 -142.82878 441.82761
8945.0000 -146.96370 -143.99208 2.97162 1.82509 -143.75344 389.73789
8950.0000 -146.48087 -143.77582 2.70505 1.82159 -143.80580 382.72928
8955.0000 -146.49136 -143.44305 3.04831 1.83623 -143.58644 405.30726
8960.0000 -146.74487 -144.30790 2.43698 1.83294 -143.63581 411.09409
8965.0000 -146.27654 -143.45255 2.82398 1.82570 -143.74432 384.39795
8970.0000 -146.80385 -143.85256 2.95130 1.82679 -143.72795 388.20370
8975.0000 -145.59773 -142.95828 2.63945 1.83684 -143.57731 392.88438
8980.0000 -146.17926 -142.60844 3.57081 1.89643 -142.68445 435.54687
8985.0000 -146.05220 -143.11814 2.93406 1.87949 -142.93825 421.45291
8990.0000 -146.04233 -143.52734 2.51500 1.85881 -143.24810 406.68338
8995.0000 -145.75617 -143.04411 2.71206 1.85570 -143.29478 401.05180
9000.0000 -146.57272 -143.79872 2.77400 1.86021 -143.22715 418.20285
FREEZING PROCESS: loop number 37 T-loop= 394.00000000000000
main_MD> interactions number 37 at Temperature= 394.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.14207 1.17970 0.12294
force_rgl> df(natom) 1.26256 2.06411 0.01544
9005.0000 -147.39677 -144.43768 2.95909 1.78806 -144.30833 371.55690
9010.0000 -147.13672 -143.76938 3.36735 1.82821 -143.70670 411.32299
9015.0000 -146.69666 -143.94675 2.74991 1.81559 -143.89577 395.59280
9020.0000 -147.15253 -144.56020 2.59232 1.80408 -144.06824 389.14130
9025.0000 -147.17663 -144.43525 2.74138 1.77295 -144.53464 359.09026
9030.0000 -146.78786 -143.63907 3.14880 1.82575 -143.74358 414.46680
9035.0000 -146.39132 -142.95886 3.43246 1.87165 -143.05576 450.19550
9040.0000 -146.92146 -143.99007 2.93138 1.83213 -143.64795 417.71381
9045.0000 -146.58138 -143.89158 2.68980 1.78970 -144.28367 376.41886
9050.0000 -147.11869 -143.94110 3.17759 1.81477 -143.90806 396.07106
9055.0000 -146.53139 -143.54973 2.98166 1.80916 -143.99208 391.65361
9060.0000 -146.88798 -143.95629 2.93169 1.78862 -144.29981 376.11989
9065.0000 -147.39769 -144.91319 2.48450 1.76563 -144.64441 351.78233
9070.0000 -146.94041 -144.44959 2.49082 1.76956 -144.58545 357.78185
9075.0000 -146.52858 -143.71745 2.81113 1.79522 -144.20094 382.08256
9080.0000 -147.07156 -143.72376 3.34780 1.83851 -143.55230 422.08655
9085.0000 -146.99572 -144.12672 2.86900 1.83085 -143.66716 406.83353
9090.0000 -146.82457 -143.63958 3.18499 1.80816 -144.00703 387.18105
9095.0000 -146.88727 -144.30544 2.58183 1.82235 -143.79452 405.31670
9100.0000 -146.58631 -144.03070 2.55561 1.78790 -144.31068 373.55695
9105.0000 -146.87526 -143.83409 3.04117 1.82437 -143.76417 403.53981
9110.0000 -147.15287 -144.48271 2.67016 1.79631 -144.18467 379.09654
9115.0000 -147.08246 -144.51317 2.56929 1.77419 -144.51610 371.93666
9120.0000 -146.66161 -143.64018 3.02142 1.79238 -144.24359 380.77299
9125.0000 -146.62954 -143.92497 2.70458 1.83094 -143.66578 416.68155
9130.0000 -146.71087 -143.40663 3.30424 1.79677 -144.17771 380.84579
9135.0000 -147.24763 -144.56472 2.68291 1.79733 -144.16940 382.57808
9140.0000 -146.22733 -143.79634 2.43099 1.79662 -144.18001 381.37297
9145.0000 -146.67470 -143.76589 2.90880 1.83985 -143.53220 416.98162
9150.0000 -147.23953 -143.97167 3.26786 1.82480 -143.75774 407.78807
9155.0000 -146.64822 -143.63263 3.01558 1.81192 -143.95081 398.57458
9160.0000 -146.87114 -143.85719 3.01395 1.82512 -143.75301 411.28537
9165.0000 -147.34238 -144.19754 3.14484 1.81660 -143.88067 397.82149
9170.0000 -146.99968 -143.83375 3.16593 1.80028 -144.12510 383.80970
9175.0000 -147.01002 -144.32248 2.68753 1.80926 -143.99064 395.94257
9180.0000 -147.07825 -144.24087 2.83738 1.78177 -144.40250 365.66691
9185.0000 -147.51845 -143.99146 3.52698 1.79897 -144.14477 379.48487
9190.0000 -146.99495 -144.36866 2.62629 1.80156 -144.10606 389.48886
9195.0000 -146.27017 -143.82665 2.44353 1.78922 -144.29094 374.27950
9200.0000 -146.66510 -143.86190 2.80319 1.82097 -143.81517 407.02000
9205.0000 -146.92920 -144.26144 2.66777 1.79629 -144.18501 379.79036
9210.0000 -147.16269 -144.09537 3.06732 1.79692 -144.17559 379.81142
9215.0000 -147.09494 -144.05330 3.04164 1.81012 -143.97767 394.96561
9220.0000 -146.75926 -143.74804 3.01121 1.81594 -143.89054 399.87464
9225.0000 -146.38342 -143.42359 2.95983 1.83606 -143.58904 414.38507
9230.0000 -147.17966 -144.09417 3.08549 1.80390 -144.07095 390.34320
9235.0000 -146.40768 -143.48978 2.91790 1.81710 -143.87320 402.75596
9240.0000 -147.36496 -143.67083 3.69413 1.81707 -143.87364 395.74862
9245.0000 -147.22131 -143.94979 3.27152 1.80822 -144.00625 395.11450
9250.0000 -146.72070 -143.53585 3.18485 1.83066 -143.66998 413.07487
FREEZING PROCESS: loop number 38 T-loop= 369.00000000000000
main_MD> interactions number 38 at Temperature= 369.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 3.74952 -0.57560 1.38451
force_rgl> df(natom) 1.45684 0.23531 -0.81701
9255.0000 -146.99219 -144.15212 2.84006 1.79601 -144.18920 379.23800
9260.0000 -147.12198 -143.93748 3.18449 1.81646 -143.88270 395.12102
9265.0000 -146.84106 -144.18043 2.66063 1.78535 -144.34885 370.84739
9270.0000 -146.53777 -143.54268 2.99509 1.81068 -143.96927 373.64280
9275.0000 -146.49366 -143.23552 3.25815 1.83834 -143.55494 410.09729
9280.0000 -146.97715 -144.12938 2.84777 1.82393 -143.77074 391.80772
9285.0000 -147.10988 -144.27796 2.83192 1.79202 -144.24893 356.84288
9290.0000 -146.38408 -143.52538 2.85870 1.80894 -143.99546 368.53209
9295.0000 -145.97524 -143.53029 2.44495 1.83646 -143.58312 390.88582
9300.0000 -146.85486 -144.18584 2.66902 1.84006 -143.52906 394.51363
9305.0000 -146.55426 -143.70855 2.84571 1.80677 -144.02799 371.18450
9310.0000 -146.89390 -143.77860 3.11530 1.81793 -143.86073 377.59222
9315.0000 -147.21500 -144.69758 2.51742 1.77394 -144.51986 344.28717
9320.0000 -147.49734 -144.73610 2.76123 1.77520 -144.50102 349.76508
9325.0000 -147.20156 -144.62802 2.57354 1.77705 -144.47328 344.61247
9330.0000 -146.86889 -143.79943 3.06946 1.80885 -143.99678 379.32971
9335.0000 -147.02113 -143.83298 3.18815 1.81743 -143.86814 375.23390
9340.0000 -146.71243 -144.24818 2.46425 1.81725 -143.87087 371.11708
9345.0000 -146.37930 -143.96901 2.41029 1.79031 -144.27456 339.10630
9350.0000 -146.54228 -143.75575 2.78653 1.82014 -143.82753 372.33580
9355.0000 -146.60848 -144.02353 2.58495 1.82299 -143.78484 370.44104
9360.0000 -146.55742 -143.63434 2.92309 1.82187 -143.80165 399.51853
9365.0000 -146.81654 -143.32031 3.49623 1.85202 -143.34991 429.15361
9370.0000 -146.24844 -143.76534 2.48309 1.83131 -143.66021 413.70754
9375.0000 -147.11349 -144.14861 2.96488 1.80106 -144.11345 387.64216
9380.0000 -147.00669 -144.20783 2.79887 1.81002 -143.97929 391.08585
9385.0000 -147.19818 -144.41443 2.78375 1.78925 -144.29050 378.78512
9390.0000 -146.82983 -143.93254 2.89729 1.80853 -144.00162 390.39943
9395.0000 -146.95946 -144.51401 2.44545 1.78067 -144.41897 365.33986
9400.0000 -146.89647 -144.09444 2.80203 1.77404 -144.51835 357.40363
9405.0000 -147.69767 -144.55067 3.14700 1.77086 -144.56599 361.14637
9410.0000 -147.12077 -144.31100 2.80977 1.81461 -143.91052 401.98090
9415.0000 -147.18346 -144.45189 2.73157 1.78251 -144.39145 368.39626
9420.0000 -146.94661 -144.47941 2.46720 1.78400 -144.36905 373.98752
9425.0000 -147.22580 -144.08465 3.14115 1.79237 -144.24362 380.33537
9430.0000 -147.64524 -144.83801 2.80723 1.80135 -144.10921 385.39961
9435.0000 -146.87818 -144.41592 2.46226 1.77666 -144.47911 361.58158
9440.0000 -146.53805 -144.54236 1.99569 1.78538 -144.34848 371.14128
9445.0000 -147.07509 -144.63185 2.44324 1.77682 -144.47666 360.32225
9450.0000 -147.44717 -144.63185 2.81532 1.77379 -144.52202 358.62607
9455.0000 -146.63639 -143.92699 2.70940 1.78516 -144.35172 369.40180
9460.0000 -146.96536 -144.15628 2.80907 1.80922 -143.99120 393.50655
9465.0000 -146.67163 -143.45592 3.21571 1.81523 -143.90110 399.21432
9470.0000 -146.87352 -144.32704 2.54648 1.82224 -143.79613 406.32929
9475.0000 -146.85989 -144.14665 2.71324 1.79118 -144.26158 377.08537
9480.0000 -147.12712 -144.44412 2.68301 1.79274 -144.23817 380.77644
9485.0000 -147.39087 -144.72082 2.67005 1.74134 -145.00826 331.98264
9490.0000 -147.20447 -144.03856 3.16591 1.77982 -144.43174 368.24805
9495.0000 -146.84204 -143.69526 3.14679 1.80309 -144.08302 387.00962
9500.0000 -146.86416 -143.91989 2.94427 1.83644 -143.58331 417.46880
FREEZING PROCESS: loop number 39 T-loop= 344.00000000000000
main_MD> interactions number 39 at Temperature= 344.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.29053 1.08235 0.10921
force_rgl> df(natom) 2.33592 0.41205 0.32571
9505.0000 -147.69523 -144.82211 2.87312 1.80216 -144.09693 386.89191
9510.0000 -147.47910 -145.11887 2.36023 1.74878 -144.89678 335.96919
9515.0000 -147.51949 -145.16240 2.35708 1.74297 -144.98382 330.68665
9520.0000 -147.31244 -144.66370 2.64874 1.75259 -144.83976 342.12831
9525.0000 -147.48604 -145.34257 2.14347 1.74772 -144.91272 338.07677
9530.0000 -147.14203 -144.43905 2.70298 1.74702 -144.92328 334.66423
9535.0000 -147.41225 -144.91054 2.50171 1.76773 -144.61287 354.99232
9540.0000 -147.33675 -144.62249 2.71425 1.76686 -144.62598 355.31781
9545.0000 -147.03518 -144.00042 3.03476 1.78431 -144.36452 371.04638
9550.0000 -147.08225 -144.59640 2.48585 1.77962 -144.43479 368.58549
9555.0000 -147.46207 -145.02347 2.43860 1.75740 -144.76767 345.14668
9560.0000 -147.29623 -145.13495 2.16128 1.73608 -145.08718 324.31752
9565.0000 -147.29097 -145.42807 1.86291 1.73784 -145.06078 323.46285
9570.0000 -147.13787 -144.95391 2.18396 1.71961 -145.33398 309.62021
9575.0000 -147.09036 -144.45478 2.63558 1.76182 -144.70137 348.51947
9580.0000 -147.30347 -144.83820 2.46527 1.76112 -144.71195 346.61942
9585.0000 -147.36167 -144.52590 2.83577 1.77387 -144.52091 359.28309
9590.0000 -147.19313 -144.87877 2.31436 1.75356 -144.82515 341.91022
9595.0000 -147.26330 -144.85624 2.40706 1.75464 -144.80900 345.28842
9600.0000 -147.20442 -144.65001 2.55442 1.75205 -144.84789 337.43477
9605.0000 -147.59742 -145.03035 2.56706 1.74084 -145.01584 327.78903
9610.0000 -147.17688 -145.41872 1.75816 1.73603 -145.08792 321.46515
9615.0000 -146.73511 -144.53528 2.19983 1.74674 -144.92744 334.04208
9620.0000 -147.12516 -144.74701 2.37815 1.78023 -144.42554 366.09440
9625.0000 -146.89292 -144.20292 2.69000 1.76317 -144.68124 348.67466
9630.0000 -147.20547 -145.02899 2.17649 1.76040 -144.72279 349.33873
9635.0000 -147.68610 -144.95477 2.73133 1.75880 -144.74673 346.85970
9640.0000 -147.44592 -144.47869 2.96723 1.73795 -145.05911 325.47760
9645.0000 -145.96378 -143.16372 2.80006 1.84472 -143.45936 424.15781
9650.0000 -147.64130 -144.57228 3.06902 1.80613 -144.03756 391.87172
9655.0000 -147.43923 -144.43239 3.00683 1.77753 -144.46600 363.77483
9660.0000 -147.00436 -144.70238 2.30198 1.76154 -144.70562 348.09143
9665.0000 -147.63192 -144.92868 2.70325 1.76485 -144.65599 350.21174
9670.0000 -147.27983 -144.77565 2.50418 1.74651 -144.93079 337.29167
9675.0000 -147.59213 -145.36516 2.22698 1.75332 -144.82881 340.01068
9680.0000 -147.57873 -145.15673 2.42200 1.73076 -145.16685 319.95813
9685.0000 -147.62393 -144.87360 2.75033 1.74090 -145.01496 333.46632
9690.0000 -147.18194 -144.83505 2.34688 1.74834 -144.90340 334.20927
9695.0000 -147.25678 -144.75996 2.49682 1.77455 -144.51066 356.96554
9700.0000 -147.68421 -144.96436 2.71985 1.75208 -144.84736 340.87938
9705.0000 -147.27282 -144.62794 2.64488 1.75031 -144.87397 338.32376
9710.0000 -147.78169 -145.19792 2.58376 1.75534 -144.79847 344.30125
9715.0000 -147.43183 -145.08271 2.34912 1.73271 -145.13767 321.50829
9720.0000 -147.31143 -145.11119 2.20024 1.73261 -145.13909 320.92871
9725.0000 -147.77418 -145.09857 2.67561 1.75556 -144.79522 341.55072
9730.0000 -147.80216 -145.32405 2.47811 1.72678 -145.22647 318.78433
9735.0000 -147.36028 -145.21834 2.14194 1.72550 -145.24572 316.10827
9740.0000 -147.10984 -144.23946 2.87038 1.78083 -144.41659 365.14109
9745.0000 -147.08272 -144.31627 2.76645 1.79777 -144.16281 382.89273
9750.0000 -147.40326 -145.11535 2.28792 1.76570 -144.64336 350.68246
FREEZING PROCESS: loop number 40 T-loop= 319.00000000000000
main_MD> interactions number 40 at Temperature= 319.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.36473 0.24430 1.59268
force_rgl> df(natom) -0.97955 0.06554 0.70964
9755.0000 -147.59976 -145.18972 2.41003 1.74158 -145.00477 329.49234
9760.0000 -147.48666 -144.51282 2.97384 1.75040 -144.87258 337.43581
9765.0000 -147.84909 -144.88018 2.96891 1.76945 -144.58714 355.83170
9770.0000 -147.47187 -144.54678 2.92509 1.76105 -144.71294 350.05250
9775.0000 -147.56092 -145.31148 2.24943 1.73726 -145.06945 328.04651
9780.0000 -147.19834 -145.10265 2.09568 1.71401 -145.41779 303.93819
9785.0000 -147.91789 -145.63830 2.27959 1.70551 -145.54513 295.12098
9790.0000 -147.18982 -144.56531 2.62452 1.74689 -144.92521 337.47899
9795.0000 -147.36916 -144.93934 2.42981 1.75065 -144.86881 342.61084
9800.0000 -147.31177 -144.52733 2.78444 1.74496 -144.95403 332.68407
9805.0000 -147.32415 -144.91091 2.41324 1.76154 -144.70561 351.56514
9810.0000 -147.22614 -144.29812 2.92802 1.76404 -144.66820 350.07818
9815.0000 -147.62366 -144.91164 2.71202 1.75327 -144.82949 338.44667
9820.0000 -147.73701 -145.37154 2.36547 1.71698 -145.37330 306.00909
9825.0000 -147.42015 -144.95653 2.46361 1.73476 -145.10684 323.91673
9830.0000 -147.39466 -144.86050 2.53416 1.73859 -145.04952 329.36445
9835.0000 -147.59842 -145.57024 2.02819 1.73194 -145.14919 323.10779
9840.0000 -147.46908 -144.99192 2.47716 1.73785 -145.06062 326.83665
9845.0000 -147.13946 -144.78893 2.35053 1.74910 -144.89211 334.49783
9850.0000 -147.52928 -144.94496 2.58432 1.75316 -144.83117 340.96127
9855.0000 -147.51903 -145.22027 2.29876 1.72355 -145.27489 314.66791
9860.0000 -147.94451 -145.88306 2.06145 1.69978 -145.63099 288.34311
9865.0000 -147.57395 -145.08757 2.48638 1.71185 -145.45021 303.18254
9870.0000 -147.54811 -144.97362 2.57449 1.74429 -144.96416 332.97535
9875.0000 -147.46727 -145.19938 2.26789 1.73434 -145.11314 323.71030
9880.0000 -147.66217 -145.18287 2.47930 1.72018 -145.32533 311.50207
9885.0000 -147.82713 -145.75464 2.07248 1.70611 -145.53611 297.12241
9890.0000 -148.07651 -145.89395 2.18256 1.68212 -145.89557 272.25429
9895.0000 -147.77191 -145.61295 2.15896 1.69373 -145.72168 286.17017
9900.0000 -147.95568 -145.92401 2.03167 1.69720 -145.66975 285.79533
9905.0000 -148.07514 -145.77374 2.30141 1.69913 -145.64073 294.18505
9910.0000 -147.76196 -145.60024 2.16172 1.69970 -145.63223 297.41526
9915.0000 -147.37836 -145.28354 2.09482 1.70277 -145.58623 295.42801
9920.0000 -147.28928 -144.81397 2.47530 1.73870 -145.04784 330.47478
9925.0000 -147.82197 -145.63940 2.18257 1.71398 -145.41820 303.36625
9930.0000 -147.38129 -145.27696 2.10433 1.71153 -145.45503 302.84311
9935.0000 -147.86872 -145.90778 1.96094 1.69172 -145.75181 282.48270
9940.0000 -147.57453 -145.47831 2.09622 1.68822 -145.80419 278.35577
9945.0000 -147.35928 -144.94757 2.41171 1.72482 -145.25583 313.34293
9950.0000 -147.33547 -144.58244 2.75303 1.75082 -144.86624 338.30616
9955.0000 -148.03821 -145.47276 2.56546 1.73431 -145.11362 324.22016
9960.0000 -147.62385 -145.24243 2.38141 1.73245 -145.14159 323.71618
9965.0000 -147.62405 -145.50092 2.12313 1.72088 -145.31486 309.32615
9970.0000 -147.70359 -145.32566 2.37793 1.73117 -145.16063 319.29535
9975.0000 -147.81363 -145.38211 2.43152 1.71224 -145.44429 305.72537
9980.0000 -147.19026 -144.65589 2.53437 1.73594 -145.08926 325.81236
9985.0000 -147.14769 -144.75727 2.39042 1.77089 -144.56547 361.65968
9990.0000 -147.82235 -145.05388 2.76847 1.76057 -144.72020 354.64430
9995.0000 -147.58661 -145.31318 2.27344 1.73196 -145.14887 322.15026
10000.0000 -147.70081 -145.69724 2.00357 1.71359 -145.42405 303.82967
main_MD> EXECUTION TIME: 0 [day], 0 [hour], 13 [min], 26.8319074 [s].
main_MD> Deallocating global variables
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