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nanoparticlesims/growth_Melting_Silver_ICO_2451/freezeSims/run_26/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_26.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 = 26 ntipo2 = 0
read_input> Finish reading input
main_MD> Allocating global variables
main_MD> Number of outputs that will be created: 1800
main_MD> Size of nv and nvoiz: 26 2600
main_MD> Size of nv and nvoiz: 26 2600
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 = 26
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> -4.7619535044875011E-002 -0.12490196104079078 -0.12255868657488050 initial drift of cluster / NP1 for coalescence
init> 0.35579846573965390 0.40145734063714400 0.30670298065281903 scaling for velocity /for coalescence NP1
init.f90 > facguy = 3.7238778506760110E-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) 1.65585 0.87349 -2.74689
force_rgl> df(natom) -1.89231 0.26813 -0.21283
preparo> THERMALIZATION PROCESS AT 1203.1190316827806
preparo> TOTAL ENERGY, KINETIC EN., POT. ENERGY, DELTA
5000 -52.518328242059411 4.1587894164971289 -56.677117658556540 6.1915489078833417E-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 36
FREEZING PROCESS: loop number 1 T-loop= 1178.0000000000000
main_MD> interactions number 1 at Temperature= 1178.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.05915 1.51096 -3.11091
force_rgl> df(natom) 1.17968 -0.13312 -0.39090
5.0000 -57.42791 -53.53153 3.89638 2.63875 -53.54132 1257.78246
10.0000 -59.19359 -55.84768 3.34591 2.36569 -55.93781 999.49843
15.0000 -58.80900 -55.08681 3.72218 2.44116 -55.27541 1023.46808
20.0000 -57.32030 -52.41135 4.90896 2.63216 -53.59919 1255.00204
25.0000 -57.39988 -53.31912 4.08076 2.64125 -53.51940 1175.17333
30.0000 -58.74056 -53.51194 5.22862 2.51493 -54.62801 1084.96048
35.0000 -59.98709 -56.41548 3.57161 2.49804 -54.77627 1197.05679
40.0000 -59.17741 -54.73896 4.43845 2.43147 -55.36052 1082.37935
45.0000 -59.03907 -55.36118 3.67789 2.41794 -55.47927 1037.36421
50.0000 -57.84382 -54.90534 2.93849 2.45318 -55.16991 1109.92760
55.0000 -59.60581 -55.44579 4.16002 2.44817 -55.21390 1054.79955
60.0000 -57.45834 -54.11756 3.34078 2.55216 -54.30123 1115.73818
65.0000 -56.27407 -51.52916 4.74491 2.66780 -53.28635 1270.13306
70.0000 -58.85908 -53.45778 5.40131 2.74111 -52.64293 1286.57940
75.0000 -59.20703 -54.24897 4.95806 2.64253 -53.50811 1296.07909
80.0000 -57.74456 -54.63908 3.10548 2.54926 -54.32672 1205.40403
85.0000 -57.05247 -53.00218 4.05028 2.59371 -53.93659 1126.67168
90.0000 -58.66901 -54.50009 4.16892 2.58818 -53.98514 1156.44131
95.0000 -57.48506 -54.53567 2.94939 2.56807 -54.16167 1185.65419
100.0000 -58.13396 -54.59532 3.53864 2.53012 -54.49467 1133.77263
105.0000 -57.34859 -53.76639 3.58220 2.61642 -53.73731 1193.86156
110.0000 -59.24576 -55.73805 3.50772 2.52259 -54.56081 1044.02364
115.0000 -59.04554 -55.05289 3.99265 2.47150 -55.00919 1123.65951
120.0000 -58.68448 -55.03924 3.64524 2.41186 -55.53261 1079.00657
125.0000 -58.99339 -55.49847 3.49492 2.41730 -55.48489 1012.19306
130.0000 -58.93910 -55.66476 3.27433 2.47696 -54.96127 1056.54017
135.0000 -59.13103 -55.99615 3.13487 2.35778 -56.00719 980.64410
140.0000 -56.83324 -53.66804 3.16519 2.50373 -54.72632 1112.93785
145.0000 -59.12159 -54.99233 4.12926 2.59587 -53.91766 1092.21030
150.0000 -57.45202 -53.46458 3.98744 2.48481 -54.89233 1061.22434
155.0000 -57.21798 -52.82116 4.39682 2.60354 -53.85037 1265.13782
160.0000 -56.71074 -52.26278 4.44796 2.78809 -52.23064 1372.07163
165.0000 -58.94529 -55.48666 3.45862 2.62990 -53.61895 1295.43392
170.0000 -58.05211 -55.03938 3.01272 2.46830 -55.03724 1108.13390
175.0000 -59.14848 -54.99703 4.15145 2.44574 -55.23526 1015.96076
180.0000 -57.28099 -53.93498 3.34601 2.54089 -54.40015 1100.41511
185.0000 -59.85044 -56.28597 3.56448 2.39824 -55.65213 1009.70979
190.0000 -58.94764 -55.47150 3.47615 2.39251 -55.70242 1041.12496
195.0000 -57.66254 -54.09151 3.57103 2.47593 -54.97027 1054.03552
200.0000 -57.83026 -53.83931 3.99095 2.59392 -53.93476 1181.11169
205.0000 -58.06800 -53.90536 4.16265 2.64227 -53.51044 1234.46853
210.0000 -57.52127 -53.47760 4.04367 2.58177 -54.04137 1196.89774
215.0000 -57.85585 -53.38823 4.46762 2.68337 -53.14971 1264.43336
220.0000 -59.29599 -54.26308 5.03291 2.61693 -53.73282 1278.15307
225.0000 -57.80702 -54.50338 3.30364 2.57940 -54.06216 1206.26681
230.0000 -57.85307 -54.46751 3.38556 2.56687 -54.17216 1211.34825
235.0000 -58.72343 -55.83977 2.88366 2.49013 -54.84564 1007.36419
240.0000 -58.78770 -55.61842 3.16928 2.47300 -54.99600 1075.35111
245.0000 -58.62166 -54.58807 4.03358 2.40714 -55.57398 1050.59338
250.0000 -58.00144 -55.47013 2.53131 2.42310 -55.43394 1037.32488
FREEZING PROCESS: loop number 2 T-loop= 1153.0000000000000
main_MD> interactions number 2 at Temperature= 1153.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.17245 4.58185 1.07636
force_rgl> df(natom) -1.22630 0.94494 -1.76817
255.0000 -57.95517 -54.41311 3.54206 2.45115 -55.18778 1108.28303
260.0000 -59.20716 -55.81425 3.39291 2.45313 -55.17038 1111.97862
265.0000 -58.97741 -54.57305 4.40437 2.58613 -54.00316 1191.70941
270.0000 -58.81043 -55.15552 3.65491 2.48279 -54.91007 1130.65116
275.0000 -58.52789 -54.30250 4.22539 2.56807 -54.16166 1150.39863
280.0000 -59.07756 -55.25640 3.82116 2.52672 -54.52452 1145.80352
285.0000 -58.95766 -55.79469 3.16297 2.38037 -55.80898 1028.44467
290.0000 -59.66474 -54.85344 4.81130 2.44665 -55.22726 1043.57382
295.0000 -59.65376 -55.14166 4.51209 2.46433 -55.07206 1105.90891
300.0000 -59.46943 -55.87545 3.59399 2.43773 -55.30552 1042.38211
305.0000 -59.24328 -56.29213 2.95115 2.41415 -55.51252 1026.21609
310.0000 -59.44528 -54.43124 5.01405 2.44734 -55.22118 1067.66109
315.0000 -58.73638 -54.65312 4.08326 2.49254 -54.82448 1120.47371
320.0000 -59.35954 -55.39362 3.96592 2.40501 -55.59269 1028.89691
325.0000 -58.16961 -53.82299 4.34662 2.50941 -54.67646 1180.91010
330.0000 -57.48757 -53.99179 3.49578 2.55037 -54.31698 1147.98168
335.0000 -58.40519 -54.70152 3.70367 2.61350 -53.76288 1240.09979
340.0000 -57.49307 -53.77040 3.72267 2.60570 -53.83141 1162.39784
345.0000 -58.20943 -53.30961 4.89982 2.59723 -53.90572 1205.10636
350.0000 -58.34122 -53.88729 4.45393 2.64094 -53.52213 1300.79740
355.0000 -58.95468 -54.90668 4.04800 2.64908 -53.45064 1326.09275
360.0000 -57.92328 -54.52326 3.40002 2.51972 -54.58601 1089.77211
365.0000 -57.77114 -53.65760 4.11353 2.62211 -53.68739 1263.93193
370.0000 -57.83682 -54.30931 3.52752 2.63417 -53.58150 1247.29743
375.0000 -58.22213 -54.06793 4.15420 2.59576 -53.91863 1209.42716
380.0000 -57.97410 -54.38814 3.58596 2.56808 -54.16152 1135.32222
385.0000 -56.64343 -52.81223 3.83120 2.66428 -53.31724 1236.75683
390.0000 -58.20515 -53.91455 4.29060 2.62254 -53.68361 1187.92734
395.0000 -58.29782 -54.26172 4.03610 2.57731 -54.08050 1210.65554
400.0000 -58.30449 -54.43354 3.87095 2.53551 -54.44741 1149.61366
405.0000 -58.99744 -54.98458 4.01286 2.51482 -54.62896 1170.47668
410.0000 -57.38211 -53.26659 4.11552 2.51545 -54.62345 1162.26255
415.0000 -57.31727 -53.80420 3.51307 2.63165 -53.60361 1271.30732
420.0000 -56.98553 -53.10720 3.87833 2.76797 -52.40724 1389.55109
425.0000 -59.74362 -55.57470 4.16892 2.53807 -54.42493 1116.28301
430.0000 -58.12118 -54.41385 3.70734 2.46535 -55.06314 1066.58224
435.0000 -57.48339 -53.38248 4.10092 2.57115 -54.13463 1201.26444
440.0000 -57.11756 -53.40704 3.71052 2.78486 -52.25903 1416.00275
445.0000 -56.51128 -52.34740 4.16387 2.72929 -52.74672 1328.44114
450.0000 -58.87290 -53.24649 5.62641 2.76220 -52.45786 1367.84901
455.0000 -57.06184 -54.13827 2.92357 2.65763 -53.37564 1247.05961
460.0000 -59.21494 -55.93799 3.27695 2.53157 -54.48201 1069.66927
465.0000 -58.62139 -55.15572 3.46567 2.40372 -55.60407 1005.13099
470.0000 -59.85577 -55.50924 4.34653 2.44738 -55.22087 1102.00842
475.0000 -58.43819 -54.46826 3.96993 2.42591 -55.40925 1014.23446
480.0000 -58.54157 -54.78683 3.75474 2.47229 -55.00226 1083.03869
485.0000 -58.87280 -55.48218 3.39063 2.53593 -54.44368 1219.85893
490.0000 -57.25593 -52.86514 4.39079 2.49580 -54.79588 1120.51609
495.0000 -58.75275 -54.35941 4.39335 2.59637 -53.91328 1190.67655
500.0000 -58.32369 -54.89307 3.43062 2.47415 -54.98588 1080.96231
FREEZING PROCESS: loop number 3 T-loop= 1128.0000000000000
main_MD> interactions number 3 at Temperature= 1128.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.63460 -1.07664 -1.86968
force_rgl> df(natom) -0.33484 -0.88844 3.71171
505.0000 -57.51813 -53.88070 3.63743 2.51480 -54.62915 1103.63996
510.0000 -58.62759 -53.90542 4.72216 2.60720 -53.81825 1252.70993
515.0000 -56.43456 -51.54233 4.89224 2.67436 -53.22875 1329.36588
520.0000 -57.49203 -52.93092 4.56111 2.77531 -52.34280 1282.86195
525.0000 -56.75879 -52.89121 3.86758 2.77021 -52.38762 1334.07257
530.0000 -58.23219 -55.04110 3.19110 2.61737 -53.72898 1204.73099
535.0000 -58.89073 -54.80768 4.08305 2.42787 -55.39212 1044.11184
540.0000 -58.81616 -54.87022 3.94594 2.49569 -54.79684 1134.99264
545.0000 -58.78974 -56.12973 2.66001 2.39868 -55.64824 1084.23630
550.0000 -60.37001 -56.14655 4.22346 2.38751 -55.74631 1044.19612
555.0000 -59.60238 -54.56053 5.04185 2.44802 -55.21525 1111.65049
560.0000 -57.80415 -54.27172 3.53243 2.49964 -54.76223 1115.38581
565.0000 -58.03518 -54.45943 3.57575 2.57423 -54.10753 1176.42991
570.0000 -58.31734 -54.04540 4.27194 2.45870 -55.12148 1117.76240
575.0000 -58.60921 -53.56171 5.04750 2.57100 -54.13591 1176.31448
580.0000 -57.65613 -53.98396 3.67218 2.54935 -54.32594 1132.14242
585.0000 -58.06834 -54.20711 3.86124 2.52927 -54.50211 1128.28706
590.0000 -57.88413 -53.05467 4.82946 2.59997 -53.88169 1237.85027
595.0000 -57.87027 -54.48751 3.38276 2.64160 -53.51629 1266.75958
600.0000 -58.49579 -54.85387 3.64191 2.49449 -54.80740 1059.44501
605.0000 -58.80098 -56.12043 2.68055 2.46218 -55.09096 1099.50881
610.0000 -57.95217 -55.05431 2.89787 2.40735 -55.57213 1043.26255
615.0000 -58.89433 -55.54472 3.34961 2.46663 -55.05189 1091.19565
620.0000 -58.41909 -55.40955 3.00954 2.37315 -55.87229 963.53820
625.0000 -58.30411 -54.88851 3.41561 2.48512 -54.88967 1104.82128
630.0000 -59.99447 -55.93837 4.05611 2.40914 -55.55650 1005.21317
635.0000 -59.09229 -55.65704 3.43525 2.36845 -55.91355 978.83592
640.0000 -58.69685 -53.65548 5.04137 2.47223 -55.00273 1123.36274
645.0000 -58.35557 -55.09091 3.26466 2.59503 -53.92506 1177.84856
650.0000 -58.89009 -55.40690 3.48318 2.42965 -55.37649 1060.05485
655.0000 -59.55019 -56.10658 3.44361 2.41693 -55.48811 1035.40957
660.0000 -59.42843 -56.28112 3.14731 2.38460 -55.77181 976.89603
665.0000 -57.91191 -54.55302 3.35889 2.38966 -55.72739 925.93583
670.0000 -56.61340 -53.13868 3.47473 2.66288 -53.32954 1318.03089
675.0000 -58.64083 -54.79679 3.84403 2.63347 -53.58766 1253.03526
680.0000 -58.84973 -54.43631 4.41342 2.56873 -54.15588 1183.90608
685.0000 -58.19192 -54.31720 3.87472 2.51993 -54.58415 1100.51194
690.0000 -58.20887 -55.19309 3.01578 2.48480 -54.89243 1093.01642
695.0000 -58.71302 -53.56417 5.14885 2.54567 -54.35820 1146.44985
700.0000 -59.42723 -55.63226 3.79497 2.50205 -54.74102 1114.49096
705.0000 -58.93509 -55.29711 3.63798 2.45637 -55.14200 1091.95197
710.0000 -58.05189 -54.92688 3.12500 2.52421 -54.54658 1145.94310
715.0000 -56.96273 -53.03047 3.93226 2.53129 -54.48445 1139.54703
720.0000 -56.51918 -52.29664 4.22254 2.75159 -52.55101 1361.58763
725.0000 -59.42793 -55.71447 3.71347 2.57478 -54.10273 1243.57136
730.0000 -58.96303 -56.01645 2.94658 2.42334 -55.43187 1046.40114
735.0000 -57.31956 -54.23525 3.08431 2.48541 -54.88713 1114.74867
740.0000 -58.92912 -55.11860 3.81052 2.55594 -54.26810 1249.11253
745.0000 -59.06855 -55.69601 3.37254 2.44643 -55.22922 990.21773
750.0000 -60.17735 -56.97838 3.19898 2.35116 -56.06528 1015.56090
FREEZING PROCESS: loop number 4 T-loop= 1103.0000000000000
main_MD> interactions number 4 at Temperature= 1103.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.84360 -0.55097 4.07957
force_rgl> df(natom) -1.21163 -3.44060 -0.99205
755.0000 -58.68280 -55.80660 2.87620 2.31751 -56.36065 927.98994
760.0000 -57.94818 -54.87723 3.07095 2.47449 -54.98297 1053.33628
765.0000 -58.21817 -54.65615 3.56202 2.48192 -54.91770 1132.09664
770.0000 -59.24687 -55.36164 3.88523 2.55582 -54.26914 1216.02059
775.0000 -58.37600 -55.28118 3.09482 2.44572 -55.23542 1077.35624
780.0000 -58.26418 -54.63049 3.63369 2.46651 -55.05294 1058.66824
785.0000 -58.68235 -54.91100 3.77135 2.51639 -54.61518 1149.05715
790.0000 -58.61529 -55.55815 3.05714 2.47222 -55.00281 1059.87239
795.0000 -57.61964 -54.88856 2.73108 2.43214 -55.35457 995.33888
800.0000 -58.18635 -53.95150 4.23485 2.52155 -54.56989 1155.90888
805.0000 -59.63069 -55.85435 3.77634 2.44844 -55.21159 1055.38702
810.0000 -59.34881 -54.93902 4.40979 2.41860 -55.47340 1048.26187
815.0000 -59.18508 -55.85386 3.33121 2.40675 -55.57742 1071.60713
820.0000 -57.72602 -54.04287 3.68315 2.49849 -54.77226 1158.90609
825.0000 -58.31659 -54.30026 4.01633 2.59025 -53.96696 1203.29582
830.0000 -58.79193 -55.35311 3.43882 2.52091 -54.57549 1142.74540
835.0000 -59.42328 -56.72960 2.69368 2.35264 -56.05233 931.76710
840.0000 -58.71578 -55.62910 3.08669 2.41129 -55.53757 1002.93513
845.0000 -58.40644 -54.31570 4.09073 2.57366 -54.11258 1123.23324
850.0000 -58.95818 -54.66318 4.29500 2.47571 -54.97221 1106.23359
855.0000 -57.66576 -53.88236 3.78341 2.62433 -53.66789 1203.81011
860.0000 -59.17477 -54.56825 4.60653 2.56687 -54.17213 1185.14383
865.0000 -59.85492 -55.15871 4.69621 2.50025 -54.75687 1148.54507
870.0000 -59.53298 -56.85476 2.67821 2.31684 -56.36657 917.18899
875.0000 -58.47211 -55.00354 3.46857 2.28075 -56.68330 932.99526
880.0000 -57.98024 -54.04011 3.94013 2.47219 -55.00309 1093.44864
885.0000 -59.24610 -54.94812 4.29798 2.51822 -54.59917 1158.86752
890.0000 -58.35079 -55.07685 3.27394 2.51463 -54.63062 1089.12341
895.0000 -58.45655 -54.55131 3.90524 2.50963 -54.67452 1049.20012
900.0000 -58.20845 -55.75393 2.45452 2.46221 -55.09072 1043.51928
905.0000 -57.85021 -52.57516 5.27506 2.56744 -54.16716 1225.78000
910.0000 -58.42317 -53.29879 5.12438 2.64206 -53.51230 1259.59460
915.0000 -59.54850 -54.99876 4.54974 2.54482 -54.36569 1140.51480
920.0000 -58.64805 -54.82009 3.82796 2.47807 -54.95154 1138.56666
925.0000 -58.02958 -53.61342 4.41617 2.54285 -54.38301 1183.38356
930.0000 -59.17502 -54.51844 4.65658 2.54496 -54.36449 1152.34676
935.0000 -58.29375 -54.62943 3.66432 2.46687 -55.04983 1120.78528
940.0000 -56.97406 -53.46368 3.51038 2.60555 -53.83271 1233.48200
945.0000 -58.62012 -55.53244 3.08768 2.54411 -54.37194 1085.15701
950.0000 -58.61116 -54.63652 3.97464 2.42153 -55.44772 1035.88910
955.0000 -58.78365 -55.16302 3.62063 2.48078 -54.92771 1056.83601
960.0000 -58.67972 -55.36591 3.31381 2.48408 -54.89873 1071.03142
965.0000 -58.93891 -54.52323 4.41568 2.46125 -55.09911 1043.81246
970.0000 -59.76678 -56.55297 3.21380 2.43192 -55.35655 1028.86916
975.0000 -56.88877 -54.11213 2.77664 2.40481 -55.59450 1028.96662
980.0000 -57.79191 -54.88403 2.90788 2.52017 -54.58198 1079.99888
985.0000 -57.61679 -53.46386 4.15293 2.61095 -53.78529 1205.98944
990.0000 -57.45265 -53.39127 4.06139 2.68914 -53.09912 1273.80348
995.0000 -57.14458 -53.64644 3.49814 2.66236 -53.33410 1253.26460
1000.0000 -59.16115 -54.87090 4.29025 2.55559 -54.27119 1182.82617
FREEZING PROCESS: loop number 5 T-loop= 1078.0000000000000
main_MD> interactions number 5 at Temperature= 1078.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.29075 1.34469 0.29082
force_rgl> df(natom) 2.17253 -0.37673 -0.75439
1005.0000 -58.21315 -54.50178 3.71137 2.50000 -54.75905 1138.46151
1010.0000 -57.07066 -54.07044 3.00022 2.65346 -53.41222 1209.47915
1015.0000 -58.42714 -54.28804 4.13910 2.44459 -55.24535 1072.61703
1020.0000 -58.77442 -55.23034 3.54408 2.52142 -54.57104 1178.07187
1025.0000 -59.93782 -55.80363 4.13419 2.39923 -55.64343 997.67089
1030.0000 -59.42734 -56.05221 3.37513 2.36899 -55.90881 1014.46566
1035.0000 -57.81794 -54.39526 3.42268 2.42031 -55.45842 971.64011
1040.0000 -58.25025 -52.84024 5.41002 2.73748 -52.67485 1361.42036
1045.0000 -57.05792 -53.35896 3.69896 2.75948 -52.48174 1336.43782
1050.0000 -57.87514 -54.57895 3.29619 2.57494 -54.10131 1209.41418
1055.0000 -58.32907 -54.48122 3.84785 2.48820 -54.86262 1118.92866
1060.0000 -59.25611 -55.89963 3.35648 2.46110 -55.10041 1107.84142
1065.0000 -59.42686 -56.56545 2.86141 2.35357 -56.04416 991.26487
1070.0000 -57.30363 -53.99347 3.31015 2.49780 -54.77838 1175.42959
1075.0000 -58.98870 -56.13767 2.85103 2.44377 -55.25255 1013.64454
1080.0000 -59.42486 -55.65571 3.76916 2.40127 -55.62551 1026.46685
1085.0000 -57.19317 -53.28611 3.90706 2.55195 -54.30307 1131.94876
1090.0000 -57.20601 -52.78825 4.41775 2.70204 -52.98584 1263.07700
1095.0000 -57.83638 -53.88729 3.94909 2.67652 -53.20986 1281.60924
1100.0000 -57.09533 -52.85194 4.24339 2.63945 -53.53521 1233.96644
1105.0000 -58.04118 -55.05541 2.98577 2.60976 -53.79576 1206.22501
1110.0000 -57.87195 -54.28118 3.59076 2.52652 -54.52634 1114.23682
1115.0000 -58.42473 -55.78199 2.64274 2.46793 -55.04054 1069.07897
1120.0000 -59.06350 -55.25555 3.80796 2.47493 -54.97907 1070.36207
1125.0000 -58.92653 -55.42105 3.50548 2.55181 -54.30429 1137.87683
1130.0000 -58.68546 -55.34397 3.34149 2.46280 -55.08553 1057.10604
1135.0000 -58.97741 -54.24444 4.73297 2.48068 -54.92857 1133.69855
1140.0000 -57.74709 -54.01039 3.73669 2.53130 -54.48437 1168.65021
1145.0000 -58.32375 -54.67325 3.65050 2.49351 -54.81598 1089.98878
1150.0000 -59.51863 -55.67830 3.84033 2.48019 -54.93293 1082.72421
1155.0000 -59.30333 -55.37768 3.92565 2.36371 -55.95514 947.48451
1160.0000 -58.05709 -54.93164 3.12545 2.44017 -55.28413 1059.32982
1165.0000 -60.15986 -56.67788 3.48198 2.39229 -55.70439 1074.35922
1170.0000 -57.89935 -54.31728 3.58207 2.39017 -55.72294 1076.55273
1175.0000 -58.61530 -55.11475 3.50056 2.44322 -55.25736 1009.77120
1180.0000 -59.62798 -56.08762 3.54036 2.44514 -55.24055 1069.42945
1185.0000 -58.83080 -56.24378 2.58702 2.38360 -55.78059 978.97471
1190.0000 -59.19879 -56.14157 3.05722 2.34059 -56.15811 953.10763
1195.0000 -59.42641 -56.46343 2.96298 2.34975 -56.07770 974.41031
1200.0000 -60.04561 -55.53186 4.51375 2.39571 -55.67429 1021.18917
1205.0000 -56.50754 -53.09651 3.41103 2.58726 -53.99318 1191.15033
1210.0000 -57.79434 -54.29296 3.50138 2.64671 -53.47142 1223.98131
1215.0000 -58.32404 -55.94165 2.38239 2.43178 -55.35779 1059.92505
1220.0000 -59.17553 -55.71123 3.46430 2.40780 -55.56821 1054.65687
1225.0000 -59.06586 -55.06406 4.00180 2.39507 -55.67996 1072.15775
1230.0000 -58.21079 -55.16379 3.04700 2.46130 -55.09866 1107.54071
1235.0000 -57.58786 -53.59441 3.99345 2.54062 -54.40253 1101.14983
1240.0000 -58.03234 -53.62070 4.41164 2.67233 -53.24657 1223.11559
1245.0000 -59.14098 -56.18577 2.95521 2.48389 -54.90040 1074.03568
1250.0000 -57.90445 -55.09159 2.81285 2.39503 -55.68029 993.43383
FREEZING PROCESS: loop number 6 T-loop= 1053.0000000000000
main_MD> interactions number 6 at Temperature= 1053.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.67449 -1.83209 0.03875
force_rgl> df(natom) -0.56595 -1.56314 -1.40948
1255.0000 -60.27772 -56.26909 4.00863 2.40382 -55.60315 999.22806
1260.0000 -59.92555 -56.29454 3.63101 2.24130 -57.02948 896.99630
1265.0000 -59.19401 -55.98002 3.21399 2.34775 -56.09529 994.42363
1270.0000 -58.85912 -55.88543 2.97369 2.36478 -55.94578 1011.78293
1275.0000 -59.13061 -55.05163 4.07898 2.41830 -55.47607 995.99823
1280.0000 -59.34602 -56.31917 3.02684 2.46968 -55.02516 1092.17534
1285.0000 -59.32860 -56.83026 2.49835 2.31413 -56.39035 905.15149
1290.0000 -59.27864 -55.67291 3.60573 2.30156 -56.50065 921.12128
1295.0000 -59.42065 -55.89964 3.52102 2.38087 -55.80459 985.14754
1300.0000 -57.92507 -54.32234 3.60273 2.48140 -54.92230 1088.48434
1305.0000 -57.36127 -54.43262 2.92864 2.53592 -54.44380 1138.92505
1310.0000 -59.13610 -54.92895 4.20715 2.50632 -54.70357 1088.12427
1315.0000 -59.26205 -55.58496 3.67710 2.53125 -54.48475 1123.54438
1320.0000 -58.46508 -54.60626 3.85881 2.44877 -55.20864 1076.09421
1325.0000 -59.06006 -54.59005 4.47001 2.54620 -54.35361 1152.86222
1330.0000 -58.68245 -55.56208 3.12037 2.41875 -55.47214 1004.14972
1335.0000 -59.11828 -56.64856 2.46972 2.35728 -56.01162 957.06120
1340.0000 -59.08090 -55.41972 3.66117 2.35100 -56.06673 980.70960
1345.0000 -59.36618 -56.14046 3.22572 2.37198 -55.88259 1009.06761
1350.0000 -58.78923 -55.37368 3.41555 2.45749 -55.13210 1108.12285
1355.0000 -59.02155 -55.45216 3.56939 2.43005 -55.37293 1042.37938
1360.0000 -58.21554 -55.30253 2.91301 2.43257 -55.35082 1022.24511
1365.0000 -58.77417 -55.53535 3.23882 2.46711 -55.04765 1098.86253
1370.0000 -59.18241 -54.95355 4.22886 2.39769 -55.65696 1045.92484
1375.0000 -59.33417 -56.24521 3.08896 2.37480 -55.85783 995.84159
1380.0000 -59.34230 -56.24358 3.09872 2.32478 -56.29681 913.33635
1385.0000 -59.55513 -56.38566 3.16948 2.30957 -56.43035 939.15499
1390.0000 -58.60827 -55.70394 2.90433 2.29827 -56.52950 918.57439
1395.0000 -59.37422 -55.01062 4.36360 2.45109 -55.18831 1051.50850
1400.0000 -58.03944 -55.21614 2.82330 2.40254 -55.61437 1032.80845
1405.0000 -59.20871 -55.66444 3.54426 2.44512 -55.24065 1036.71174
1410.0000 -58.28301 -53.84601 4.43700 2.54412 -54.37184 1162.94197
1415.0000 -58.68289 -54.66581 4.01708 2.50560 -54.70989 1072.13465
1420.0000 -58.28725 -53.77903 4.50822 2.55248 -54.29848 1158.09327
1425.0000 -58.02461 -54.41964 3.60497 2.57976 -54.05901 1177.52149
1430.0000 -58.30855 -54.92540 3.38315 2.53451 -54.45613 1099.51285
1435.0000 -57.83733 -54.77842 3.05891 2.57794 -54.07499 1141.24491
1440.0000 -59.31161 -56.44968 2.86193 2.39907 -55.64486 965.63660
1445.0000 -59.97899 -57.57019 2.40880 2.31552 -56.37812 906.93341
1450.0000 -58.58122 -54.94697 3.63424 2.35706 -56.01357 996.39110
1455.0000 -59.13941 -55.49082 3.64859 2.46951 -55.02663 1071.85104
1460.0000 -59.38295 -55.96805 3.41489 2.36956 -55.90387 989.56484
1465.0000 -58.55496 -55.44080 3.11416 2.39441 -55.68578 924.92265
1470.0000 -60.31408 -55.99357 4.32052 2.38463 -55.77161 1034.80930
1475.0000 -60.12987 -56.56835 3.56152 2.35766 -56.00830 999.26547
1480.0000 -57.90685 -55.18741 2.71944 2.34285 -56.13825 935.48782
1485.0000 -59.19958 -55.68250 3.51708 2.44252 -55.26353 1028.67029
1490.0000 -59.88573 -56.06057 3.82516 2.43435 -55.33520 1083.79165
1495.0000 -59.14833 -55.14764 4.00069 2.46610 -55.05657 1094.04460
1500.0000 -58.41202 -54.44797 3.96405 2.53106 -54.48646 1077.10782
FREEZING PROCESS: loop number 7 T-loop= 1028.0000000000000
main_MD> interactions number 7 at Temperature= 1028.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.60621 -0.60124 1.72430
force_rgl> df(natom) -0.83401 -0.49010 -1.46230
1505.0000 -58.86727 -54.76896 4.09831 2.57550 -54.09638 1203.13431
1510.0000 -58.23569 -56.11700 2.11869 2.31332 -56.39741 878.14617
1515.0000 -59.18025 -56.02543 3.15481 2.35001 -56.07544 933.24851
1520.0000 -59.10075 -55.97883 3.12192 2.40360 -55.60511 1050.11320
1525.0000 -58.01731 -54.47677 3.54053 2.47764 -54.95527 1101.01079
1530.0000 -59.31078 -56.78140 2.52939 2.41440 -55.51030 1003.24785
1535.0000 -59.87865 -57.73631 2.14235 2.21484 -57.26172 805.93780
1540.0000 -59.31868 -56.05315 3.26553 2.23725 -57.06504 812.79210
1545.0000 -59.68032 -56.62139 3.05893 2.28869 -56.61356 851.68109
1550.0000 -58.69632 -54.69902 3.99730 2.41638 -55.49290 1015.37951
1555.0000 -60.09352 -56.78520 3.30833 2.42264 -55.43795 1021.98881
1560.0000 -59.76754 -56.10101 3.66653 2.34157 -56.14951 1013.37302
1565.0000 -59.28294 -56.29780 2.98514 2.36573 -55.93743 977.04856
1570.0000 -58.34715 -54.77047 3.57668 2.45246 -55.17624 1078.56113
1575.0000 -59.11506 -55.35562 3.75943 2.45690 -55.13728 1062.23183
1580.0000 -59.03715 -54.95309 4.08406 2.42307 -55.43421 994.14757
1585.0000 -58.36595 -54.77882 3.58713 2.44611 -55.23197 1102.93971
1590.0000 -59.26490 -55.69218 3.57272 2.44763 -55.21871 1057.06344
1595.0000 -58.38160 -55.58462 2.79697 2.36234 -55.96724 1002.67883
1600.0000 -57.33794 -53.35182 3.98613 2.50891 -54.68085 1166.83300
1605.0000 -57.36585 -52.95894 4.40690 2.69319 -53.06353 1279.13978
1610.0000 -59.03666 -54.98457 4.05209 2.52556 -54.53472 1089.90825
1615.0000 -59.37632 -55.12773 4.24859 2.53297 -54.46970 1166.71084
1620.0000 -59.32282 -56.65327 2.66955 2.39781 -55.65593 1012.47409
1625.0000 -59.57283 -55.97277 3.60006 2.32897 -56.26009 929.17817
1630.0000 -58.02371 -55.58902 2.43469 2.35284 -56.05054 973.62225
1635.0000 -59.63147 -56.04085 3.59062 2.37176 -55.88453 994.90564
1640.0000 -58.41893 -54.82529 3.59364 2.44586 -55.23424 1056.24289
1645.0000 -58.95590 -54.48429 4.47161 2.51921 -54.59045 1084.93243
1650.0000 -58.95188 -55.76346 3.18843 2.44043 -55.28185 1039.94072
1655.0000 -59.06541 -55.52217 3.54324 2.46675 -55.05089 1094.26503
1660.0000 -59.66764 -56.24241 3.42523 2.43344 -55.34321 1062.37968
1665.0000 -60.03946 -56.18846 3.85101 2.34721 -56.10001 1007.63075
1670.0000 -59.33049 -56.66006 2.67043 2.27646 -56.72093 905.74358
1675.0000 -59.07891 -55.73626 3.34265 2.37463 -55.85935 979.06258
1680.0000 -60.19271 -56.48286 3.70985 2.29568 -56.55220 912.36833
1685.0000 -60.75568 -57.60204 3.15364 2.26868 -56.78916 933.11504
1690.0000 -60.07498 -56.70037 3.37462 2.24408 -57.00508 892.87150
1695.0000 -59.64173 -55.77409 3.86765 2.35984 -55.98918 949.39983
1700.0000 -59.62280 -55.56706 4.05573 2.39551 -55.67609 1105.93019
1705.0000 -59.27430 -55.47689 3.79740 2.36440 -55.94913 1001.63746
1710.0000 -58.25707 -55.44991 2.80716 2.42768 -55.39375 996.04391
1715.0000 -59.93063 -56.83488 3.09575 2.36479 -55.94570 999.39687
1720.0000 -60.65255 -57.65562 2.99693 2.20802 -57.32156 843.33269
1725.0000 -59.48395 -55.43328 4.05067 2.34652 -56.10601 972.25010
1730.0000 -60.35405 -56.66261 3.69144 2.38423 -55.77510 1022.36371
1735.0000 -59.19456 -55.85963 3.33493 2.33821 -56.17901 982.97678
1740.0000 -57.84352 -54.39022 3.45330 2.43591 -55.32148 1065.64824
1745.0000 -57.93185 -54.10747 3.82437 2.59451 -53.92954 1150.67941
1750.0000 -59.10781 -54.78605 4.32176 2.53461 -54.45529 1183.96415
FREEZING PROCESS: loop number 8 T-loop= 1003.0000000000000
main_MD> interactions number 8 at Temperature= 1003.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.65135 2.77161 -0.63013
force_rgl> df(natom) 0.41824 5.60004 -3.71126
1755.0000 -58.93481 -55.51979 3.41502 2.45375 -55.16496 1069.03218
1760.0000 -59.18518 -55.75394 3.43125 2.39116 -55.71427 1022.63129
1765.0000 -59.75047 -56.08236 3.66810 2.38241 -55.79107 1044.83304
1770.0000 -58.57830 -56.35713 2.22117 2.43054 -55.36863 1051.36218
1775.0000 -59.45904 -57.02071 2.43833 2.23852 -57.05389 841.88037
1780.0000 -59.29414 -56.27414 3.02000 2.29762 -56.53523 892.55745
1785.0000 -59.41079 -55.89050 3.52029 2.36938 -55.90538 986.24772
1790.0000 -59.90040 -57.04682 2.85357 2.25431 -56.91534 905.55234
1795.0000 -60.54867 -56.97223 3.57644 2.28789 -56.62064 985.77624
1800.0000 -59.19627 -55.30524 3.89103 2.29964 -56.51746 924.98827
1805.0000 -59.54582 -55.95261 3.59321 2.37216 -55.88104 977.94604
1810.0000 -58.91284 -56.02210 2.89074 2.34655 -56.10580 976.25479
1815.0000 -59.43588 -56.18097 3.25491 2.30982 -56.42813 960.18549
1820.0000 -59.65336 -56.59489 3.05847 2.28503 -56.64572 930.19535
1825.0000 -59.05249 -55.77826 3.27423 2.28567 -56.64006 962.29557
1830.0000 -59.85599 -56.33716 3.51884 2.40641 -55.58045 1025.10457
1835.0000 -57.22611 -53.65046 3.57565 2.53492 -54.45262 1121.75588
1840.0000 -59.54050 -56.07173 3.46877 2.43629 -55.31818 1121.07174
1845.0000 -57.93868 -54.47970 3.45898 2.43501 -55.32946 1021.28842
1850.0000 -58.98301 -55.71023 3.27277 2.48473 -54.89309 1103.31721
1855.0000 -59.35871 -55.55032 3.80839 2.39699 -55.66311 1004.71735
1860.0000 -59.15375 -55.65958 3.49417 2.37573 -55.84968 1024.71743
1865.0000 -58.29040 -54.45516 3.83524 2.43048 -55.36919 997.17705
1870.0000 -58.61665 -55.56151 3.05514 2.47422 -54.98527 1064.43324
1875.0000 -59.39211 -56.33838 3.05373 2.36919 -55.90712 943.08869
1880.0000 -59.57242 -56.25169 3.32073 2.34032 -56.16048 969.54303
1885.0000 -59.40417 -56.33938 3.06479 2.32334 -56.30952 973.16842
1890.0000 -59.33453 -55.23967 4.09486 2.39782 -55.65583 969.82537
1895.0000 -58.63872 -55.00069 3.63803 2.44655 -55.22811 1034.53011
1900.0000 -60.17964 -54.92815 5.25149 2.47863 -54.94657 1085.80166
1905.0000 -59.39717 -55.40739 3.98978 2.47193 -55.00538 1194.97453
1910.0000 -58.79546 -55.39212 3.40334 2.45060 -55.19263 1037.39597
1915.0000 -59.54290 -57.10872 2.43418 2.27931 -56.69594 890.95688
1920.0000 -60.28358 -56.74364 3.53994 2.24205 -57.02294 860.53561
1925.0000 -58.66630 -55.68566 2.98065 2.32687 -56.27849 943.04781
1930.0000 -59.38769 -55.44788 3.93981 2.43298 -55.34726 1075.29836
1935.0000 -59.00528 -54.90504 4.10024 2.42113 -55.45121 1017.49942
1940.0000 -59.30685 -55.94304 3.36380 2.40775 -55.56867 1010.03029
1945.0000 -59.68528 -56.71076 2.97452 2.36661 -55.92973 978.71172
1950.0000 -60.04495 -57.82629 2.21866 2.19543 -57.43209 808.37847
1955.0000 -59.97336 -57.18643 2.78693 2.19921 -57.39889 793.81389
1960.0000 -58.99545 -56.07452 2.92093 2.31055 -56.42174 919.57338
1965.0000 -59.74042 -56.89124 2.84918 2.33945 -56.16810 980.71125
1970.0000 -60.06180 -57.75519 2.30661 2.28312 -56.66245 929.06303
1975.0000 -60.45649 -57.34289 3.11360 2.18361 -57.53577 819.13446
1980.0000 -58.67033 -54.40706 4.26327 2.39371 -55.69186 1010.86946
1985.0000 -58.21870 -54.76897 3.44972 2.53799 -54.42564 1153.00000
1990.0000 -58.87470 -55.08316 3.79154 2.46059 -55.10495 1000.12935
1995.0000 -59.24056 -55.25106 3.98950 2.47391 -54.98801 1028.52187
2000.0000 -58.68940 -55.37621 3.31319 2.43295 -55.34750 1020.70276
FREEZING PROCESS: loop number 9 T-loop= 978.00000000000000
main_MD> interactions number 9 at Temperature= 978.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.46262 -2.51901 -4.77876
force_rgl> df(natom) -1.86706 -0.71933 -3.40340
2005.0000 -60.16585 -56.28723 3.87863 2.37388 -55.86588 1026.89616
2010.0000 -58.97446 -55.68159 3.29287 2.29661 -56.54410 966.31333
2015.0000 -59.95334 -56.95383 2.99951 2.29737 -56.53738 926.99339
2020.0000 -59.30637 -55.05064 4.25573 2.39344 -55.69424 1065.83453
2025.0000 -58.47424 -55.32254 3.15169 2.43289 -55.34805 969.86834
2030.0000 -58.88581 -54.13098 4.75483 2.44791 -55.21620 1099.09015
2035.0000 -57.82717 -54.56743 3.25974 2.58046 -54.05287 1175.61824
2040.0000 -58.32682 -54.62976 3.69706 2.51645 -54.61470 1103.30837
2045.0000 -58.52052 -55.52468 2.99584 2.45554 -55.14927 1057.60640
2050.0000 -58.48138 -54.59736 3.88402 2.51401 -54.63611 1111.79187
2055.0000 -59.24321 -55.46965 3.77357 2.44413 -55.24940 1066.00491
2060.0000 -58.67446 -54.52578 4.14868 2.49534 -54.79997 1143.25188
2065.0000 -59.36332 -55.75001 3.61331 2.42184 -55.44500 1032.50058
2070.0000 -59.12716 -55.92783 3.19933 2.36045 -55.98381 976.03332
2075.0000 -59.55285 -56.07165 3.48120 2.33404 -56.21561 951.69874
2080.0000 -60.30306 -56.64981 3.65325 2.33980 -56.16500 981.05055
2085.0000 -59.10257 -55.92458 3.17800 2.36315 -55.96013 946.62085
2090.0000 -59.73492 -57.11033 2.62459 2.35278 -56.05110 975.00536
2095.0000 -59.94467 -56.88558 3.05909 2.20132 -57.38033 831.09128
2100.0000 -59.64882 -55.90297 3.74585 2.30929 -56.43275 950.41019
2105.0000 -59.41494 -55.67844 3.73650 2.39785 -55.65552 1051.36821
2110.0000 -59.02013 -55.67213 3.34799 2.30990 -56.42741 909.45549
2115.0000 -59.49080 -55.21609 4.27471 2.38705 -55.75035 1000.37751
2120.0000 -59.77165 -56.24887 3.52278 2.36497 -55.94411 995.08864
2125.0000 -59.30971 -56.54163 2.76808 2.29019 -56.60044 919.50943
2130.0000 -60.32761 -57.34773 2.97987 2.23953 -57.04503 888.51241
2135.0000 -59.22774 -56.18009 3.04765 2.26235 -56.84472 882.77447
2140.0000 -60.22367 -56.90523 3.31845 2.28871 -56.61343 934.11172
2145.0000 -59.50967 -55.98277 3.52690 2.38658 -55.75450 991.97628
2150.0000 -59.28086 -56.38595 2.89491 2.29770 -56.53449 863.67620
2155.0000 -59.16355 -56.36061 2.80294 2.31309 -56.39945 956.84746
2160.0000 -58.30870 -54.41575 3.89295 2.45318 -55.16998 1070.03050
2165.0000 -59.02860 -55.33105 3.69755 2.48178 -54.91898 1147.99087
2170.0000 -58.13736 -54.45651 3.68085 2.51800 -54.60106 1150.15853
2175.0000 -58.84889 -55.41781 3.43108 2.54425 -54.37070 1139.11777
2180.0000 -59.01364 -55.63923 3.37441 2.40629 -55.58147 1007.66241
2185.0000 -59.57975 -56.22296 3.35680 2.37330 -55.87101 998.80237
2190.0000 -60.00455 -57.49646 2.50809 2.29975 -56.51655 982.42657
2195.0000 -59.99002 -57.16211 2.82791 2.29637 -56.54618 916.42730
2200.0000 -58.22285 -55.46097 2.76188 2.32319 -56.31083 964.86887
2205.0000 -58.81038 -55.17181 3.63856 2.42549 -55.41295 1000.82168
2210.0000 -59.01043 -54.37540 4.63503 2.43807 -55.30257 1057.96516
2215.0000 -57.28627 -53.29563 3.99063 2.56023 -54.23040 1220.68104
2220.0000 -59.37294 -55.76070 3.61225 2.48483 -54.89220 1093.88530
2225.0000 -59.62703 -56.71729 2.90974 2.33628 -56.19592 925.83582
2230.0000 -60.09785 -56.51847 3.57938 2.24493 -56.99765 884.61552
2235.0000 -60.42334 -56.93962 3.48372 2.27993 -56.69045 889.23026
2240.0000 -60.46996 -57.62957 2.84040 2.23313 -57.10117 852.53032
2245.0000 -60.54430 -56.47901 4.06529 2.24838 -56.96734 862.22970
2250.0000 -59.07758 -55.57991 3.49767 2.38491 -55.76908 988.56642
FREEZING PROCESS: loop number 10 T-loop= 953.00000000000000
main_MD> interactions number 10 at Temperature= 953.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.32557 -2.36447 0.81975
force_rgl> df(natom) -2.39792 0.69464 -3.01249
2255.0000 -60.06036 -56.36652 3.69384 2.39022 -55.72247 1005.76626
2260.0000 -60.86219 -57.50330 3.35889 2.26142 -56.85290 917.86264
2265.0000 -59.89095 -57.80086 2.09009 2.23005 -57.12824 890.36409
2270.0000 -60.01219 -56.60964 3.40254 2.21006 -57.30363 838.60029
2275.0000 -59.86574 -56.43205 3.43369 2.29250 -56.58012 943.59809
2280.0000 -59.31549 -56.35749 2.95799 2.37696 -55.83891 1015.32227
2285.0000 -59.48751 -56.88406 2.60344 2.30328 -56.48554 869.32606
2290.0000 -58.93187 -54.72843 4.20344 2.32703 -56.27712 910.53768
2295.0000 -59.43330 -55.85833 3.57498 2.38212 -55.79359 1045.24058
2300.0000 -59.29740 -55.30711 3.99030 2.38666 -55.75376 974.64884
2305.0000 -59.92300 -56.37478 3.54822 2.36483 -55.94533 988.45051
2310.0000 -59.50364 -56.06660 3.43704 2.28466 -56.64893 978.77622
2315.0000 -59.57237 -56.65488 2.91750 2.34499 -56.11947 987.84665
2320.0000 -58.77470 -55.16346 3.61124 2.36718 -55.92469 996.47320
2325.0000 -59.06124 -55.98646 3.07479 2.44637 -55.22975 1066.60849
2330.0000 -59.39820 -55.76845 3.62975 2.34400 -56.12816 945.43725
2335.0000 -59.11668 -56.12624 2.99044 2.40455 -55.59675 1017.90639
2340.0000 -59.44274 -55.97970 3.46305 2.31147 -56.41363 933.53775
2345.0000 -59.71953 -56.35246 3.36707 2.33493 -56.20780 994.96822
2350.0000 -59.80567 -56.96827 2.83739 2.23775 -57.06068 899.10427
2355.0000 -58.74973 -56.27068 2.47905 2.27214 -56.75882 922.71921
2360.0000 -59.34296 -56.08697 3.25598 2.35465 -56.03465 989.15551
2365.0000 -60.20195 -57.07644 3.12551 2.29129 -56.59074 914.54540
2370.0000 -59.21168 -56.10424 3.10744 2.27873 -56.70103 925.10216
2375.0000 -59.52713 -56.56993 2.95719 2.34018 -56.16171 965.41981
2380.0000 -59.83830 -56.67885 3.15944 2.27262 -56.75461 898.65939
2385.0000 -60.46663 -57.74710 2.71953 2.20520 -57.34633 829.01401
2390.0000 -58.07542 -55.24634 2.82908 2.25590 -56.90136 857.58065
2395.0000 -58.51978 -54.97734 3.54245 2.48255 -54.91215 991.00740
2400.0000 -59.28793 -56.16193 3.12601 2.42478 -55.41918 1011.52063
2405.0000 -58.82356 -54.88070 3.94286 2.46836 -55.03669 1093.50926
2410.0000 -59.80388 -56.46652 3.33737 2.42933 -55.37931 1082.65791
2415.0000 -58.24430 -55.21091 3.03338 2.39667 -55.66587 1016.44037
2420.0000 -58.89289 -54.94631 3.94658 2.49811 -54.77561 1101.81349
2425.0000 -58.25013 -55.05825 3.19188 2.43324 -55.34496 1058.34927
2430.0000 -58.86202 -54.96626 3.89576 2.45574 -55.14745 1065.56092
2435.0000 -59.39515 -55.89180 3.50335 2.38784 -55.74343 1013.42876
2440.0000 -59.05671 -55.38834 3.66837 2.38815 -55.74071 967.92475
2445.0000 -58.32304 -55.29812 3.02492 2.39388 -55.69035 1015.11876
2450.0000 -59.47819 -56.48744 2.99076 2.41797 -55.47895 975.36960
2455.0000 -59.03430 -55.26529 3.76901 2.38779 -55.74385 956.94816
2460.0000 -59.71155 -56.90591 2.80564 2.29363 -56.57022 909.97617
2465.0000 -58.72341 -55.13300 3.59041 2.38094 -55.80400 996.30387
2470.0000 -59.25771 -56.49938 2.75833 2.35491 -56.03244 931.58997
2475.0000 -58.44034 -55.83262 2.60772 2.27623 -56.72294 901.25058
2480.0000 -60.46400 -56.95827 3.50573 2.27743 -56.71244 877.86128
2485.0000 -60.19327 -57.06618 3.12709 2.29960 -56.51784 962.68798
2490.0000 -59.82738 -56.60316 3.22421 2.30765 -56.44714 931.97933
2495.0000 -59.60347 -56.79684 2.80663 2.25800 -56.88294 932.83077
2500.0000 -60.43130 -57.47837 2.95293 2.24798 -56.97084 881.20444
FREEZING PROCESS: loop number 11 T-loop= 928.00000000000000
main_MD> interactions number 11 at Temperature= 928.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.07949 -0.50846 4.60336
force_rgl> df(natom) -1.78610 2.45968 2.01929
2505.0000 -60.01323 -57.22311 2.79012 2.21949 -57.22095 818.80404
2510.0000 -59.03777 -56.63203 2.40574 2.25862 -56.87753 871.96786
2515.0000 -59.12163 -56.03210 3.08953 2.33093 -56.24289 947.28733
2520.0000 -59.98992 -56.78794 3.20198 2.35257 -56.05292 936.40376
2525.0000 -60.16063 -57.27605 2.88457 2.21633 -57.24867 870.85150
2530.0000 -60.25953 -57.06118 3.19835 2.25500 -56.90927 911.08021
2535.0000 -61.04048 -57.88971 3.15077 2.17530 -57.60874 857.03930
2540.0000 -60.02950 -56.94236 3.08714 2.10782 -58.20095 724.97785
2545.0000 -60.31488 -56.10092 4.21395 2.28917 -56.60939 940.06814
2550.0000 -60.29746 -57.61461 2.68286 2.28635 -56.63413 903.26702
2555.0000 -60.44039 -56.90032 3.54007 2.23981 -57.04259 861.49590
2560.0000 -60.01029 -57.81596 2.19433 2.17449 -57.61584 787.53355
2565.0000 -59.55309 -56.72312 2.82997 2.21545 -57.25632 852.77007
2570.0000 -60.46788 -57.38581 3.08207 2.25861 -56.87762 882.90232
2575.0000 -59.83097 -57.42484 2.40613 2.22554 -57.16780 854.47905
2580.0000 -59.62441 -57.31647 2.30794 2.17332 -57.62615 808.33883
2585.0000 -61.00551 -57.43817 3.56734 2.20481 -57.34970 839.12349
2590.0000 -59.84774 -56.03753 3.81021 2.21791 -57.23479 883.30589
2595.0000 -60.14140 -56.40385 3.73755 2.32723 -56.27533 956.50452
2600.0000 -61.08708 -57.79879 3.28829 2.20521 -57.34621 862.19990
2605.0000 -59.94949 -57.11465 2.83484 2.21591 -57.25231 876.91940
2610.0000 -58.91772 -55.94629 2.97143 2.32260 -56.31594 956.39119
2615.0000 -60.00960 -56.08251 3.92708 2.37631 -55.84462 1010.75739
2620.0000 -59.00051 -56.10947 2.89104 2.38783 -55.74351 1026.11076
2625.0000 -60.29993 -56.58268 3.71725 2.31463 -56.38594 927.90728
2630.0000 -58.89641 -55.78402 3.11238 2.31601 -56.37383 963.16980
2635.0000 -60.03039 -55.99587 4.03451 2.32910 -56.25896 958.83365
2640.0000 -58.16822 -55.29039 2.87783 2.40048 -55.63246 973.90781
2645.0000 -58.97094 -56.33003 2.64091 2.31437 -56.38818 920.58418
2650.0000 -59.46723 -56.47809 2.98914 2.34817 -56.09157 965.87352
2655.0000 -58.76227 -55.36520 3.39708 2.38194 -55.79518 967.89558
2660.0000 -59.20120 -56.55689 2.64431 2.30952 -56.43079 887.98792
2665.0000 -59.84358 -56.75642 3.08716 2.28054 -56.68509 901.27897
2670.0000 -60.11341 -57.68101 2.43240 2.22869 -57.14015 843.37671
2675.0000 -59.86047 -57.15488 2.70558 2.20381 -57.35849 841.88693
2680.0000 -60.90523 -57.73787 3.16736 2.20249 -57.37012 821.74505
2685.0000 -59.91094 -58.13415 1.77679 2.16174 -57.72778 740.96055
2690.0000 -58.72597 -55.86311 2.86286 2.23604 -57.07569 851.75558
2695.0000 -58.43113 -54.71926 3.71187 2.43505 -55.32908 1025.33049
2700.0000 -58.30141 -55.31244 2.98897 2.46309 -55.08296 1026.87204
2705.0000 -59.72365 -56.26990 3.45375 2.41404 -55.51345 1001.82276
2710.0000 -59.01712 -56.25274 2.76438 2.30318 -56.48644 895.16992
2715.0000 -58.29159 -55.79361 2.49798 2.32730 -56.27471 905.78586
2720.0000 -59.62742 -56.29404 3.33338 2.33718 -56.18802 963.18251
2725.0000 -59.68186 -56.85830 2.82356 2.27821 -56.70560 919.88488
2730.0000 -59.66814 -56.87366 2.79448 2.28091 -56.68184 914.21335
2735.0000 -60.36503 -56.82139 3.54364 2.24729 -56.97691 840.47617
2740.0000 -59.55642 -55.90098 3.65544 2.28756 -56.62350 920.38370
2745.0000 -59.04050 -55.44598 3.59453 2.36953 -55.90408 1016.48244
2750.0000 -59.10893 -56.40167 2.70727 2.32694 -56.27790 979.18223
FREEZING PROCESS: loop number 12 T-loop= 903.00000000000000
main_MD> interactions number 12 at Temperature= 903.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.47057 -0.32661 1.39563
force_rgl> df(natom) 1.00534 -0.17812 -1.98666
2755.0000 -59.42755 -56.53459 2.89296 2.37972 -55.81468 1023.10945
2760.0000 -59.74296 -56.41652 3.32644 2.25665 -56.89480 888.60359
2765.0000 -58.62660 -55.76358 2.86302 2.33268 -56.22751 923.80759
2770.0000 -60.30982 -57.60410 2.70572 2.33790 -56.18171 970.01879
2775.0000 -59.60011 -56.68042 2.91969 2.23941 -57.04609 869.37705
2780.0000 -59.94990 -56.78379 3.16612 2.23934 -57.04666 847.75902
2785.0000 -59.85331 -56.90462 2.94868 2.21952 -57.22064 860.37470
2790.0000 -60.76001 -57.55727 3.20274 2.16593 -57.69096 829.40541
2795.0000 -60.97259 -58.78522 2.18737 2.14262 -57.89551 818.40204
2800.0000 -60.74323 -58.08402 2.65921 2.07149 -58.51983 755.33470
2805.0000 -59.89045 -57.00758 2.88287 2.16352 -57.71209 776.34499
2810.0000 -60.11673 -57.49710 2.61963 2.21757 -57.23771 803.90063
2815.0000 -60.10245 -57.28310 2.81934 2.21651 -57.24707 843.47315
2820.0000 -59.68014 -56.30276 3.37738 2.26984 -56.77900 906.42153
2825.0000 -59.95933 -57.35554 2.60378 2.27852 -56.70287 898.48079
2830.0000 -59.89130 -57.14262 2.74868 2.26049 -56.86107 898.65243
2835.0000 -60.83263 -57.87212 2.96051 2.17081 -57.64814 833.18175
2840.0000 -60.42085 -57.53190 2.88895 2.18171 -57.55250 820.81112
2845.0000 -59.73759 -56.18274 3.55485 2.35579 -56.02468 995.60846
2850.0000 -59.05245 -56.45437 2.59807 2.24931 -56.95922 903.53788
2855.0000 -58.90373 -56.51223 2.39149 2.33896 -56.17241 971.95819
2860.0000 -58.89901 -56.44363 2.45538 2.34174 -56.14796 958.42211
2865.0000 -59.48503 -55.99602 3.48902 2.38531 -55.76559 989.56292
2870.0000 -59.56221 -56.41987 3.14234 2.34709 -56.10104 992.92277
2875.0000 -60.42342 -57.91281 2.51060 2.23264 -57.10547 843.01178
2880.0000 -59.50838 -56.70567 2.80271 2.24671 -56.98200 826.20100
2885.0000 -59.37014 -56.47340 2.89674 2.32204 -56.32090 916.40458
2890.0000 -58.90599 -55.70144 3.20454 2.32182 -56.32278 923.31185
2895.0000 -60.05225 -56.25152 3.80073 2.35684 -56.01544 998.61608
2900.0000 -58.88780 -56.76305 2.12475 2.28232 -56.66948 871.09761
2905.0000 -59.99107 -57.51429 2.47677 2.24088 -57.03321 799.52556
2910.0000 -60.04203 -57.44194 2.60009 2.17663 -57.59705 751.96678
2915.0000 -59.99591 -58.13075 1.86516 2.17219 -57.63606 774.47355
2920.0000 -59.44693 -56.38805 3.05887 2.25325 -56.92463 881.98763
2925.0000 -59.84849 -56.88303 2.96546 2.27297 -56.75152 863.91510
2930.0000 -59.34954 -55.89732 3.45222 2.37070 -55.89384 1012.36912
2935.0000 -59.41503 -56.39524 3.01979 2.31879 -56.34943 964.59070
2940.0000 -59.60006 -56.47903 3.12103 2.28977 -56.60410 866.38721
2945.0000 -59.92872 -56.88592 3.04280 2.26379 -56.83210 853.81873
2950.0000 -59.43672 -56.88217 2.55455 2.25724 -56.88962 845.93593
2955.0000 -60.24460 -56.25526 3.98934 2.26037 -56.86216 929.18531
2960.0000 -59.33504 -56.29120 3.04384 2.31870 -56.35020 932.18336
2965.0000 -59.71311 -56.93309 2.78002 2.27007 -56.77701 861.17535
2970.0000 -60.14228 -57.11739 3.02488 2.16294 -57.71721 712.04118
2975.0000 -59.91553 -57.12173 2.79379 2.26005 -56.86491 869.13817
2980.0000 -60.64996 -58.40844 2.24151 2.15217 -57.81172 806.73128
2985.0000 -60.55781 -58.13890 2.41890 2.11442 -58.14305 756.03549
2990.0000 -60.35790 -57.68583 2.67207 2.12617 -58.03995 755.21864
2995.0000 -60.71496 -58.10093 2.61403 2.15393 -57.79632 776.36135
3000.0000 -60.97474 -58.11451 2.86023 2.08215 -58.42624 731.25508
FREEZING PROCESS: loop number 13 T-loop= 878.00000000000000
main_MD> interactions number 13 at Temperature= 878.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 3.84217 2.34160 -1.30593
force_rgl> df(natom) 1.60782 3.26088 0.23259
3005.0000 -60.59935 -57.86565 2.73370 2.21522 -57.25838 885.24854
3010.0000 -60.52424 -58.11358 2.41066 2.13952 -57.92272 778.01783
3015.0000 -60.15375 -57.44064 2.71310 2.10869 -58.19336 767.10187
3020.0000 -61.94287 -59.15250 2.79037 2.11992 -58.09479 754.49744
3025.0000 -59.47265 -57.12784 2.34482 2.10942 -58.18691 768.77984
3030.0000 -60.39215 -57.76426 2.62790 2.16229 -57.72291 794.48178
3035.0000 -59.69285 -57.43884 2.25401 2.19584 -57.42850 839.96154
3040.0000 -60.53434 -57.33741 3.19692 2.27231 -56.75731 909.92740
3045.0000 -61.28961 -58.00817 3.28143 2.21394 -57.26962 831.76167
3050.0000 -61.05641 -58.34132 2.71509 2.16424 -57.70580 787.63299
3055.0000 -61.71726 -59.20341 2.51385 2.05171 -58.69337 683.53231
3060.0000 -60.04778 -58.08372 1.96406 2.06897 -58.54193 729.50793
3065.0000 -61.52759 -58.91177 2.61582 2.12825 -58.02168 748.04538
3070.0000 -60.96701 -58.48706 2.47995 2.05678 -58.64890 733.91588
3075.0000 -60.63464 -57.57095 3.06369 2.11115 -58.17175 781.26051
3080.0000 -60.52329 -57.89132 2.63197 2.13533 -57.95952 757.38048
3085.0000 -60.37029 -57.23575 3.13454 2.18210 -57.54908 852.81520
3090.0000 -60.85983 -57.54110 3.31872 2.16638 -57.68706 830.44243
3095.0000 -61.38279 -58.89496 2.48783 2.10068 -58.26363 767.94225
3100.0000 -60.37688 -57.50387 2.87301 2.13677 -57.94689 773.98758
3105.0000 -59.54901 -56.11401 3.43500 2.23632 -57.07323 814.79611
3110.0000 -59.85171 -55.67947 4.17224 2.44195 -55.26850 1073.96839
3115.0000 -60.32899 -57.67825 2.65074 2.27946 -56.69460 882.77973
3120.0000 -59.77023 -56.78506 2.98516 2.21714 -57.24149 887.24882
3125.0000 -60.65359 -58.11874 2.53485 2.16086 -57.73546 796.52189
3130.0000 -59.54944 -57.16485 2.38459 2.21144 -57.29154 808.81986
3135.0000 -59.18969 -56.34061 2.84909 2.29971 -56.51688 932.47041
3140.0000 -59.30452 -56.31981 2.98471 2.32123 -56.32795 917.47943
3145.0000 -58.93946 -55.32782 3.61164 2.40163 -55.62240 1003.31956
3150.0000 -59.78815 -56.68569 3.10246 2.28676 -56.63050 902.86620
3155.0000 -60.36416 -56.54773 3.81643 2.26983 -56.77913 916.34558
3160.0000 -59.70493 -57.07870 2.62623 2.27453 -56.73784 892.60469
3165.0000 -59.58937 -56.75841 2.83095 2.26478 -56.82339 891.26368
3170.0000 -59.93783 -56.45261 3.48522 2.31367 -56.39436 891.73804
3175.0000 -59.77077 -57.63983 2.13095 2.25680 -56.89345 865.45948
3180.0000 -59.11576 -56.42962 2.68614 2.25254 -56.93084 904.24642
3185.0000 -59.66199 -56.70170 2.96029 2.35083 -56.06820 987.22095
3190.0000 -59.27667 -56.56691 2.70976 2.26499 -56.82160 861.22010
3195.0000 -60.16642 -57.25005 2.91637 2.22919 -57.13578 886.29292
3200.0000 -59.50903 -55.43704 4.07199 2.37778 -55.83170 1014.67548
3205.0000 -59.38745 -57.19401 2.19344 2.33540 -56.20366 949.00029
3210.0000 -60.33980 -57.83546 2.50434 2.18911 -57.48749 848.44317
3215.0000 -59.83272 -57.43438 2.39834 2.15330 -57.80178 771.34211
3220.0000 -59.68258 -56.98042 2.70217 2.22079 -57.20953 845.49137
3225.0000 -59.21560 -56.37924 2.83636 2.31256 -56.40405 934.15588
3230.0000 -59.57256 -56.51860 3.05397 2.29502 -56.55807 931.86841
3235.0000 -59.16358 -57.28149 1.88209 2.27344 -56.74743 905.76045
3240.0000 -59.78696 -56.54267 3.24429 2.25334 -56.92385 901.52548
3245.0000 -58.54821 -55.29677 3.25144 2.31257 -56.40402 888.33688
3250.0000 -59.06973 -55.79443 3.27531 2.45399 -55.16286 1129.11868
FREEZING PROCESS: loop number 14 T-loop= 853.00000000000000
main_MD> interactions number 14 at Temperature= 853.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.53365 -0.04215 0.74649
force_rgl> df(natom) -5.43632 4.95981 -0.78511
3255.0000 -58.91569 -56.19738 2.71832 2.35757 -56.00907 955.59855
3260.0000 -59.47880 -56.21956 3.25924 2.32122 -56.32804 889.78325
3265.0000 -59.73015 -57.24374 2.48641 2.30600 -56.46167 909.05241
3270.0000 -60.28804 -57.41396 2.87408 2.19496 -57.43623 806.51389
3275.0000 -59.65175 -57.16437 2.48738 2.19004 -57.47936 753.41114
3280.0000 -60.44172 -57.80329 2.63843 2.21676 -57.24483 843.67631
3285.0000 -60.72640 -57.89455 2.83185 2.18767 -57.50017 815.23606
3290.0000 -60.22433 -57.65605 2.56828 2.20634 -57.33628 861.94225
3295.0000 -60.22899 -56.94806 3.28094 2.19314 -57.45215 799.90063
3300.0000 -59.48989 -56.34532 3.14456 2.30436 -56.47606 959.91543
3305.0000 -59.59842 -56.63946 2.95896 2.27569 -56.72770 894.09918
3310.0000 -58.98665 -55.20332 3.78333 2.40610 -55.58313 1000.01293
3315.0000 -61.21008 -57.73178 3.47830 2.37583 -55.84879 1040.47305
3320.0000 -59.94881 -56.58072 3.36809 2.20667 -57.33343 894.73239
3325.0000 -60.12752 -58.09888 2.02864 2.19194 -57.46266 801.59449
3330.0000 -61.53061 -58.71600 2.81461 2.07574 -58.48250 753.79498
3335.0000 -61.55128 -58.45316 3.09812 2.10130 -58.25821 778.35143
3340.0000 -60.57152 -57.97479 2.59673 2.13264 -57.98318 724.85341
3345.0000 -60.27233 -57.72396 2.54837 2.16932 -57.66122 806.43114
3350.0000 -60.16220 -55.74884 4.41336 2.31206 -56.40850 922.04902
3355.0000 -60.37764 -57.13674 3.24090 2.28855 -56.61479 913.34466
3360.0000 -60.27750 -57.49498 2.78252 2.22342 -57.18646 819.18487
3365.0000 -60.10656 -57.47678 2.62978 2.15992 -57.74374 796.95414
3370.0000 -59.60474 -57.11844 2.48630 2.24369 -57.00850 880.23101
3375.0000 -60.01806 -57.58010 2.43796 2.25187 -56.93674 901.15611
3380.0000 -61.04501 -57.86982 3.17519 2.21500 -57.26033 809.15929
3385.0000 -60.73691 -58.18344 2.55347 2.11569 -58.13192 741.34970
3390.0000 -60.13307 -58.06356 2.06951 2.05591 -58.65659 663.59117
3395.0000 -60.90403 -58.00211 2.90192 2.11275 -58.15774 796.71739
3400.0000 -60.35439 -57.29065 3.06374 2.11652 -58.12465 762.37125
3405.0000 -60.58229 -57.55739 3.02489 2.19089 -57.47189 823.32564
3410.0000 -59.40859 -56.47088 2.93772 2.25504 -56.90890 901.25837
3415.0000 -59.90810 -57.02458 2.88351 2.32261 -56.31587 924.89167
3420.0000 -59.21982 -55.91021 3.30961 2.34739 -56.09836 986.49481
3425.0000 -59.10203 -55.82249 3.27955 2.32959 -56.25463 973.34307
3430.0000 -58.42948 -56.66649 1.76299 2.34350 -56.13254 964.44549
3435.0000 -59.86782 -55.44350 4.42432 2.30605 -56.46126 919.63566
3440.0000 -58.86594 -55.57364 3.29229 2.42130 -55.44979 1031.59618
3445.0000 -58.79268 -55.71399 3.07869 2.37696 -55.83887 955.66577
3450.0000 -60.30194 -56.20744 4.09450 2.36076 -55.98106 985.04023
3455.0000 -59.74365 -56.71106 3.03259 2.28874 -56.61317 899.86113
3460.0000 -58.85155 -56.00293 2.84862 2.33029 -56.24848 943.57626
3465.0000 -59.69827 -57.53722 2.16106 2.24775 -56.97287 835.76282
3470.0000 -60.10828 -56.76054 3.34774 2.23842 -57.05480 863.76399
3475.0000 -60.56146 -56.96998 3.59148 2.19122 -57.46903 885.07987
3480.0000 -60.08211 -57.56404 2.51807 2.16392 -57.70864 865.23380
3485.0000 -59.72091 -57.22987 2.49104 2.19992 -57.39270 828.82154
3490.0000 -59.96092 -57.11396 2.84696 2.29036 -56.59888 897.20058
3495.0000 -59.60555 -57.04719 2.55837 2.27932 -56.69578 915.91923
3500.0000 -60.80589 -57.60600 3.19989 2.19545 -57.43191 868.33345
FREEZING PROCESS: loop number 15 T-loop= 828.00000000000000
main_MD> interactions number 15 at Temperature= 828.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.42066 4.81169 3.50729
force_rgl> df(natom) -1.18069 2.78039 2.04991
3505.0000 -60.21973 -57.55242 2.66731 2.11095 -58.17346 775.29954
3510.0000 -59.82758 -56.61456 3.21302 2.19723 -57.41626 831.01380
3515.0000 -59.36424 -56.62584 2.73840 2.33060 -56.24577 988.72065
3520.0000 -59.48694 -56.66073 2.82620 2.28476 -56.64808 900.58873
3525.0000 -59.25296 -56.45840 2.79456 2.29795 -56.53230 928.32448
3530.0000 -59.67979 -56.84826 2.83153 2.27996 -56.69024 928.77524
3535.0000 -60.50061 -58.08895 2.41166 2.23527 -57.08237 877.66999
3540.0000 -60.58209 -57.62811 2.95399 2.16038 -57.73964 790.81251
3545.0000 -60.55835 -58.45396 2.10438 2.10193 -58.25263 765.43960
3550.0000 -60.52436 -57.81046 2.71390 2.10214 -58.25079 790.09018
3555.0000 -60.37841 -57.79547 2.58294 2.14354 -57.88744 805.02120
3560.0000 -60.59282 -57.61230 2.98053 2.14409 -57.88267 808.72824
3565.0000 -59.01054 -55.65423 3.35631 2.25589 -56.90148 967.18140
3570.0000 -58.72666 -56.29656 2.43010 2.33896 -56.17242 967.36346
3575.0000 -59.97071 -57.88238 2.08832 2.27594 -56.72546 869.27067
3580.0000 -61.80953 -57.76934 4.04019 2.11510 -58.13705 759.35520
3585.0000 -59.62654 -57.49650 2.13004 2.14890 -57.84046 797.18988
3590.0000 -60.15358 -56.91525 3.23833 2.19838 -57.40618 835.15675
3595.0000 -61.07966 -57.82240 3.25726 2.18283 -57.54264 822.49186
3600.0000 -59.92989 -57.28094 2.64895 2.18952 -57.48389 757.98643
3605.0000 -60.00516 -57.16096 2.84421 2.23970 -57.04355 851.51638
3610.0000 -60.01481 -56.58885 3.42595 2.25764 -56.88607 880.88109
3615.0000 -59.62830 -57.42533 2.20297 2.24384 -57.00719 864.81381
3620.0000 -61.28349 -57.86924 3.41425 2.20615 -57.33802 871.37173
3625.0000 -60.52859 -56.73816 3.79043 2.23002 -57.12845 883.95920
3630.0000 -60.19196 -57.86677 2.32519 2.27800 -56.70742 927.82656
3635.0000 -60.69358 -58.09981 2.59377 2.14266 -57.89516 781.21458
3640.0000 -61.27858 -59.00784 2.27074 2.04966 -58.71137 677.68005
3645.0000 -60.21161 -57.68312 2.52849 2.11015 -58.18050 734.31220
3650.0000 -60.45990 -57.31518 3.14472 2.21362 -57.27247 831.59230
3655.0000 -60.24607 -57.44817 2.79790 2.24386 -57.00702 859.47279
3660.0000 -60.49623 -57.47151 3.02472 2.19571 -57.42964 842.69816
3665.0000 -60.25404 -56.53971 3.71433 2.24506 -56.99649 927.29030
3670.0000 -59.45018 -56.75548 2.69470 2.25182 -56.93714 914.34769
3675.0000 -58.97244 -56.26185 2.71059 2.31850 -56.35197 956.22704
3680.0000 -59.12315 -56.20002 2.92313 2.30930 -56.43266 930.51653
3685.0000 -59.75741 -57.53942 2.21799 2.24678 -56.98136 889.27592
3690.0000 -59.85686 -57.70824 2.14863 2.19699 -57.41834 783.42883
3695.0000 -60.55073 -57.71391 2.83683 2.18390 -57.53325 811.82381
3700.0000 -60.12506 -58.10883 2.01624 2.17544 -57.60747 825.66467
3705.0000 -61.11835 -58.39000 2.72835 2.15112 -57.82095 800.75065
3710.0000 -61.04561 -58.41669 2.62893 2.07753 -58.46681 725.06966
3715.0000 -60.24646 -57.46007 2.78639 2.17012 -57.65420 811.66847
3720.0000 -61.19099 -58.63220 2.55879 2.11887 -58.10398 773.37207
3725.0000 -60.88823 -58.46024 2.42799 2.04543 -58.74848 695.48847
3730.0000 -61.17014 -58.54647 2.62367 2.09821 -58.28530 751.49165
3735.0000 -60.04642 -57.60073 2.44569 2.08154 -58.43159 682.22069
3740.0000 -59.55643 -56.37653 3.17990 2.22292 -57.19082 820.66989
3745.0000 -58.40398 -55.53478 2.86920 2.37413 -55.86369 953.27839
3750.0000 -59.59732 -57.11726 2.48006 2.28606 -56.63664 900.10622
FREEZING PROCESS: loop number 16 T-loop= 803.00000000000000
main_MD> interactions number 16 at Temperature= 803.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.65154 -1.97938 -2.48709
force_rgl> df(natom) -0.12207 -0.13403 0.81990
3755.0000 -60.65430 -58.54284 2.11146 2.11472 -58.14041 754.62749
3760.0000 -60.65552 -57.05688 3.59864 2.15203 -57.81298 801.57438
3765.0000 -60.92042 -58.10222 2.81820 2.21278 -57.27976 858.17214
3770.0000 -59.90413 -58.05438 1.84975 2.12657 -58.03638 734.76861
3775.0000 -59.70103 -57.32002 2.38101 2.19658 -57.42198 797.12831
3780.0000 -60.13034 -57.18064 2.94969 2.19623 -57.42501 769.60425
3785.0000 -59.88011 -57.74910 2.13101 2.18741 -57.50244 815.26802
3790.0000 -60.11311 -57.82672 2.28639 2.16760 -57.67629 738.96830
3795.0000 -60.01061 -57.14527 2.86534 2.19480 -57.43756 808.66279
3800.0000 -60.33879 -57.95218 2.38661 2.16764 -57.67597 823.00986
3805.0000 -61.56341 -58.87190 2.69151 2.06115 -58.61056 729.98192
3810.0000 -61.09363 -58.69865 2.39498 2.05263 -58.68535 680.84122
3815.0000 -61.36046 -58.34858 3.01189 2.08585 -58.39378 748.49707
3820.0000 -60.98400 -58.84238 2.14161 2.08591 -58.39326 731.59934
3825.0000 -60.01714 -57.80366 2.21348 2.08538 -58.39787 717.10016
3830.0000 -60.32142 -57.69594 2.62548 2.22684 -57.15636 863.69269
3835.0000 -60.48210 -58.34543 2.13667 2.07190 -58.51622 718.11793
3840.0000 -60.60673 -58.15067 2.45606 2.07418 -58.49622 691.81717
3845.0000 -60.43300 -57.85658 2.57642 2.15579 -57.77996 789.09376
3850.0000 -60.94913 -58.21413 2.73499 2.14178 -57.90289 783.87060
3855.0000 -61.46488 -58.63514 2.82973 2.05901 -58.62938 720.15583
3860.0000 -60.63249 -57.51980 3.11269 2.10204 -58.25171 763.83093
3865.0000 -59.98262 -57.87635 2.10627 2.09417 -58.32075 753.45141
3870.0000 -60.25481 -58.02697 2.22784 2.16438 -57.70458 796.51111
3875.0000 -60.25247 -58.20510 2.04737 2.13409 -57.97044 773.22373
3880.0000 -61.08731 -58.84365 2.24366 2.09363 -58.32548 751.37716
3885.0000 -61.17234 -58.69024 2.48210 2.10318 -58.24171 715.67249
3890.0000 -61.59696 -59.12125 2.47571 2.01764 -58.99241 639.90090
3895.0000 -59.57600 -57.09051 2.48549 2.07185 -58.51664 700.46216
3900.0000 -59.45224 -56.98229 2.46994 2.23781 -57.06013 882.45149
3905.0000 -61.09033 -57.59653 3.49380 2.18399 -57.53245 862.06626
3910.0000 -61.05765 -58.40375 2.65391 2.12182 -58.07808 786.07199
3915.0000 -60.96547 -58.30406 2.66141 2.09085 -58.34994 782.53775
3920.0000 -60.18834 -57.13051 3.05783 2.16809 -57.67200 764.06763
3925.0000 -60.62054 -57.76918 2.85136 2.16068 -57.73707 759.62146
3930.0000 -60.35929 -57.70887 2.65042 2.18116 -57.55730 839.06763
3935.0000 -60.63103 -57.92166 2.70937 2.11191 -58.16504 715.73601
3940.0000 -60.66787 -58.07196 2.59591 2.13798 -57.93627 771.45956
3945.0000 -61.10654 -58.74641 2.36013 2.08470 -58.40388 788.35592
3950.0000 -60.26280 -57.06051 3.20229 2.11790 -58.11251 775.69816
3955.0000 -59.96186 -56.87740 3.08447 2.22013 -57.21527 894.45765
3960.0000 -60.60919 -56.97410 3.63509 2.25546 -56.90522 837.11433
3965.0000 -61.28797 -59.08366 2.20431 2.06854 -58.54570 699.83231
3970.0000 -60.53023 -57.33778 3.19245 2.08796 -58.37526 767.22664
3975.0000 -59.89715 -57.17338 2.72377 2.20029 -57.38944 907.85515
3980.0000 -60.62647 -57.96086 2.66560 2.13675 -57.94704 781.64134
3985.0000 -60.69133 -58.00967 2.68166 2.12320 -58.06600 790.38146
3990.0000 -59.92733 -57.58804 2.33928 2.14985 -57.83208 788.53206
3995.0000 -59.72879 -57.78172 1.94708 2.23105 -57.11942 865.39335
4000.0000 -61.21241 -58.32728 2.88513 2.15355 -57.79959 858.28587
FREEZING PROCESS: loop number 17 T-loop= 778.00000000000000
main_MD> interactions number 17 at Temperature= 778.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -2.38997 2.22873 -0.64534
force_rgl> df(natom) 0.60190 0.12144 1.94604
4005.0000 -60.32957 -57.66886 2.66071 2.09797 -58.28745 755.01640
4010.0000 -59.58320 -56.87917 2.70403 2.20380 -57.35865 854.11117
4015.0000 -59.37521 -56.99620 2.37901 2.28463 -56.64919 871.18211
4020.0000 -61.04288 -57.86913 3.17375 2.20384 -57.35829 833.12184
4025.0000 -60.48959 -58.18361 2.30598 2.09953 -58.27374 745.06969
4030.0000 -60.15452 -57.71961 2.43491 2.11385 -58.14801 778.60334
4035.0000 -59.82875 -57.52705 2.30170 2.15443 -57.79188 838.47826
4040.0000 -60.52250 -57.79360 2.72890 2.09837 -58.28394 686.54083
4045.0000 -60.95961 -57.47260 3.48701 2.18276 -57.54330 801.02419
4050.0000 -60.09678 -57.18139 2.91538 2.21724 -57.24067 851.44300
4055.0000 -60.93722 -57.73220 3.20502 2.21611 -57.25057 821.58680
4060.0000 -60.25035 -57.69974 2.55061 2.14720 -57.85537 786.53981
4065.0000 -60.59835 -58.11756 2.48079 2.11293 -58.15611 719.10275
4070.0000 -61.26734 -58.70723 2.56011 2.08025 -58.44293 748.13255
4075.0000 -60.83880 -58.32649 2.51231 2.06111 -58.61092 694.85440
4080.0000 -60.23679 -57.26537 2.97142 2.15802 -57.76036 779.53943
4085.0000 -60.61985 -57.64560 2.97425 2.20543 -57.34433 785.97311
4090.0000 -60.61037 -58.30286 2.30751 2.12243 -58.07274 772.88489
4095.0000 -61.07350 -58.85177 2.22173 2.10835 -58.19633 738.39433
4100.0000 -60.59039 -57.94580 2.64459 2.05588 -58.65679 665.59486
4105.0000 -60.57359 -58.36982 2.20378 2.16706 -57.68102 758.13922
4110.0000 -60.63153 -58.11133 2.52020 2.12682 -58.03422 689.20115
4115.0000 -59.72690 -56.84262 2.88428 2.24192 -57.02406 855.12656
4120.0000 -59.55755 -56.21235 3.34520 2.36514 -55.94267 1004.59818
4125.0000 -59.71858 -56.85328 2.86530 2.29119 -56.59167 891.17981
4130.0000 -60.31713 -57.52046 2.79667 2.24150 -57.02773 840.71686
4135.0000 -60.47697 -57.64425 2.83272 2.18814 -57.49605 808.94996
4140.0000 -60.62571 -57.76385 2.86187 2.15390 -57.79653 750.80956
4145.0000 -60.27509 -57.21339 3.06170 2.22810 -57.14532 852.76393
4150.0000 -60.27574 -57.58566 2.69008 2.20651 -57.33486 862.81853
4155.0000 -60.65037 -58.17827 2.47210 2.19116 -57.46957 833.58671
4160.0000 -61.13117 -58.21308 2.91809 2.11916 -58.10141 799.52516
4165.0000 -61.03572 -58.33362 2.70211 2.08428 -58.40752 739.81254
4170.0000 -59.98594 -56.93424 3.05170 2.17602 -57.60240 848.49804
4175.0000 -60.07069 -57.49421 2.57648 2.18084 -57.56014 773.51726
4180.0000 -60.60854 -58.52671 2.08183 2.12312 -58.06668 763.76984
4185.0000 -61.11163 -58.05154 3.06009 2.07684 -58.47289 705.61778
4190.0000 -60.57404 -58.43719 2.13685 2.08731 -58.38101 736.40294
4195.0000 -61.42169 -59.21082 2.21087 2.06260 -58.59787 706.02429
4200.0000 -61.14526 -58.87886 2.26640 2.02735 -58.90723 742.89583
4205.0000 -61.41231 -59.26364 2.14867 1.98269 -59.29915 645.22375
4210.0000 -60.58977 -58.49165 2.09811 2.02592 -58.91977 630.22708
4215.0000 -60.42043 -58.20826 2.21216 2.12970 -58.00893 724.00024
4220.0000 -59.13253 -56.36519 2.76734 2.14803 -57.84804 799.16319
4225.0000 -60.19918 -56.94493 3.25425 2.20081 -57.38482 852.68258
4230.0000 -61.09142 -59.16751 1.92391 2.12469 -58.05291 773.59804
4235.0000 -60.33093 -57.43047 2.90046 2.05154 -58.69492 679.23163
4240.0000 -59.87220 -57.13637 2.73583 2.19709 -57.41753 824.43280
4245.0000 -60.76224 -57.98348 2.77876 2.17864 -57.57945 840.40043
4250.0000 -60.76136 -58.72045 2.04090 2.09712 -58.29484 725.04899
FREEZING PROCESS: loop number 18 T-loop= 753.00000000000000
main_MD> interactions number 18 at Temperature= 753.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.44202 -2.72183 -0.97061
force_rgl> df(natom) 0.25024 2.15706 -1.56753
4255.0000 -60.99840 -58.02986 2.96854 2.07712 -58.47040 728.66908
4260.0000 -60.04547 -57.86196 2.18351 2.14038 -57.91523 790.47291
4265.0000 -60.28867 -57.76050 2.52818 2.16816 -57.67143 797.68747
4270.0000 -61.63320 -58.31077 3.32244 2.13337 -57.97675 755.44655
4275.0000 -60.92071 -57.77030 3.15040 2.12646 -58.03737 791.42588
4280.0000 -60.11704 -58.05654 2.06051 2.15330 -57.80186 836.73633
4285.0000 -60.00760 -56.96041 3.04719 2.21543 -57.25654 833.87211
4290.0000 -60.31925 -57.17750 3.14175 2.18568 -57.51766 815.86700
4295.0000 -60.05005 -58.25149 1.79856 2.16249 -57.72112 804.47818
4300.0000 -60.38662 -57.89764 2.48897 2.10257 -58.24706 669.78069
4305.0000 -60.81442 -58.71994 2.09447 2.09191 -58.34063 688.14368
4310.0000 -60.60958 -58.74772 1.86186 2.11175 -58.16647 751.96176
4315.0000 -60.21885 -57.77613 2.44272 2.07661 -58.47489 725.95240
4320.0000 -61.17230 -58.91617 2.25613 2.07710 -58.47056 735.07831
4325.0000 -61.23285 -59.30458 1.92827 2.01868 -58.98333 680.64044
4330.0000 -60.81302 -58.16877 2.64425 2.03376 -58.85096 649.06808
4335.0000 -60.89470 -59.10153 1.79317 2.07280 -58.50828 707.46308
4340.0000 -61.41240 -58.88541 2.52699 2.03253 -58.86173 693.66686
4345.0000 -61.10766 -58.87487 2.23278 2.04424 -58.75899 674.73738
4350.0000 -60.99620 -58.72023 2.27597 2.07226 -58.51303 688.75108
4355.0000 -58.77418 -56.24509 2.52909 2.22411 -57.18036 843.84055
4360.0000 -60.20997 -57.34246 2.86751 2.28780 -56.62141 941.28597
4365.0000 -61.49581 -58.90749 2.58832 2.15092 -57.82271 821.14484
4370.0000 -61.43961 -59.03890 2.40071 2.01350 -59.02872 673.74239
4375.0000 -60.75391 -58.11408 2.63983 2.06896 -58.54206 749.07498
4380.0000 -61.14991 -59.02439 2.12552 2.02639 -58.91561 695.86803
4385.0000 -60.99684 -58.51646 2.48038 2.11082 -58.17466 776.52837
4390.0000 -61.18272 -58.91472 2.26800 2.05555 -58.65968 714.39186
4395.0000 -60.32984 -58.38800 1.94184 2.05975 -58.62283 672.23027
4400.0000 -61.11317 -58.44765 2.66552 2.07674 -58.47374 711.94490
4405.0000 -60.84526 -58.43459 2.41068 2.10030 -58.26699 816.09628
4410.0000 -60.81701 -58.10587 2.71113 2.08291 -58.41960 739.24009
4415.0000 -60.52369 -57.83402 2.68967 2.15690 -57.77023 798.36764
4420.0000 -59.99541 -57.78168 2.21373 2.14570 -57.86854 753.44092
4425.0000 -60.68499 -58.15223 2.53277 2.17133 -57.64359 817.23553
4430.0000 -61.10204 -58.29594 2.80610 2.11617 -58.12771 802.87749
4435.0000 -60.89220 -58.15488 2.73732 2.05108 -58.69891 712.88380
4440.0000 -60.41340 -58.24981 2.16358 2.09722 -58.29400 754.68236
4445.0000 -60.67167 -57.59473 3.07694 2.08794 -58.37547 775.89892
4450.0000 -60.24090 -56.50107 3.73983 2.19384 -57.44605 824.02099
4455.0000 -59.46408 -56.30950 3.15458 2.35042 -56.07178 941.36615
4460.0000 -60.43576 -58.10218 2.33358 2.21339 -57.27442 861.29527
4465.0000 -60.35723 -58.25789 2.09934 2.06499 -58.57682 687.18877
4470.0000 -61.76422 -59.32512 2.43910 2.07384 -58.49916 738.40748
4475.0000 -61.12003 -58.73427 2.38576 1.96997 -59.41080 619.62472
4480.0000 -60.42279 -58.32413 2.09866 2.05358 -58.67697 664.11901
4485.0000 -60.68598 -58.61740 2.06858 2.06187 -58.60424 689.15585
4490.0000 -61.47616 -58.90812 2.56804 2.01611 -59.00585 705.24443
4495.0000 -60.28469 -57.64889 2.63580 2.07914 -58.45264 697.53663
4500.0000 -59.14530 -57.24611 1.89918 2.19101 -57.47087 772.28224
FREEZING PROCESS: loop number 19 T-loop= 728.00000000000000
main_MD> interactions number 19 at Temperature= 728.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.84300 -1.08387 -1.88642
force_rgl> df(natom) -0.91430 -0.58945 2.64763
4505.0000 -59.71391 -57.10342 2.61049 2.25236 -56.93239 829.39768
4510.0000 -61.21520 -58.68748 2.52771 2.12721 -58.03078 739.72267
4515.0000 -60.61873 -58.19626 2.42247 2.09185 -58.34108 769.04505
4520.0000 -60.44705 -58.09670 2.35035 2.12452 -58.05441 767.40917
4525.0000 -59.66050 -57.70200 1.95850 2.15941 -57.74816 797.17172
4530.0000 -60.34736 -57.09125 3.25611 2.17722 -57.59186 783.75526
4535.0000 -60.65009 -58.18030 2.46979 2.15033 -57.82788 776.39203
4540.0000 -60.18869 -56.61884 3.56985 2.11652 -58.12461 771.87244
4545.0000 -60.75341 -58.49751 2.25590 2.16795 -57.67324 790.15188
4550.0000 -60.29190 -58.72243 1.56947 2.00762 -59.08034 631.52075
4555.0000 -60.07028 -56.67275 3.39754 2.18366 -57.53534 817.19976
4560.0000 -60.76903 -58.06673 2.70231 2.18250 -57.54556 840.81098
4565.0000 -60.64131 -58.34074 2.30057 2.11505 -58.13754 748.12431
4570.0000 -61.24350 -58.64372 2.59978 2.05928 -58.62693 742.32983
4575.0000 -60.77613 -58.75446 2.02166 2.05251 -58.68637 675.23129
4580.0000 -60.74155 -58.30564 2.43591 2.08304 -58.41843 719.60159
4585.0000 -60.28493 -57.43116 2.85377 2.10551 -58.22123 713.48991
4590.0000 -60.38184 -57.72197 2.65986 2.16441 -57.70428 793.70510
4595.0000 -60.90740 -58.43468 2.47272 2.17095 -57.64694 847.22271
4600.0000 -60.86025 -58.61876 2.24148 2.03587 -58.83238 632.06017
4605.0000 -61.57489 -59.43857 2.13633 2.05646 -58.65168 701.33755
4610.0000 -60.91579 -58.72689 2.18890 1.98854 -59.24779 622.93914
4615.0000 -61.48832 -59.10697 2.38135 2.03020 -58.88220 670.81283
4620.0000 -60.90387 -59.14231 1.76156 2.02531 -58.92508 633.06743
4625.0000 -60.91817 -58.36854 2.54963 2.08066 -58.43933 709.81809
4630.0000 -62.45911 -59.52427 2.93484 2.02791 -58.90225 698.90856
4635.0000 -61.50424 -59.36801 2.13623 1.99174 -59.21971 663.76831
4640.0000 -61.15681 -58.77601 2.38080 2.06032 -58.61788 724.56601
4645.0000 -61.31451 -59.18318 2.13133 2.02662 -58.91359 706.72532
4650.0000 -60.61744 -58.58914 2.02829 1.97519 -59.36501 642.37999
4655.0000 -60.78739 -58.56036 2.22703 2.05416 -58.67189 731.43414
4660.0000 -60.50277 -58.69408 1.80869 2.07568 -58.48303 747.75210
4665.0000 -60.99775 -58.72834 2.26941 2.05070 -58.70230 709.35861
4670.0000 -60.38012 -58.14834 2.23178 2.04818 -58.72443 667.40316
4675.0000 -61.23011 -58.57389 2.65622 2.07320 -58.50476 691.13799
4680.0000 -61.36668 -59.35696 2.00972 2.02728 -58.90784 650.36216
4685.0000 -61.10870 -58.44143 2.66726 2.02441 -58.93304 713.71003
4690.0000 -61.03290 -59.01112 2.02178 2.06388 -58.58656 743.79448
4695.0000 -61.56342 -59.13449 2.42893 1.93836 -59.68817 620.56850
4700.0000 -61.56934 -59.37933 2.19001 2.03323 -58.85561 733.31613
4705.0000 -60.91927 -57.73306 3.18621 2.05736 -58.64384 731.48121
4710.0000 -60.81039 -58.10509 2.70530 2.07863 -58.45715 763.34336
4715.0000 -60.85004 -57.57642 3.27362 2.15746 -57.76534 799.92337
4720.0000 -60.51351 -57.05905 3.45446 2.17446 -57.61607 857.40359
4725.0000 -61.46672 -59.48870 1.97802 2.09742 -58.29225 752.72225
4730.0000 -61.41155 -58.96739 2.44415 2.00348 -59.11670 649.00138
4735.0000 -61.07363 -58.76878 2.30484 2.02491 -58.92863 667.42503
4740.0000 -60.17021 -57.70045 2.46976 2.11166 -58.16722 765.26119
4745.0000 -61.34157 -58.58367 2.75790 2.11312 -58.15442 743.75370
4750.0000 -60.20423 -57.95178 2.25245 2.10813 -58.19824 777.43841
FREEZING PROCESS: loop number 20 T-loop= 703.00000000000000
main_MD> interactions number 20 at Temperature= 703.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -3.95320 -1.48851 2.50426
force_rgl> df(natom) -4.50899 -0.50374 5.94690
4755.0000 -60.94036 -58.26651 2.67386 2.09684 -58.29733 748.31302
4760.0000 -60.71427 -58.50859 2.20568 2.05139 -58.69618 697.38917
4765.0000 -60.23584 -57.67929 2.55655 2.13213 -57.98763 738.78518
4770.0000 -60.56361 -58.46380 2.09981 2.16166 -57.72841 753.30417
4775.0000 -60.61644 -57.96454 2.65191 2.06324 -58.59220 675.49812
4780.0000 -60.48220 -57.84575 2.63645 2.13182 -57.99037 745.76591
4785.0000 -60.73481 -58.47402 2.26079 2.09885 -58.27969 745.79487
4790.0000 -60.27608 -57.73509 2.54099 2.11544 -58.13408 797.85399
4795.0000 -61.32776 -58.24778 3.07998 2.09611 -58.30377 772.98094
4800.0000 -59.81199 -57.37811 2.43388 2.11326 -58.15319 790.54396
4805.0000 -59.63458 -56.86580 2.76878 2.20874 -57.31522 829.72412
4810.0000 -60.97381 -58.72416 2.24965 2.13752 -57.94029 791.22595
4815.0000 -61.23993 -58.84231 2.39762 2.05212 -58.68979 719.04416
4820.0000 -60.51050 -58.74560 1.76489 2.04025 -58.79400 692.77895
4825.0000 -60.84008 -58.63475 2.20533 2.03415 -58.84755 667.18741
4830.0000 -61.21864 -59.11740 2.10124 2.05006 -58.70787 704.79114
4835.0000 -61.82205 -58.99717 2.82488 1.98735 -59.25828 660.58706
4840.0000 -60.97615 -59.54819 1.42796 1.99274 -59.21094 627.05251
4845.0000 -61.00473 -58.22320 2.78153 2.05246 -58.68682 700.21579
4850.0000 -61.28267 -58.45124 2.83143 2.11336 -58.15239 752.41899
4855.0000 -60.69576 -58.12051 2.57525 2.10166 -58.25506 733.02148
4860.0000 -61.04171 -58.46044 2.58127 2.10583 -58.21846 780.16144
4865.0000 -60.60446 -58.15818 2.44629 2.12117 -58.08376 772.92108
4870.0000 -60.73184 -58.69349 2.03835 2.07210 -58.51445 729.90659
4875.0000 -60.66487 -58.17227 2.49261 2.06735 -58.55614 730.36542
4880.0000 -60.41603 -57.93761 2.47843 2.17805 -57.58456 813.00744
4885.0000 -61.39220 -58.93554 2.45666 2.11188 -58.16534 783.43161
4890.0000 -61.50028 -58.88568 2.61460 2.03567 -58.83417 713.69821
4895.0000 -62.05506 -59.66097 2.39408 1.98653 -59.26547 661.80610
4900.0000 -61.54249 -59.34053 2.20196 1.97233 -59.39005 632.05494
4905.0000 -61.28946 -58.65287 2.63659 1.97912 -59.33049 657.98002
4910.0000 -61.13054 -58.56547 2.56508 2.08857 -58.36987 709.63296
4915.0000 -60.47833 -58.04468 2.43364 2.08062 -58.43968 699.39084
4920.0000 -61.13074 -58.64161 2.48912 2.07843 -58.45887 717.66201
4925.0000 -59.69641 -57.26971 2.42670 2.11520 -58.13616 711.72069
4930.0000 -60.45502 -57.74100 2.71401 2.18918 -57.48696 786.41855
4935.0000 -61.52691 -58.85230 2.67460 2.09172 -58.34226 715.85160
4940.0000 -60.65282 -58.22965 2.42317 2.10660 -58.21163 768.07165
4945.0000 -60.49359 -57.84739 2.64620 2.14063 -57.91304 784.40657
4950.0000 -61.72167 -59.70130 2.02036 2.07110 -58.52325 750.94909
4955.0000 -61.76468 -59.65206 2.11262 1.91878 -59.86002 600.02944
4960.0000 -61.56421 -59.57247 1.99173 1.96185 -59.48202 635.11791
4965.0000 -61.67614 -59.08686 2.58928 1.98077 -59.31596 661.81141
4970.0000 -61.60112 -59.79124 1.80987 1.95464 -59.54536 621.68039
4975.0000 -61.50718 -59.18896 2.31822 1.98665 -59.26443 655.86791
4980.0000 -60.79464 -58.26646 2.52818 2.01776 -58.99140 709.12411
4985.0000 -61.23327 -58.71068 2.52259 2.03503 -58.83982 634.97732
4990.0000 -60.69064 -58.13509 2.55555 2.08036 -58.44198 721.11096
4995.0000 -60.99962 -59.27538 1.72424 1.99944 -59.15211 619.07242
5000.0000 -61.46833 -59.38782 2.08051 1.98478 -59.28082 657.82853
FREEZING PROCESS: loop number 21 T-loop= 678.00000000000000
main_MD> interactions number 21 at Temperature= 678.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.16584 -2.95705 1.41456
force_rgl> df(natom) -2.34664 -0.88040 0.50871
5005.0000 -61.15359 -58.25181 2.90179 1.99977 -59.14925 674.26062
5010.0000 -61.41021 -58.49972 2.91050 2.04958 -58.71214 711.73625
5015.0000 -59.68205 -57.57610 2.10596 2.10452 -58.22989 764.07476
5020.0000 -60.69187 -59.03103 1.66084 2.11415 -58.14542 806.02730
5025.0000 -60.50978 -58.74353 1.76625 2.05926 -58.62713 678.83524
5030.0000 -62.12813 -59.80008 2.32805 1.96599 -59.44569 638.74928
5035.0000 -61.68666 -59.62137 2.06529 1.91236 -59.91638 590.10300
5040.0000 -61.76723 -60.16102 1.60620 1.96085 -59.49080 600.19739
5045.0000 -61.54468 -59.33613 2.20855 1.95268 -59.56253 631.96293
5050.0000 -61.28509 -59.22176 2.06333 1.96334 -59.46894 625.84648
5055.0000 -61.46347 -58.77806 2.68542 2.05020 -58.70666 725.37538
5060.0000 -61.43944 -58.58401 2.85544 2.05441 -58.66969 681.95447
5065.0000 -60.34151 -57.65432 2.68719 2.10114 -58.25962 738.96774
5070.0000 -61.17064 -58.75024 2.42040 2.11185 -58.16557 740.35414
5075.0000 -60.83314 -59.03261 1.80053 2.03636 -58.82808 669.53680
5080.0000 -62.28382 -59.97643 2.30739 1.97659 -59.35266 616.31553
5085.0000 -62.01511 -60.26511 1.75000 1.88158 -60.18655 532.26774
5090.0000 -60.93056 -58.82946 2.10110 1.96704 -59.43653 607.34029
5095.0000 -60.75613 -58.22570 2.53043 2.07535 -58.48595 709.80186
5100.0000 -61.31157 -59.18930 2.12227 1.99969 -59.14997 640.55737
5105.0000 -61.63963 -59.36925 2.27038 1.98738 -59.25801 619.28658
5110.0000 -61.33055 -58.54196 2.78859 2.05344 -58.67824 715.73855
5115.0000 -60.76914 -58.72897 2.04016 2.07141 -58.52048 705.00249
5120.0000 -61.71324 -59.69094 2.02230 1.97553 -59.36197 665.05047
5125.0000 -61.64012 -59.29312 2.34701 1.93682 -59.70172 597.12709
5130.0000 -61.20672 -59.39063 1.81609 1.97991 -59.32351 636.06455
5135.0000 -61.54522 -58.94414 2.60108 2.00248 -59.12549 657.70871
5140.0000 -61.17204 -58.02773 3.14431 2.05632 -58.65295 726.18588
5145.0000 -60.61591 -58.40805 2.20787 2.09106 -58.34802 713.56135
5150.0000 -59.36191 -56.63204 2.72987 2.18582 -57.51639 804.40181
5155.0000 -60.81000 -58.10640 2.70361 2.25536 -56.90607 886.40262
5160.0000 -60.53634 -58.47387 2.06247 2.08024 -58.44300 697.92375
5165.0000 -60.50779 -58.69992 1.80787 2.03740 -58.81900 651.59855
5170.0000 -60.54981 -57.99644 2.55337 2.11018 -58.18029 733.40870
5175.0000 -60.75688 -58.71028 2.04660 2.08637 -58.38918 733.18251
5180.0000 -61.12256 -58.94307 2.17949 2.03587 -58.83241 696.42708
5185.0000 -61.86245 -59.32255 2.53990 1.95713 -59.52346 639.15101
5190.0000 -62.23262 -60.02676 2.20586 1.93350 -59.73089 599.47180
5195.0000 -61.74392 -59.42575 2.31817 1.94823 -59.60156 621.90648
5200.0000 -61.47043 -59.67659 1.79384 1.98678 -59.26327 656.99131
5205.0000 -61.55014 -59.09620 2.45394 1.98919 -59.24209 646.23850
5210.0000 -61.29871 -58.91356 2.38515 1.98894 -59.24426 649.67166
5215.0000 -60.91906 -58.89010 2.02896 2.02759 -58.90510 682.21181
5220.0000 -61.04397 -58.99036 2.05362 2.06739 -58.55579 724.03529
5225.0000 -61.09967 -58.41794 2.68172 2.10928 -58.18818 744.83909
5230.0000 -60.63708 -59.08147 1.55562 2.06651 -58.56356 686.74416
5235.0000 -61.23381 -59.45643 1.77737 1.95271 -59.56223 605.90070
5240.0000 -61.40329 -58.78385 2.61943 2.00210 -59.12878 671.73117
5245.0000 -60.54758 -58.38268 2.16491 2.05361 -58.67678 678.24446
5250.0000 -59.73529 -57.79672 1.93857 2.12630 -58.03876 709.84219
FREEZING PROCESS: loop number 22 T-loop= 653.00000000000000
main_MD> interactions number 22 at Temperature= 653.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.23412 -2.11174 -1.00890
force_rgl> df(natom) -1.56923 3.54124 0.34679
5255.0000 -60.82242 -57.92034 2.90208 2.18048 -57.56328 754.13120
5260.0000 -61.75800 -59.35374 2.40426 2.05593 -58.65640 722.37988
5265.0000 -61.54541 -58.98617 2.55923 1.97377 -59.37748 623.61314
5270.0000 -61.32860 -59.67026 1.65834 1.97078 -59.40371 581.60520
5275.0000 -61.67277 -59.17177 2.50100 1.92195 -59.83224 541.29892
5280.0000 -61.85998 -59.16065 2.69933 1.98811 -59.25161 646.87491
5285.0000 -61.38696 -57.94575 3.44121 2.01943 -58.97675 644.17900
5290.0000 -61.03766 -58.44090 2.59676 2.09312 -58.32997 742.79799
5295.0000 -61.56236 -58.78126 2.78110 2.02973 -58.88632 723.37342
5300.0000 -61.01980 -58.78989 2.22991 2.02689 -58.91128 731.28223
5305.0000 -61.23451 -58.61053 2.62399 2.06576 -58.57006 747.35364
5310.0000 -60.79311 -57.94094 2.85217 2.07565 -58.48329 729.48850
5315.0000 -61.23053 -58.81666 2.41388 2.08784 -58.37633 780.36081
5320.0000 -60.15402 -57.89723 2.25680 2.08554 -58.39652 694.73982
5325.0000 -60.59251 -58.20480 2.38771 2.15730 -57.76670 805.22025
5330.0000 -61.86360 -59.78217 2.08143 1.98860 -59.24730 611.10889
5335.0000 -60.95887 -59.32756 1.63131 1.95528 -59.53969 591.77481
5340.0000 -60.50057 -57.91876 2.58181 2.02469 -58.93052 627.90220
5345.0000 -60.82188 -57.87898 2.94290 2.13686 -57.94609 749.99042
5350.0000 -61.17151 -59.44465 1.72686 2.06622 -58.56610 682.58966
5355.0000 -60.51988 -58.40021 2.11967 1.98490 -59.27976 593.34969
5360.0000 -61.03583 -59.00822 2.02761 2.05065 -58.70272 660.91316
5365.0000 -60.62170 -58.48137 2.14033 2.05593 -58.65634 672.39559
5370.0000 -60.79625 -58.50621 2.29004 2.07708 -58.47076 715.56104
5375.0000 -61.39306 -59.59210 1.80096 2.02734 -58.90731 652.58802
5380.0000 -61.77201 -59.67738 2.09463 1.94194 -59.65681 545.10741
5385.0000 -61.83804 -59.80590 2.03214 1.96018 -59.49675 563.78805
5390.0000 -61.28968 -59.37420 1.91548 1.95850 -59.51145 615.93893
5395.0000 -60.63699 -58.52981 2.10717 2.05410 -58.67243 690.80792
5400.0000 -61.19269 -59.10700 2.08569 2.00012 -59.14620 610.94039
5405.0000 -60.69078 -58.37414 2.31664 2.00801 -59.07695 611.71623
5410.0000 -61.38312 -59.12926 2.25387 2.05535 -58.66147 682.79990
5415.0000 -61.29956 -58.85314 2.44642 2.01921 -58.97865 660.87160
5420.0000 -60.78448 -58.57431 2.21018 2.04673 -58.73710 684.95212
5425.0000 -61.66782 -59.40693 2.26088 2.02194 -58.95472 684.01225
5430.0000 -61.65120 -58.48315 3.16805 1.98651 -59.26565 657.72258
5435.0000 -61.47237 -58.91978 2.55259 2.05185 -58.69220 727.14481
5440.0000 -60.62302 -58.26329 2.35974 2.05372 -58.67578 727.49367
5445.0000 -61.20679 -58.74887 2.45791 2.07503 -58.48871 709.06445
5450.0000 -61.63549 -58.67437 2.96112 2.04425 -58.75890 689.09110
5455.0000 -62.20610 -59.75941 2.44669 1.97332 -59.38139 658.14576
5460.0000 -61.24061 -59.54630 1.69431 1.95213 -59.56739 598.42984
5465.0000 -61.68897 -59.31468 2.37429 1.94114 -59.66380 601.49745
5470.0000 -61.90519 -59.86116 2.04402 1.97969 -59.32550 626.06067
5475.0000 -60.97526 -58.65786 2.31740 2.03657 -58.82626 720.68353
5480.0000 -60.06506 -58.49663 1.56843 2.08065 -58.43940 733.03486
5485.0000 -61.77201 -59.25334 2.51867 2.03372 -58.85132 647.68492
5490.0000 -61.43352 -59.04026 2.39327 2.02668 -58.91311 695.93883
5495.0000 -60.70566 -58.80452 1.90115 1.99574 -59.18461 642.30686
5500.0000 -61.85804 -59.11093 2.74711 2.04986 -58.70966 659.58413
FREEZING PROCESS: loop number 23 T-loop= 628.00000000000000
main_MD> interactions number 23 at Temperature= 628.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.88305 -0.42052 3.71160
force_rgl> df(natom) -0.82991 0.75204 -0.05140
5505.0000 -60.95194 -58.55930 2.39264 2.04384 -58.76251 672.20335
5510.0000 -61.16792 -59.39652 1.77140 2.02556 -58.92291 602.40237
5515.0000 -61.60601 -59.37885 2.22716 1.94923 -59.59284 574.68743
5520.0000 -61.45394 -59.71152 1.74243 1.95537 -59.53889 638.98547
5525.0000 -62.01137 -60.06851 1.94287 1.93256 -59.73911 596.88717
5530.0000 -61.03992 -58.87533 2.16459 1.98235 -59.30213 628.69653
5535.0000 -61.24253 -58.92833 2.31420 2.01506 -59.01506 667.46981
5540.0000 -60.85639 -59.09364 1.76275 2.02322 -58.94343 656.84562
5545.0000 -61.34304 -58.89442 2.44862 2.00383 -59.11361 597.36515
5550.0000 -61.55626 -59.22998 2.32629 1.98385 -59.28894 576.46151
5555.0000 -61.60966 -59.54222 2.06744 1.99496 -59.19147 661.23816
5560.0000 -61.84697 -59.62234 2.22462 1.94725 -59.61022 620.52540
5565.0000 -61.82843 -60.13339 1.69504 1.92564 -59.79983 582.67486
5570.0000 -61.21328 -59.47852 1.73477 1.90505 -59.98057 500.47428
5575.0000 -61.60037 -59.35842 2.24195 1.99267 -59.21156 620.18687
5580.0000 -61.79866 -60.29630 1.50236 1.90285 -59.99986 543.95035
5585.0000 -62.22736 -59.43231 2.79505 1.88573 -60.15010 488.56681
5590.0000 -61.71682 -59.47054 2.24628 1.94031 -59.67112 622.28277
5595.0000 -61.68907 -60.05432 1.63475 1.94404 -59.63838 616.50279
5600.0000 -60.99023 -59.03748 1.95275 1.96819 -59.42645 624.26393
5605.0000 -61.64244 -59.88061 1.76183 1.95794 -59.51640 631.25704
5610.0000 -61.46212 -60.11358 1.34854 1.89089 -60.10485 522.03586
5615.0000 -61.84024 -59.35904 2.48120 1.96362 -59.46650 613.71770
5620.0000 -61.14040 -59.42049 1.71991 1.98982 -59.23657 630.12158
5625.0000 -61.42738 -59.68613 1.74125 1.99883 -59.15750 644.52652
5630.0000 -61.89276 -59.31703 2.57573 1.97779 -59.34218 641.83437
5635.0000 -61.29343 -59.35127 1.94216 1.92728 -59.78544 597.23275
5640.0000 -61.20916 -59.19911 2.01005 1.97396 -59.37576 628.99238
5645.0000 -61.59397 -59.56528 2.02869 1.95951 -59.50262 607.59955
5650.0000 -61.11514 -59.23825 1.87689 1.98970 -59.23759 651.52959
5655.0000 -61.24979 -58.43433 2.81545 2.02378 -58.93855 693.34124
5660.0000 -61.42059 -59.26672 2.15387 2.04020 -58.79442 729.59730
5665.0000 -61.56495 -59.42569 2.13926 1.95654 -59.52864 627.28907
5670.0000 -61.65601 -59.43510 2.22091 1.95599 -59.53349 595.00706
5675.0000 -61.66601 -59.79802 1.86799 1.94389 -59.63970 611.56257
5680.0000 -62.10920 -60.31301 1.79619 1.87798 -60.21811 533.76112
5685.0000 -61.19431 -58.94161 2.25270 1.94828 -59.60111 589.17728
5690.0000 -61.48924 -58.46247 3.02677 2.04302 -58.76966 716.21331
5695.0000 -62.37564 -60.05129 2.32435 1.98676 -59.26340 657.51494
5700.0000 -61.46038 -58.87287 2.58751 1.93941 -59.67897 633.02604
5705.0000 -61.14734 -59.60834 1.53900 1.99698 -59.17371 617.97019
5710.0000 -61.55057 -59.16996 2.38061 1.94938 -59.59146 580.82482
5715.0000 -61.56110 -59.12637 2.43473 2.01135 -59.04760 624.81199
5720.0000 -60.92084 -57.98187 2.93898 2.02584 -58.92042 640.99587
5725.0000 -60.71622 -58.30938 2.40684 2.12248 -58.07233 722.56133
5730.0000 -60.97068 -58.98986 1.98082 2.08543 -58.39750 706.42573
5735.0000 -61.82405 -59.40469 2.41936 1.99199 -59.21754 618.51800
5740.0000 -61.02715 -58.75518 2.27198 2.02006 -58.97117 634.32602
5745.0000 -61.19622 -58.98159 2.21464 2.02840 -58.89797 651.78821
5750.0000 -60.73904 -58.57996 2.15907 2.06659 -58.56285 691.67731
FREEZING PROCESS: loop number 24 T-loop= 603.00000000000000
main_MD> interactions number 24 at Temperature= 603.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.15186 3.64894 1.78479
force_rgl> df(natom) -1.39276 0.09274 1.31198
5755.0000 -61.25153 -58.86887 2.38266 1.99706 -59.17302 626.66029
5760.0000 -61.18568 -59.32816 1.85752 2.01128 -59.04822 655.00472
5765.0000 -61.74959 -59.49497 2.25462 2.01435 -59.02134 690.69957
5770.0000 -61.73336 -59.57529 2.15807 1.95604 -59.53302 602.05687
5775.0000 -61.01590 -59.14234 1.87357 1.98924 -59.24169 663.83824
5780.0000 -61.42675 -59.98870 1.43805 1.96887 -59.42044 629.44463
5785.0000 -61.31799 -59.54586 1.77213 1.90527 -59.97864 553.10511
5790.0000 -61.50146 -59.45918 2.04229 1.92617 -59.79523 556.24008
5795.0000 -61.95234 -60.17030 1.78205 1.92348 -59.81878 558.71116
5800.0000 -61.84045 -59.07492 2.76553 1.91562 -59.88778 571.51666
5805.0000 -61.54556 -59.34060 2.20496 1.99585 -59.18370 637.38928
5810.0000 -61.82743 -60.00894 1.81849 1.94186 -59.65751 585.66778
5815.0000 -62.11737 -59.49059 2.62678 1.91743 -59.87189 554.35533
5820.0000 -61.28266 -59.08609 2.19657 2.00763 -59.08031 643.28395
5825.0000 -60.99661 -58.69048 2.30612 2.02730 -58.90766 657.96393
5830.0000 -61.63471 -59.15106 2.48365 2.01970 -58.97434 648.32053
5835.0000 -61.39916 -59.19219 2.20697 1.97453 -59.37080 644.11614
5840.0000 -61.53812 -59.61431 1.92382 2.03085 -58.87646 665.52307
5845.0000 -61.21019 -59.86446 1.34573 1.92894 -59.77087 565.76422
5850.0000 -61.54578 -58.86102 2.68476 1.95043 -59.58231 635.96312
5855.0000 -60.58836 -57.37263 3.21572 2.09960 -58.27311 764.72677
5860.0000 -61.53633 -58.87280 2.66353 2.10081 -58.26244 744.51273
5865.0000 -61.79636 -59.22832 2.56804 2.00893 -59.06890 632.61976
5870.0000 -61.38911 -59.45818 1.93093 2.00542 -59.09971 625.39071
5875.0000 -62.23448 -59.77374 2.46074 1.96636 -59.44248 611.80527
5880.0000 -61.32229 -59.56297 1.75932 1.93863 -59.68581 592.41573
5885.0000 -61.58815 -59.31312 2.27503 1.91781 -59.86859 564.80846
5890.0000 -61.46519 -58.96149 2.50370 1.99094 -59.22672 656.54941
5895.0000 -61.15109 -58.81427 2.33682 2.03659 -58.82611 728.65753
5900.0000 -61.20774 -59.00510 2.20264 2.03365 -58.85193 714.42089
5905.0000 -62.18510 -59.32445 2.86065 2.00150 -59.13407 644.17577
5910.0000 -61.62866 -59.48232 2.14634 1.98299 -59.29652 640.53192
5915.0000 -61.18919 -59.13581 2.05338 1.97821 -59.33845 599.90345
5920.0000 -61.36203 -58.93093 2.43110 1.95669 -59.52737 579.74080
5925.0000 -60.79715 -58.56190 2.23525 2.03664 -58.82569 682.85674
5930.0000 -61.65918 -59.95764 1.70154 1.97653 -59.35321 627.53235
5935.0000 -62.04525 -60.02852 2.01673 1.86069 -60.36983 495.21082
5940.0000 -62.00272 -59.95654 2.04618 1.88047 -60.19629 535.87589
5945.0000 -62.00675 -60.40573 1.60102 1.89333 -60.08340 565.98173
5950.0000 -61.68481 -59.50190 2.18291 1.93879 -59.68442 631.94895
5955.0000 -61.34501 -59.37452 1.97049 1.96934 -59.41630 614.82353
5960.0000 -61.33493 -59.45998 1.87495 1.97317 -59.38267 599.82327
5965.0000 -60.78006 -58.98272 1.79734 2.00184 -59.13108 587.81184
5970.0000 -61.52389 -58.91608 2.60781 2.01714 -58.99678 619.27293
5975.0000 -61.49417 -59.01193 2.48224 2.00857 -59.07199 613.66298
5980.0000 -61.43543 -59.41943 2.01600 1.99582 -59.18395 607.18936
5985.0000 -61.74991 -59.59457 2.15534 1.96285 -59.47324 564.63272
5990.0000 -61.41711 -59.26604 2.15106 1.92594 -59.79722 549.94952
5995.0000 -61.14331 -59.39800 1.74531 1.98794 -59.25307 642.82386
6000.0000 -60.76676 -58.59970 2.16706 2.06363 -58.58879 750.42461
FREEZING PROCESS: loop number 25 T-loop= 578.00000000000000
main_MD> interactions number 25 at Temperature= 578.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.62906 1.04867 1.07426
force_rgl> df(natom) 2.32876 1.35466 2.56172
6005.0000 -61.08818 -59.24541 1.84277 1.99952 -59.15149 621.93999
6010.0000 -61.75137 -58.86236 2.88902 2.04903 -58.71691 687.17319
6015.0000 -61.27599 -59.08607 2.18991 1.99416 -59.19847 635.47644
6020.0000 -61.32952 -59.33349 1.99603 1.96598 -59.44577 619.79324
6025.0000 -61.39253 -59.40831 1.98422 1.97138 -59.39839 589.46989
6030.0000 -62.26934 -60.35175 1.91760 1.90722 -59.96153 567.63016
6035.0000 -61.72933 -59.43484 2.29450 1.89052 -60.10806 548.35624
6040.0000 -61.51513 -58.80065 2.71448 1.95623 -59.53140 641.42739
6045.0000 -61.82611 -59.80579 2.02033 2.00016 -59.14585 666.28545
6050.0000 -62.09113 -60.21449 1.87664 1.89642 -60.05626 545.62044
6055.0000 -61.80612 -59.87395 1.93217 1.88686 -60.14022 551.37414
6060.0000 -61.98573 -60.30381 1.68192 1.89895 -60.03413 546.46223
6065.0000 -62.20613 -59.65400 2.55213 1.89053 -60.10798 531.63453
6070.0000 -61.37374 -59.49358 1.88016 1.94641 -59.61757 627.64379
6075.0000 -61.55961 -59.29185 2.26775 1.96960 -59.41405 625.21704
6080.0000 -61.36704 -59.21133 2.15571 1.98738 -59.25800 639.46269
6085.0000 -61.04996 -59.16687 1.88309 1.98982 -59.23658 649.37285
6090.0000 -60.51980 -58.70629 1.81352 2.02550 -58.92342 621.29410
6095.0000 -62.08826 -60.39848 1.68977 1.91857 -59.86186 530.37008
6100.0000 -61.77075 -59.34929 2.42146 1.91747 -59.87159 541.27625
6105.0000 -62.51378 -59.89424 2.61954 1.93529 -59.71515 593.32145
6110.0000 -61.82659 -60.17692 1.64968 1.89010 -60.11179 555.64723
6115.0000 -61.69137 -59.82168 1.86970 1.94221 -59.65438 579.52111
6120.0000 -61.63468 -60.00830 1.62638 1.90657 -59.96721 569.50756
6125.0000 -62.26722 -59.94798 2.31924 1.90645 -59.96828 581.01217
6130.0000 -61.11908 -58.82187 2.29721 1.96732 -59.43402 634.70768
6135.0000 -61.32733 -59.09920 2.22813 1.98733 -59.25840 634.88329
6140.0000 -61.40775 -59.58486 1.82289 1.93304 -59.73488 585.93888
6145.0000 -61.83811 -59.50202 2.33608 1.95012 -59.58503 612.35655
6150.0000 -61.37551 -59.65968 1.71583 1.95867 -59.50999 637.69894
6155.0000 -62.68551 -60.36842 2.31708 1.90958 -59.94080 576.87770
6160.0000 -62.58185 -60.49451 2.08734 1.84025 -60.54922 500.54119
6165.0000 -62.04620 -60.41962 1.62658 1.88200 -60.18286 540.41626
6170.0000 -61.68489 -59.77382 1.91107 1.88205 -60.18241 554.86788
6175.0000 -61.28080 -58.80009 2.48071 1.97275 -59.38640 617.12010
6180.0000 -61.81318 -59.85388 1.95930 1.96719 -59.43522 621.86850
6185.0000 -62.51668 -60.04252 2.47416 1.92020 -59.84760 586.44510
6190.0000 -61.78875 -60.47113 1.31762 1.88979 -60.11446 543.80363
6195.0000 -61.73018 -60.31940 1.41078 1.85963 -60.37921 522.46795
6200.0000 -62.21126 -60.75101 1.46025 1.84177 -60.53591 488.45911
6205.0000 -62.08677 -60.64794 1.43883 1.82838 -60.65346 486.68300
6210.0000 -62.21108 -59.93951 2.27157 1.87732 -60.22388 527.67312
6215.0000 -61.93020 -59.97476 1.95544 1.90851 -59.95022 570.13067
6220.0000 -61.29358 -59.72503 1.56855 1.90670 -59.96610 513.79228
6225.0000 -62.24829 -60.70276 1.54552 1.83832 -60.56616 494.85602
6230.0000 -61.80163 -59.53603 2.26560 1.86441 -60.33723 542.13623
6235.0000 -61.87366 -60.22978 1.64388 1.86409 -60.34007 503.46774
6240.0000 -62.06611 -59.93172 2.13438 1.89237 -60.09185 541.87439
6245.0000 -61.79673 -59.86197 1.93476 1.89108 -60.10317 549.17099
6250.0000 -62.01704 -60.26664 1.75040 1.90114 -60.01485 570.45588
FREEZING PROCESS: loop number 26 T-loop= 553.00000000000000
main_MD> interactions number 26 at Temperature= 553.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.26069 -1.97966 -3.11150
force_rgl> df(natom) -1.76406 2.44283 2.18143
6255.0000 -61.59702 -59.94974 1.64729 1.89629 -60.05744 531.65558
6260.0000 -62.41656 -61.04054 1.37602 1.83733 -60.57493 484.22522
6265.0000 -62.14296 -60.39100 1.75196 1.84909 -60.47166 513.45229
6270.0000 -62.00393 -60.06645 1.93748 1.86981 -60.28985 517.59561
6275.0000 -61.99335 -60.36264 1.63071 1.85753 -60.39763 541.94920
6280.0000 -62.19741 -60.23608 1.96133 1.88919 -60.11978 556.77465
6285.0000 -61.55932 -59.82395 1.73536 1.91321 -59.90893 565.03921
6290.0000 -62.34195 -60.60800 1.73395 1.86185 -60.35969 491.00687
6295.0000 -61.92682 -60.42079 1.50602 1.84040 -60.54791 494.74246
6300.0000 -62.66766 -61.24478 1.42287 1.80754 -60.83633 440.24190
6305.0000 -62.00791 -60.33508 1.67283 1.82151 -60.71377 470.70489
6310.0000 -61.82687 -60.16315 1.66372 1.89446 -60.07346 561.12454
6315.0000 -62.08262 -59.97992 2.10270 1.94008 -59.67311 617.58116
6320.0000 -62.09673 -60.10800 1.98873 1.91006 -59.93654 566.28423
6325.0000 -62.14837 -60.12894 2.01943 1.89013 -60.11151 576.13838
6330.0000 -62.02587 -59.74540 2.28047 1.94021 -59.67194 630.28966
6335.0000 -61.50615 -59.83030 1.67586 1.95849 -59.51153 614.10417
6340.0000 -61.67018 -59.47461 2.19557 1.98295 -59.29690 614.77340
6345.0000 -61.33942 -59.89808 1.44134 1.90711 -59.96244 542.55859
6350.0000 -61.38191 -59.48131 1.90060 1.96093 -59.49013 599.53125
6355.0000 -61.79212 -59.62195 2.17016 1.95723 -59.52258 583.92816
6360.0000 -61.68142 -60.08380 1.59762 1.92216 -59.83038 516.88694
6365.0000 -61.43188 -59.70836 1.72352 1.89407 -60.07687 512.11924
6370.0000 -61.78095 -60.29811 1.48284 1.91058 -59.93203 514.84252
6375.0000 -61.29592 -59.38238 1.91354 1.92498 -59.80560 537.85729
6380.0000 -61.43113 -59.79690 1.63424 1.92798 -59.77934 536.79803
6385.0000 -61.58920 -59.87160 1.71760 1.92605 -59.79621 540.82608
6390.0000 -61.54277 -59.89206 1.65071 1.89124 -60.10178 558.53121
6395.0000 -61.72565 -59.90865 1.81700 1.91399 -59.90207 574.37559
6400.0000 -62.00486 -59.91505 2.08981 1.90589 -59.97316 538.01290
6405.0000 -61.93457 -60.55829 1.37629 1.84961 -60.46711 502.20599
6410.0000 -62.42730 -61.04456 1.38274 1.83578 -60.58851 482.13812
6415.0000 -61.84958 -60.67817 1.17141 1.78557 -61.02913 441.12247
6420.0000 -62.40039 -61.05703 1.34335 1.79225 -60.97056 429.71885
6425.0000 -62.43088 -60.55540 1.87548 1.80870 -60.82617 451.60987
6430.0000 -61.60832 -59.76799 1.84033 1.88623 -60.14576 534.75688
6435.0000 -62.67532 -61.09914 1.57618 1.86131 -60.36440 505.41169
6440.0000 -62.60479 -61.20465 1.40013 1.81094 -60.80653 438.96789
6445.0000 -62.34495 -60.90357 1.44139 1.77345 -61.13550 401.03899
6450.0000 -62.18777 -60.76457 1.42320 1.81524 -60.76880 469.90087
6455.0000 -61.99764 -60.73279 1.26485 1.82600 -60.67434 467.58879
6460.0000 -62.28900 -60.69759 1.59141 1.81884 -60.73716 476.78323
6465.0000 -62.07411 -60.33221 1.74190 1.85843 -60.38975 511.31633
6470.0000 -62.11392 -60.21268 1.90124 1.86369 -60.34355 507.10950
6475.0000 -61.69963 -59.89840 1.80122 1.83491 -60.59609 490.52691
6480.0000 -61.91005 -60.21878 1.69126 1.82862 -60.65134 479.51859
6485.0000 -62.37742 -60.70696 1.67046 1.85081 -60.45660 509.12877
6490.0000 -61.91910 -59.80212 2.11698 1.83541 -60.59178 504.49573
6495.0000 -61.34706 -59.94463 1.40243 1.92628 -59.79423 581.83802
6500.0000 -62.32136 -60.56342 1.75794 1.88589 -60.14873 550.95773
FREEZING PROCESS: loop number 27 T-loop= 528.00000000000000
main_MD> interactions number 27 at Temperature= 528.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.47148 -0.04935 0.53694
force_rgl> df(natom) -1.78181 -0.55761 -0.18411
6505.0000 -61.89344 -59.99199 1.90144 1.85411 -60.42762 495.56278
6510.0000 -62.40348 -60.24150 2.16198 1.89045 -60.10865 540.90230
6515.0000 -61.98807 -60.46063 1.52744 1.86156 -60.36225 532.50850
6520.0000 -62.29024 -60.70227 1.58797 1.82655 -60.66948 492.90173
6525.0000 -62.49545 -60.59809 1.89735 1.80620 -60.84807 455.02773
6530.0000 -61.90020 -60.10400 1.79620 1.86099 -60.36723 507.29318
6535.0000 -61.72126 -60.26513 1.45613 1.90215 -60.00603 544.41396
6540.0000 -62.38292 -60.57700 1.80592 1.83056 -60.63434 479.50612
6545.0000 -61.86555 -60.14219 1.72336 1.86899 -60.29702 548.01375
6550.0000 -62.59942 -60.45602 2.14341 1.89882 -60.03526 524.27729
6555.0000 -62.08013 -60.43086 1.64928 1.84514 -60.50632 498.67407
6560.0000 -62.37523 -60.19039 2.18484 1.86419 -60.33913 531.14542
6565.0000 -62.21523 -60.70335 1.51188 1.86236 -60.35519 518.92165
6570.0000 -62.12380 -60.48302 1.64077 1.84912 -60.47145 506.82957
6575.0000 -62.55443 -60.68653 1.86790 1.82645 -60.67038 504.19684
6580.0000 -62.29476 -60.55195 1.74281 1.85747 -60.39814 518.52861
6585.0000 -61.41951 -59.80819 1.61132 1.89846 -60.03843 582.65129
6590.0000 -62.32921 -60.23619 2.09302 1.88583 -60.14920 529.98816
6595.0000 -62.18817 -60.35580 1.83237 1.84124 -60.54053 503.88157
6600.0000 -62.46619 -60.61441 1.85178 1.84196 -60.53427 520.95261
6605.0000 -62.19073 -60.15830 2.03244 1.86954 -60.29219 529.11140
6610.0000 -62.38517 -60.10136 2.28381 1.90299 -59.99863 547.38307
6615.0000 -61.65036 -60.23546 1.41489 1.85693 -60.40283 519.80755
6620.0000 -62.32453 -60.34941 1.97512 1.84418 -60.51475 490.83952
6625.0000 -61.87875 -60.33397 1.54478 1.87494 -60.24478 526.55720
6630.0000 -61.88188 -60.20991 1.67197 1.90136 -60.01291 548.60482
6635.0000 -61.85871 -59.73727 2.12144 1.90001 -60.02481 558.40735
6640.0000 -62.20194 -60.51392 1.68802 1.88881 -60.12311 543.93241
6645.0000 -62.00031 -60.23677 1.76354 1.83770 -60.57164 526.48120
6650.0000 -61.61181 -59.68703 1.92478 1.91920 -59.85638 619.35331
6655.0000 -61.91818 -60.13876 1.77941 1.88000 -60.20043 539.57396
6660.0000 -61.57517 -60.10059 1.47458 1.88024 -60.19827 534.35267
6665.0000 -62.28132 -60.74828 1.53304 1.85293 -60.43797 515.90999
6670.0000 -61.60234 -60.11071 1.49163 1.83058 -60.63414 489.97262
6675.0000 -61.60023 -60.08095 1.51928 1.90887 -59.94702 529.93358
6680.0000 -61.86013 -60.28354 1.57659 1.87287 -60.26295 522.40893
6685.0000 -62.09439 -60.26974 1.82464 1.89765 -60.04547 543.45826
6690.0000 -62.55347 -61.07304 1.48042 1.80844 -60.82848 452.47292
6695.0000 -61.61301 -59.82720 1.78581 1.87985 -60.20173 557.32229
6700.0000 -62.05523 -60.55784 1.49739 1.88060 -60.19515 527.96477
6705.0000 -62.20862 -60.35104 1.85758 1.87847 -60.21386 534.86173
6710.0000 -61.82471 -60.00631 1.81840 1.87272 -60.26425 527.37831
6715.0000 -61.95523 -59.85791 2.09732 1.92761 -59.78257 550.77315
6720.0000 -61.78022 -59.82957 1.95065 1.89135 -60.10076 554.02151
6725.0000 -62.40595 -60.50403 1.90191 1.85627 -60.40863 538.19927
6730.0000 -62.42608 -59.99756 2.42852 1.88047 -60.19625 543.01675
6735.0000 -61.50139 -59.33359 2.16780 1.92595 -59.79713 616.81845
6740.0000 -61.68609 -60.04417 1.64191 1.94825 -59.60145 615.74527
6745.0000 -61.83604 -60.08114 1.75490 1.92657 -59.79171 573.84999
6750.0000 -62.17866 -60.31369 1.86497 1.90861 -59.94930 549.29635
FREEZING PROCESS: loop number 28 T-loop= 503.00000000000000
main_MD> interactions number 28 at Temperature= 503.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.59032 -1.69108 -1.68943
force_rgl> df(natom) -2.37196 -1.78602 -2.87596
6755.0000 -62.23413 -60.65873 1.57540 1.83464 -60.59846 474.18824
6760.0000 -62.59703 -60.81164 1.78539 1.79946 -60.90728 437.87176
6765.0000 -62.37794 -60.69591 1.68203 1.83562 -60.58991 494.20921
6770.0000 -62.41988 -60.73915 1.68073 1.80567 -60.85272 466.35850
6775.0000 -61.96469 -60.60774 1.35696 1.81125 -60.80374 477.49825
6780.0000 -62.50578 -61.06715 1.43863 1.80889 -60.82447 470.17883
6785.0000 -62.01683 -60.86948 1.14735 1.82226 -60.70717 461.49073
6790.0000 -62.66596 -61.00169 1.66428 1.76118 -61.24321 396.63928
6795.0000 -61.56665 -59.84990 1.71675 1.86328 -60.34715 523.37976
6800.0000 -62.06227 -60.16602 1.89625 1.89949 -60.02938 562.45115
6805.0000 -62.12919 -59.96117 2.16802 1.90139 -60.01271 526.92560
6810.0000 -62.30399 -60.61534 1.68865 1.90620 -59.97048 574.41383
6815.0000 -62.63151 -60.66834 1.96317 1.83377 -60.60610 494.26419
6820.0000 -61.75577 -60.31286 1.44291 1.84127 -60.54034 475.83925
6825.0000 -62.12731 -60.26622 1.86108 1.87395 -60.25350 516.66586
6830.0000 -62.31294 -60.72702 1.58592 1.85679 -60.40409 520.77268
6835.0000 -62.07358 -60.41487 1.65872 1.84052 -60.54689 495.75106
6840.0000 -61.95315 -60.51594 1.43721 1.84802 -60.48109 497.26663
6845.0000 -61.68688 -60.10304 1.58384 1.86915 -60.29559 531.08428
6850.0000 -62.37960 -60.67313 1.70647 1.86833 -60.30280 532.98975
6855.0000 -62.40443 -60.83521 1.56922 1.85030 -60.46102 521.03832
6860.0000 -62.45151 -61.20116 1.25035 1.78427 -61.04053 440.03381
6865.0000 -62.41286 -59.98390 2.42896 1.83181 -60.62336 501.04415
6870.0000 -61.78199 -59.97196 1.81003 1.89059 -60.10747 566.98113
6875.0000 -62.25913 -60.56123 1.69789 1.86002 -60.37575 496.83993
6880.0000 -62.17620 -60.03637 2.13983 1.89226 -60.09280 559.33948
6885.0000 -61.58070 -60.23600 1.34469 1.88146 -60.18762 543.29743
6890.0000 -62.57746 -60.94411 1.63334 1.86288 -60.35068 518.25880
6895.0000 -62.29453 -60.62925 1.66528 1.81574 -60.76436 483.33947
6900.0000 -62.20449 -60.69729 1.50720 1.83640 -60.58303 494.65903
6905.0000 -61.96990 -60.50951 1.46039 1.83789 -60.56997 494.38550
6910.0000 -61.98873 -60.44645 1.54228 1.82816 -60.65536 486.91976
6915.0000 -62.39367 -61.08728 1.30639 1.82759 -60.66038 487.20913
6920.0000 -62.38878 -61.17198 1.21681 1.78202 -61.06027 416.21090
6925.0000 -61.70153 -60.25286 1.44867 1.84322 -60.52316 501.75611
6930.0000 -61.91805 -60.14999 1.76806 1.85766 -60.39649 506.60815
6935.0000 -61.77493 -59.65991 2.11502 1.90342 -59.99484 565.30160
6940.0000 -61.56434 -59.81546 1.74889 1.95736 -59.52146 599.82857
6945.0000 -62.55115 -60.68056 1.87059 1.87479 -60.24616 557.63096
6950.0000 -62.63384 -61.13121 1.50263 1.80640 -60.84633 467.53256
6955.0000 -61.92101 -60.42988 1.49113 1.79129 -60.97897 441.50789
6960.0000 -62.16770 -60.24663 1.92106 1.87046 -60.28409 513.14952
6965.0000 -61.79084 -60.76124 1.02960 1.86914 -60.29569 531.26909
6970.0000 -62.02398 -60.24012 1.78387 1.83433 -60.60119 485.70171
6975.0000 -62.10120 -60.40410 1.69710 1.86954 -60.29221 524.04197
6980.0000 -61.75895 -60.13874 1.62021 1.86163 -60.36164 453.59871
6985.0000 -62.04006 -60.27550 1.76457 1.87858 -60.21282 542.01040
6990.0000 -62.33273 -60.74984 1.58290 1.83453 -60.59950 492.12957
6995.0000 -62.55482 -60.78083 1.77399 1.81550 -60.76646 466.79521
7000.0000 -61.81642 -59.98477 1.83165 1.84532 -60.50480 521.12533
FREEZING PROCESS: loop number 29 T-loop= 478.00000000000000
main_MD> interactions number 29 at Temperature= 478.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -2.63997 2.62668 -1.89598
force_rgl> df(natom) 2.95283 2.50465 -0.63010
7005.0000 -62.23791 -60.55775 1.68015 1.87690 -60.22760 521.08968
7010.0000 -61.84059 -60.35472 1.48587 1.86937 -60.29370 517.37704
7015.0000 -61.72788 -60.04989 1.67799 1.87446 -60.24906 516.11036
7020.0000 -62.00465 -60.45997 1.54467 1.87748 -60.22256 535.06957
7025.0000 -62.26211 -60.71529 1.54683 1.83234 -60.61872 460.07040
7030.0000 -62.28589 -60.55856 1.72733 1.82229 -60.70684 463.67960
7035.0000 -62.27247 -60.52696 1.74551 1.81078 -60.80790 456.08287
7040.0000 -62.13631 -60.46671 1.66960 1.86102 -60.36698 481.78954
7045.0000 -62.40771 -60.91765 1.49006 1.82770 -60.65936 484.60329
7050.0000 -62.41473 -61.01923 1.39551 1.82459 -60.68668 477.65276
7055.0000 -62.28582 -60.94358 1.34224 1.76188 -61.23705 392.14379
7060.0000 -62.48201 -60.97306 1.50896 1.80248 -60.88076 444.01768
7065.0000 -62.19724 -60.13814 2.05910 1.82781 -60.65847 471.31613
7070.0000 -62.61434 -61.01232 1.60203 1.83634 -60.58357 485.53783
7075.0000 -62.48218 -61.00942 1.47276 1.80202 -60.88482 461.68800
7080.0000 -62.70834 -61.27462 1.43372 1.79144 -60.97762 430.93872
7085.0000 -62.88073 -61.27944 1.60128 1.74533 -61.38231 396.91794
7090.0000 -62.14649 -60.72370 1.42279 1.78832 -61.00498 437.01418
7095.0000 -62.16253 -60.75440 1.40813 1.81677 -60.75535 465.84514
7100.0000 -62.56981 -61.27068 1.29913 1.80655 -60.84507 458.39419
7105.0000 -62.65216 -61.00940 1.64276 1.79566 -60.94057 441.42719
7110.0000 -62.74512 -61.07460 1.67052 1.78202 -61.06028 432.66954
7115.0000 -62.02955 -60.72348 1.30607 1.79359 -60.95876 438.44807
7120.0000 -61.98790 -60.67564 1.31226 1.84599 -60.49886 504.20224
7125.0000 -62.01300 -60.11192 1.90108 1.88758 -60.13386 562.99379
7130.0000 -62.13757 -60.33782 1.79975 1.87910 -60.20829 522.77802
7135.0000 -62.68339 -61.39165 1.29173 1.78021 -61.07616 431.18980
7140.0000 -62.41751 -61.05440 1.36311 1.77187 -61.14939 417.75078
7145.0000 -61.85631 -60.69053 1.16578 1.80385 -60.86869 449.90891
7150.0000 -62.67179 -60.80152 1.87027 1.83737 -60.57452 498.90061
7155.0000 -62.74021 -61.22203 1.51817 1.78460 -61.03768 442.02897
7160.0000 -62.23970 -60.66421 1.57549 1.79786 -60.92128 458.87474
7165.0000 -62.57132 -60.92833 1.64299 1.80142 -60.89008 451.35942
7170.0000 -62.48337 -60.85110 1.63227 1.80678 -60.84300 452.31507
7175.0000 -62.34962 -60.18360 2.16602 1.82923 -60.64600 494.04053
7180.0000 -62.52917 -60.43826 2.09091 1.87716 -60.22535 539.08751
7185.0000 -62.25678 -60.47359 1.78319 1.86898 -60.29707 506.26451
7190.0000 -62.28420 -60.75353 1.53067 1.81863 -60.73900 487.04002
7195.0000 -62.23033 -60.71596 1.51437 1.82076 -60.72033 478.82559
7200.0000 -62.10821 -60.21926 1.88895 1.82567 -60.67721 490.24293
7205.0000 -62.49527 -60.88054 1.61472 1.82137 -60.71492 484.00690
7210.0000 -62.67771 -60.91770 1.76001 1.78531 -61.03141 417.82633
7215.0000 -62.56072 -61.19343 1.36729 1.76508 -61.20898 406.14917
7220.0000 -62.32362 -60.54948 1.77414 1.81545 -60.76694 501.58434
7225.0000 -62.23110 -60.63619 1.59491 1.80861 -60.82697 472.09835
7230.0000 -62.18980 -61.08034 1.10946 1.79531 -60.94368 447.91374
7235.0000 -62.86198 -61.61374 1.24824 1.76590 -61.20181 412.44986
7240.0000 -62.76153 -61.63146 1.13007 1.74423 -61.39194 388.69513
7245.0000 -62.21651 -61.08380 1.13271 1.76369 -61.22114 412.45590
7250.0000 -62.02183 -60.51779 1.50405 1.80387 -60.86858 447.18781
FREEZING PROCESS: loop number 30 T-loop= 453.00000000000000
main_MD> interactions number 30 at Temperature= 453.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.50355 -0.35702 -1.59804
force_rgl> df(natom) 1.17780 -0.17314 -1.80506
7255.0000 -62.46150 -60.55457 1.90694 1.85024 -60.46158 508.20620
7260.0000 -62.17156 -60.23949 1.93207 1.82870 -60.65059 481.95448
7265.0000 -62.43638 -60.69488 1.74150 1.84047 -60.54731 502.53101
7270.0000 -62.53130 -61.05882 1.47249 1.79239 -60.96929 432.35276
7275.0000 -62.39307 -61.16874 1.22433 1.77313 -61.13835 425.21057
7280.0000 -62.64924 -61.18950 1.45974 1.74916 -61.34874 370.44624
7285.0000 -61.94765 -60.58546 1.36219 1.79701 -60.92874 450.90722
7290.0000 -62.32515 -60.57185 1.75330 1.81638 -60.75878 476.82667
7295.0000 -62.61895 -60.85767 1.76128 1.80377 -60.86939 452.48853
7300.0000 -62.53715 -60.28925 2.24789 1.82889 -60.64892 472.41184
7305.0000 -62.26797 -60.27732 1.99065 1.83437 -60.60091 486.05330
7310.0000 -62.11096 -60.31030 1.80066 1.86078 -60.36909 520.26783
7315.0000 -61.63291 -59.75894 1.87397 1.90084 -60.01751 543.61831
7320.0000 -61.87224 -60.26656 1.60568 1.87212 -60.26953 528.21630
7325.0000 -62.49233 -61.27017 1.22216 1.81580 -60.76382 454.66849
7330.0000 -62.37325 -60.56695 1.80630 1.81036 -60.81161 448.12887
7335.0000 -62.23947 -60.53467 1.70480 1.84710 -60.48910 502.88963
7340.0000 -62.47455 -60.66637 1.80818 1.81478 -60.77276 467.95097
7345.0000 -62.14098 -60.51872 1.62227 1.80833 -60.82944 474.95163
7350.0000 -62.88634 -61.46004 1.42630 1.80525 -60.85644 455.98561
7355.0000 -62.25895 -60.87010 1.38885 1.76802 -61.18319 387.01280
7360.0000 -62.35510 -60.85368 1.50142 1.80273 -60.87858 449.35782
7365.0000 -62.12819 -60.81971 1.30848 1.77471 -61.12446 412.35450
7370.0000 -62.30016 -61.03562 1.26454 1.80558 -60.85354 446.10187
7375.0000 -62.12745 -60.63783 1.48962 1.82188 -60.71049 485.73087
7380.0000 -62.22631 -60.42002 1.80629 1.84673 -60.49237 516.66002
7385.0000 -62.52198 -60.87095 1.65103 1.83819 -60.56733 495.14676
7390.0000 -62.43445 -61.17190 1.26256 1.79019 -60.98857 433.79748
7395.0000 -61.98857 -60.70188 1.28669 1.80595 -60.85026 443.16971
7400.0000 -62.14905 -60.72727 1.42179 1.86427 -60.33842 526.43095
7405.0000 -62.32646 -60.96075 1.36571 1.79421 -60.95330 447.02108
7410.0000 -62.18843 -60.57931 1.60912 1.80964 -60.81794 478.13372
7415.0000 -62.17294 -60.27555 1.89740 1.87653 -60.23082 530.71873
7420.0000 -61.53072 -60.28954 1.24118 1.87950 -60.20475 532.30620
7425.0000 -61.97028 -60.52703 1.44325 1.83364 -60.60732 483.00073
7430.0000 -62.47509 -60.53420 1.94089 1.82588 -60.67535 469.25798
7435.0000 -62.61133 -60.74061 1.87072 1.82198 -60.70960 474.93788
7440.0000 -62.12412 -60.60239 1.52173 1.82790 -60.65767 467.76678
7445.0000 -62.27648 -60.28039 1.99609 1.82721 -60.66372 489.82583
7450.0000 -62.41183 -60.79100 1.62083 1.84115 -60.54133 485.14007
7455.0000 -62.38867 -61.11668 1.27199 1.80941 -60.81993 448.39152
7460.0000 -62.59249 -61.13421 1.45827 1.75987 -61.25467 391.17888
7465.0000 -62.59473 -61.50998 1.08475 1.74278 -61.40472 366.47776
7470.0000 -62.91406 -61.28839 1.62566 1.74515 -61.38387 386.43384
7475.0000 -63.05172 -61.52837 1.52335 1.72131 -61.59315 368.46270
7480.0000 -62.58740 -60.87041 1.71699 1.76323 -61.22526 408.67412
7485.0000 -62.44079 -61.01248 1.42830 1.79300 -60.96396 440.86499
7490.0000 -61.67858 -59.99902 1.67957 1.83167 -60.62460 456.15781
7495.0000 -62.47016 -60.83677 1.63339 1.81252 -60.79264 464.32484
7500.0000 -62.36921 -60.84795 1.52126 1.78750 -61.01218 444.24710
FREEZING PROCESS: loop number 31 T-loop= 428.00000000000000
main_MD> interactions number 31 at Temperature= 428.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.07502 -0.22393 1.56674
force_rgl> df(natom) -2.16393 4.58333 0.44520
7505.0000 -62.08640 -60.43049 1.65591 1.81472 -60.77335 463.91177
7510.0000 -62.38113 -60.79393 1.58719 1.81745 -60.74936 458.95591
7515.0000 -62.45376 -61.02875 1.42502 1.77229 -61.14568 419.63983
7520.0000 -62.42433 -61.10711 1.31723 1.77410 -61.12979 424.69144
7525.0000 -62.82966 -61.62150 1.20816 1.72558 -61.55563 376.22623
7530.0000 -62.54556 -61.08729 1.45827 1.73150 -61.50369 378.21089
7535.0000 -62.25085 -60.66027 1.59058 1.79199 -60.97278 450.45704
7540.0000 -62.70902 -61.10946 1.59956 1.81057 -60.80971 464.10242
7545.0000 -62.52278 -61.04539 1.47739 1.78222 -61.05852 438.18227
7550.0000 -62.53311 -61.33587 1.19724 1.82208 -60.70870 479.79579
7555.0000 -62.64214 -61.29518 1.34696 1.73656 -61.45927 375.15175
7560.0000 -62.72281 -61.07074 1.65208 1.76263 -61.23044 406.64406
7565.0000 -62.29530 -60.77253 1.52277 1.79957 -60.90625 456.09550
7570.0000 -62.30668 -60.66868 1.63800 1.82633 -60.67144 465.47272
7575.0000 -62.39278 -60.68490 1.70788 1.83173 -60.62400 458.01749
7580.0000 -62.04004 -60.19026 1.84978 1.82639 -60.67091 460.51093
7585.0000 -62.28456 -60.83208 1.45248 1.82412 -60.69080 474.10891
7590.0000 -62.58152 -60.95666 1.62486 1.79897 -60.91152 436.50909
7595.0000 -62.19559 -60.66855 1.52704 1.80539 -60.85523 470.37265
7600.0000 -62.61404 -61.20892 1.40512 1.79987 -60.90368 433.28288
7605.0000 -62.42514 -61.16330 1.26184 1.76596 -61.20122 406.91937
7610.0000 -62.55678 -60.82149 1.73529 1.79929 -60.90873 449.35013
7615.0000 -62.30156 -60.86818 1.43338 1.80097 -60.89398 442.03226
7620.0000 -62.24733 -60.50679 1.74055 1.78052 -61.07352 429.52533
7625.0000 -61.84062 -60.26851 1.57211 1.85388 -60.42964 501.11084
7630.0000 -62.44049 -60.67872 1.76177 1.83432 -60.60126 464.29685
7635.0000 -62.36626 -61.09791 1.26834 1.80662 -60.84437 458.40591
7640.0000 -62.54676 -61.12710 1.41966 1.77441 -61.12709 405.87449
7645.0000 -62.55281 -61.06310 1.48971 1.78181 -61.06213 433.19863
7650.0000 -62.49706 -61.07412 1.42295 1.76459 -61.21332 418.62433
7655.0000 -62.55931 -60.86341 1.69590 1.81756 -60.74842 485.39160
7660.0000 -62.00788 -60.74875 1.25913 1.82362 -60.69518 458.91807
7665.0000 -62.37561 -60.83783 1.53778 1.81924 -60.73365 457.20436
7670.0000 -62.11121 -60.68089 1.43032 1.79703 -60.92854 436.53599
7675.0000 -62.47566 -61.20946 1.26620 1.80421 -60.86559 467.91658
7680.0000 -62.65182 -60.92032 1.73151 1.80436 -60.86420 468.71969
7685.0000 -62.35514 -60.69808 1.65706 1.79673 -60.93120 456.29189
7690.0000 -62.44920 -60.70454 1.74466 1.79569 -60.94037 445.85326
7695.0000 -62.44737 -60.79502 1.65235 1.79924 -60.90920 464.81470
7700.0000 -62.32002 -61.18272 1.13730 1.77574 -61.11539 426.63477
7705.0000 -62.95976 -61.03808 1.92168 1.77266 -61.14250 406.72940
7710.0000 -62.84748 -61.25448 1.59300 1.77701 -61.10429 432.07745
7715.0000 -62.84784 -61.11223 1.73560 1.76896 -61.17490 417.40637
7720.0000 -62.98613 -61.77937 1.20675 1.73611 -61.46322 375.50601
7725.0000 -62.62275 -60.84508 1.77767 1.74405 -61.39357 388.34119
7730.0000 -62.40868 -61.13633 1.27235 1.76963 -61.16906 409.99840
7735.0000 -62.50890 -60.91545 1.59345 1.82225 -60.70721 489.63553
7740.0000 -62.35102 -61.04903 1.30198 1.79734 -60.92590 442.41327
7745.0000 -62.48289 -61.17123 1.31166 1.79332 -60.96110 431.62561
7750.0000 -62.75798 -61.49372 1.26426 1.76354 -61.22251 374.16127
FREEZING PROCESS: loop number 32 T-loop= 403.00000000000000
main_MD> interactions number 32 at Temperature= 403.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.29833 0.06283 -1.19355
force_rgl> df(natom) -1.68951 0.98606 0.28136
7755.0000 -62.65601 -61.42104 1.23497 1.73419 -61.48011 375.42297
7760.0000 -62.95100 -61.52339 1.42761 1.73325 -61.48836 377.60192
7765.0000 -62.81639 -61.93866 0.87774 1.69496 -61.82441 332.29302
7770.0000 -62.70112 -61.46138 1.23974 1.72796 -61.53478 366.06367
7775.0000 -62.07590 -60.78469 1.29121 1.76614 -61.19966 411.01491
7780.0000 -62.61173 -60.75178 1.85994 1.85588 -60.41205 502.41046
7785.0000 -62.21626 -60.74216 1.47410 1.82676 -60.66766 465.70196
7790.0000 -61.61555 -60.22466 1.39090 1.81408 -60.77890 461.19732
7795.0000 -62.58650 -60.63392 1.95258 1.82930 -60.64533 493.94743
7800.0000 -62.79247 -61.04431 1.74816 1.82659 -60.66915 489.27729
7805.0000 -62.23440 -61.02476 1.20964 1.79266 -60.96690 454.71421
7810.0000 -62.55878 -61.08474 1.47404 1.80478 -60.86053 455.42811
7815.0000 -62.33366 -60.87143 1.46223 1.77035 -61.16271 412.39235
7820.0000 -62.16235 -60.74917 1.41317 1.80986 -60.81595 442.40665
7825.0000 -62.38358 -61.24083 1.14275 1.78389 -61.04388 418.97572
7830.0000 -62.56804 -61.21008 1.35795 1.78815 -61.00655 427.58594
7835.0000 -62.05076 -60.79909 1.25167 1.80072 -60.89620 446.32769
7840.0000 -62.06163 -60.73678 1.32485 1.82861 -60.65140 455.04431
7845.0000 -62.55503 -60.90102 1.65401 1.80289 -60.87714 442.03505
7850.0000 -62.06759 -60.69613 1.37145 1.81229 -60.79463 444.54441
7855.0000 -62.69495 -61.16288 1.53207 1.78835 -61.00471 437.74487
7860.0000 -62.59182 -60.83058 1.76124 1.77437 -61.12749 421.70575
7865.0000 -62.50386 -61.10381 1.40005 1.79259 -60.96751 444.92679
7870.0000 -62.80094 -61.89911 0.90183 1.76121 -61.24293 403.58769
7875.0000 -62.37716 -61.26942 1.10774 1.74860 -61.35362 381.16764
7880.0000 -62.55081 -61.21514 1.33567 1.74649 -61.37215 373.98325
7885.0000 -62.63035 -61.12782 1.50253 1.77365 -61.13376 410.04078
7890.0000 -61.83535 -59.75766 2.07769 1.81605 -60.76164 461.71836
7895.0000 -61.90039 -60.63310 1.26729 1.87033 -60.28528 490.95876
7900.0000 -62.62052 -61.59607 1.02444 1.74743 -61.36384 379.84510
7905.0000 -62.64326 -61.22554 1.41772 1.74786 -61.36007 380.87194
7910.0000 -62.23207 -60.62866 1.60341 1.80874 -60.82577 439.70089
7915.0000 -62.48869 -61.28700 1.20169 1.76593 -61.20150 393.82135
7920.0000 -62.44938 -61.05566 1.39372 1.77911 -61.08582 419.56918
7925.0000 -62.11508 -60.72778 1.38730 1.80178 -60.88685 451.82485
7930.0000 -62.24399 -60.85163 1.39237 1.80961 -60.81821 478.15854
7935.0000 -62.42203 -61.04154 1.38049 1.78941 -60.99543 442.71326
7940.0000 -62.41763 -61.19413 1.22350 1.76960 -61.16934 405.38600
7945.0000 -62.22701 -61.17302 1.05399 1.77299 -61.13958 402.38439
7950.0000 -62.38468 -61.22516 1.15952 1.77353 -61.13480 408.57616
7955.0000 -62.38946 -61.00921 1.38026 1.77702 -61.10422 419.41652
7960.0000 -62.53183 -61.30655 1.22528 1.75672 -61.28233 403.38260
7965.0000 -62.72877 -61.29283 1.43594 1.76421 -61.21658 403.48784
7970.0000 -62.65072 -61.65399 0.99673 1.74000 -61.42910 375.47756
7975.0000 -62.75849 -61.54573 1.21275 1.76044 -61.24971 396.81649
7980.0000 -62.96151 -61.49595 1.46556 1.73926 -61.43558 363.39414
7985.0000 -62.70603 -61.50970 1.19634 1.74303 -61.40251 378.30443
7990.0000 -62.62479 -61.26629 1.35850 1.73491 -61.47376 373.06230
7995.0000 -62.88509 -61.65158 1.23351 1.75250 -61.31940 399.61081
8000.0000 -62.62782 -61.32715 1.30067 1.73574 -61.46648 382.35587
FREEZING PROCESS: loop number 33 T-loop= 378.00000000000000
main_MD> interactions number 33 at Temperature= 378.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -2.38414 0.83029 0.55000
force_rgl> df(natom) -1.19669 -0.47374 0.87821
8005.0000 -62.65585 -61.60779 1.04806 1.73629 -61.46164 365.74036
8010.0000 -62.73804 -61.14688 1.59116 1.76576 -61.20299 403.36183
8015.0000 -62.60727 -61.28773 1.31954 1.78714 -61.01533 433.81006
8020.0000 -63.01419 -61.78462 1.22957 1.72783 -61.53593 358.51175
8025.0000 -62.89777 -61.80233 1.09543 1.71327 -61.66372 347.84228
8030.0000 -62.76695 -61.62565 1.14130 1.67832 -61.97044 313.28697
8035.0000 -62.59218 -61.42655 1.16563 1.72068 -61.59865 355.02451
8040.0000 -63.04537 -61.74715 1.29822 1.71813 -61.62105 359.34151
8045.0000 -62.98758 -61.72617 1.26141 1.70774 -61.71225 357.36770
8050.0000 -62.77710 -61.37467 1.40243 1.73602 -61.46405 384.95376
8055.0000 -62.88333 -61.70229 1.18104 1.69996 -61.78050 334.79728
8060.0000 -62.75222 -61.69381 1.05841 1.72054 -61.59985 355.24557
8065.0000 -62.61383 -61.42624 1.18758 1.71731 -61.62821 344.75680
8070.0000 -62.75157 -61.61157 1.14000 1.72066 -61.59883 362.99275
8075.0000 -62.64251 -61.64385 0.99865 1.72926 -61.52332 361.71636
8080.0000 -62.77338 -61.53835 1.23503 1.71367 -61.66015 360.12993
8085.0000 -62.73802 -61.37938 1.35865 1.72537 -61.55753 367.20376
8090.0000 -63.09081 -61.57350 1.51731 1.71874 -61.61564 357.81934
8095.0000 -62.61420 -60.98908 1.62512 1.76283 -61.22870 406.54772
8100.0000 -62.92937 -61.80046 1.12892 1.74309 -61.40201 378.83813
8105.0000 -62.78042 -61.59138 1.18904 1.73049 -61.51257 358.92688
8110.0000 -62.58766 -61.48846 1.09919 1.72219 -61.58538 359.29378
8115.0000 -62.49905 -61.30564 1.19341 1.76597 -61.20118 412.44426
8120.0000 -62.33478 -60.62286 1.71192 1.81179 -60.79902 461.47639
8125.0000 -62.70558 -61.48240 1.22318 1.77838 -61.09229 421.01713
8130.0000 -62.50007 -61.40787 1.09220 1.72142 -61.59217 360.63677
8135.0000 -62.80659 -61.48807 1.31853 1.76908 -61.17388 417.43654
8140.0000 -62.28371 -61.16976 1.11395 1.75882 -61.26394 405.70809
8145.0000 -62.38142 -60.99548 1.38595 1.74425 -61.39179 387.90217
8150.0000 -62.73321 -61.62348 1.10973 1.75761 -61.27455 390.58871
8155.0000 -62.58157 -61.30288 1.27869 1.72070 -61.59846 339.65877
8160.0000 -63.06561 -61.93484 1.13077 1.69615 -61.81391 312.90112
8165.0000 -62.84619 -61.68529 1.16090 1.71571 -61.64225 338.65101
8170.0000 -63.01539 -61.89921 1.11618 1.71228 -61.67242 340.21424
8175.0000 -62.63541 -61.29331 1.34210 1.72908 -61.52491 359.87408
8180.0000 -62.33586 -61.32001 1.01584 1.76217 -61.23448 407.33578
8185.0000 -62.55501 -61.37315 1.18186 1.75134 -61.32958 382.89922
8190.0000 -62.31336 -60.72372 1.58963 1.74726 -61.36538 383.76172
8195.0000 -62.84903 -61.24037 1.60866 1.80280 -60.87793 458.67345
8200.0000 -62.47683 -61.13323 1.34360 1.77501 -61.12182 420.12016
8205.0000 -62.66332 -61.01195 1.65137 1.78251 -61.05598 438.86909
8210.0000 -62.65152 -61.40637 1.24515 1.76707 -61.19152 409.03250
8215.0000 -62.42850 -61.47057 0.95793 1.71861 -61.61683 346.98160
8220.0000 -62.66333 -60.83719 1.82614 1.75643 -61.28486 384.29600
8225.0000 -62.64794 -61.08365 1.56429 1.80248 -60.88070 440.26017
8230.0000 -62.48437 -61.20941 1.27496 1.77618 -61.11158 419.32152
8235.0000 -62.70277 -61.40835 1.29443 1.76070 -61.24738 388.77407
8240.0000 -62.59903 -61.28403 1.31499 1.73400 -61.48172 362.86444
8245.0000 -62.50227 -60.76599 1.73628 1.78466 -61.03712 436.30378
8250.0000 -62.69294 -61.27385 1.41908 1.77495 -61.12234 417.89737
FREEZING PROCESS: loop number 34 T-loop= 353.00000000000000
main_MD> interactions number 34 at Temperature= 353.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.77644 -0.77200 2.02701
force_rgl> df(natom) 0.06925 -0.76788 2.85163
8255.0000 -62.73005 -61.41867 1.31138 1.77155 -61.15223 404.89555
8260.0000 -62.50443 -61.53050 0.97393 1.74015 -61.42774 330.47551
8265.0000 -62.65648 -61.18459 1.47188 1.74126 -61.41800 363.22869
8270.0000 -62.42738 -61.30658 1.12080 1.76181 -61.23770 386.86208
8275.0000 -62.62862 -61.23020 1.39842 1.73850 -61.44228 360.68131
8280.0000 -62.79779 -61.27632 1.52147 1.75206 -61.32325 384.03968
8285.0000 -62.89171 -61.42220 1.46951 1.73038 -61.51352 358.67199
8290.0000 -62.47302 -60.98147 1.49155 1.76084 -61.24619 383.55838
8295.0000 -62.87278 -61.59393 1.27885 1.77469 -61.12461 410.05917
8300.0000 -62.53913 -61.54961 0.98952 1.74227 -61.40920 376.54838
8305.0000 -63.09558 -61.53011 1.56548 1.73930 -61.43522 364.44496
8310.0000 -62.74582 -61.58440 1.16142 1.72807 -61.53379 344.11788
8315.0000 -62.82032 -61.95116 0.86916 1.70009 -61.77933 317.44634
8320.0000 -62.76838 -61.55876 1.20963 1.71211 -61.67391 339.84449
8325.0000 -62.75026 -61.31280 1.43746 1.73561 -61.46765 356.62831
8330.0000 -62.92474 -61.56785 1.35689 1.74893 -61.35076 378.67326
8335.0000 -62.65815 -61.45221 1.20593 1.74021 -61.42723 368.05032
8340.0000 -62.72738 -61.46476 1.26262 1.74471 -61.38774 354.90686
8345.0000 -62.73512 -61.46628 1.26884 1.72059 -61.59944 349.24460
8350.0000 -62.73504 -61.81466 0.92038 1.70416 -61.74363 328.09608
8355.0000 -62.66579 -61.41134 1.25445 1.71500 -61.64850 346.11374
8360.0000 -62.75543 -61.97296 0.78247 1.74025 -61.42686 388.62328
8365.0000 -62.62471 -61.40368 1.22102 1.71393 -61.65789 349.42956
8370.0000 -62.90186 -61.63714 1.26472 1.72885 -61.52691 356.50540
8375.0000 -62.37422 -61.10773 1.26648 1.75117 -61.33104 400.84471
8380.0000 -62.71586 -61.47211 1.24375 1.75093 -61.33314 390.69698
8385.0000 -62.75266 -61.53779 1.21487 1.75154 -61.32778 401.38657
8390.0000 -62.80502 -61.61223 1.19279 1.71180 -61.67655 340.97737
8395.0000 -63.01890 -61.60553 1.41337 1.71670 -61.63359 363.10539
8400.0000 -62.97391 -61.73303 1.24088 1.69240 -61.84684 326.02588
8405.0000 -62.71666 -61.39810 1.31856 1.72385 -61.57086 364.80111
8410.0000 -62.51733 -61.11310 1.40423 1.74759 -61.36246 380.22402
8415.0000 -62.39886 -61.22195 1.17691 1.75874 -61.26460 390.42393
8420.0000 -62.63630 -61.56094 1.07536 1.70975 -61.69462 334.62512
8425.0000 -62.67959 -61.53192 1.14767 1.74497 -61.38552 391.86824
8430.0000 -62.83577 -61.97965 0.85612 1.71309 -61.66524 339.78562
8435.0000 -62.66428 -61.34065 1.32363 1.69126 -61.85683 325.92901
8440.0000 -62.92287 -61.75939 1.16348 1.71391 -61.65811 338.67851
8445.0000 -62.97938 -61.91651 1.06287 1.68918 -61.87507 322.68320
8450.0000 -62.84279 -61.84270 1.00009 1.68071 -61.94942 313.27567
8455.0000 -62.84677 -61.96026 0.88651 1.67536 -61.99641 305.05910
8460.0000 -63.10870 -61.97212 1.13658 1.68756 -61.88929 315.19894
8465.0000 -63.00094 -61.76381 1.23713 1.69667 -61.80935 329.66583
8470.0000 -62.79098 -61.30903 1.48195 1.72120 -61.59406 358.11828
8475.0000 -62.56490 -61.26101 1.30389 1.76602 -61.20074 407.88329
8480.0000 -62.60730 -61.42726 1.18004 1.75401 -61.30614 394.08306
8485.0000 -62.88014 -61.73926 1.14088 1.73379 -61.48361 357.12649
8490.0000 -62.66288 -61.43376 1.22912 1.71515 -61.64722 344.76246
8495.0000 -62.46195 -61.24852 1.21342 1.76743 -61.18835 405.40905
8500.0000 -62.51122 -61.19560 1.31562 1.78150 -61.06486 411.01767
FREEZING PROCESS: loop number 35 T-loop= 328.00000000000000
main_MD> interactions number 35 at Temperature= 328.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -2.10686 1.30712 -0.45154
force_rgl> df(natom) -3.03120 -1.60867 0.26858
8505.0000 -62.83653 -61.84130 0.99523 1.71948 -61.60922 356.94507
8510.0000 -62.57558 -61.41611 1.15947 1.71795 -61.62260 355.13882
8515.0000 -62.51460 -61.25518 1.25941 1.77579 -61.11500 408.65009
8520.0000 -62.62200 -61.33413 1.28787 1.74853 -61.35421 392.67573
8525.0000 -62.44744 -61.03411 1.41333 1.75528 -61.29499 395.50623
8530.0000 -62.81969 -61.61132 1.20837 1.74055 -61.42429 394.05222
8535.0000 -62.79369 -61.89533 0.89836 1.69429 -61.83022 325.09002
8540.0000 -63.16475 -62.27594 0.88881 1.69474 -61.82629 325.12993
8545.0000 -63.12792 -62.16475 0.96318 1.65316 -62.19124 279.62973
8550.0000 -63.08258 -62.00172 1.08086 1.67530 -61.99696 304.72920
8555.0000 -63.06489 -61.89097 1.17392 1.67619 -61.98907 305.75152
8560.0000 -62.93789 -61.90868 1.02921 1.68151 -61.94244 303.47314
8565.0000 -63.17116 -62.13417 1.03700 1.67732 -61.97921 306.89800
8570.0000 -62.63063 -61.67147 0.95917 1.70263 -61.75706 331.53344
8575.0000 -62.88676 -62.00629 0.88047 1.71438 -61.65394 354.51139
8580.0000 -63.07753 -61.93543 1.14210 1.68411 -61.91958 311.22376
8585.0000 -63.08485 -61.72533 1.35953 1.69730 -61.80384 339.31601
8590.0000 -62.90967 -61.66429 1.24538 1.69644 -61.81137 333.96402
8595.0000 -63.08560 -61.80680 1.27880 1.70216 -61.76120 334.36164
8600.0000 -62.85145 -62.09812 0.75332 1.68713 -61.89313 316.47334
8605.0000 -63.06534 -61.88941 1.17593 1.67366 -62.01128 300.04873
8610.0000 -63.10556 -62.09076 1.01480 1.66938 -62.04885 301.41318
8615.0000 -63.17636 -62.53220 0.64416 1.63320 -62.36638 258.54078
8620.0000 -63.10584 -62.31359 0.79225 1.62579 -62.43145 246.63871
8625.0000 -62.84766 -62.00213 0.84553 1.65165 -62.20449 276.98458
8630.0000 -62.83602 -61.86920 0.96683 1.68739 -61.89081 317.75298
8635.0000 -62.62784 -61.39800 1.22984 1.70402 -61.74488 341.22600
8640.0000 -62.62705 -61.44328 1.18378 1.73355 -61.48574 374.10676
8645.0000 -62.88772 -61.83334 1.05438 1.72271 -61.58081 358.41158
8650.0000 -62.92182 -61.85167 1.07015 1.65918 -62.13842 283.44451
8655.0000 -62.93265 -61.93717 0.99548 1.69523 -61.82205 305.38961
8660.0000 -62.89265 -61.99898 0.89367 1.68026 -61.95343 292.35148
8665.0000 -62.96583 -62.05122 0.91461 1.67602 -61.99056 298.15319
8670.0000 -62.93821 -61.71962 1.21859 1.69284 -61.84303 328.92616
8675.0000 -63.00453 -61.65311 1.35142 1.72189 -61.58805 367.27737
8680.0000 -62.60620 -61.65833 0.94788 1.71853 -61.61749 336.26629
8685.0000 -62.91201 -61.66928 1.24274 1.70912 -61.70011 337.52317
8690.0000 -63.09071 -62.22046 0.87025 1.66960 -62.04696 304.63581
8695.0000 -63.08742 -62.07179 1.01563 1.66924 -62.05009 299.97107
8700.0000 -62.99202 -61.84053 1.15150 1.70755 -61.71390 338.29487
8705.0000 -62.79842 -61.46444 1.33398 1.72983 -61.51833 370.61767
8710.0000 -62.91337 -61.93266 0.98071 1.69893 -61.78958 316.63632
8715.0000 -63.13280 -62.12529 1.00751 1.66827 -62.05861 284.78138
8720.0000 -62.92212 -61.88823 1.03389 1.67009 -62.04261 284.43044
8725.0000 -63.02550 -61.86077 1.16473 1.68050 -61.95132 314.40348
8730.0000 -62.98277 -62.11718 0.86559 1.68432 -61.91779 312.16632
8735.0000 -62.78042 -61.78217 0.99825 1.68989 -61.86892 318.75774
8740.0000 -62.94287 -61.94956 0.99332 1.69166 -61.85338 329.71092
8745.0000 -63.10223 -62.06032 1.04190 1.67231 -62.02313 300.37166
8750.0000 -63.27214 -61.58672 1.68542 1.69535 -61.82096 325.50842
FREEZING PROCESS: loop number 36 T-loop= 303.00000000000000
main_MD> interactions number 36 at Temperature= 303.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.06659 -1.80957 -1.90559
force_rgl> df(natom) 1.62067 0.48569 -0.67220
8755.0000 -62.69973 -61.46455 1.23518 1.71886 -61.61465 352.37650
8760.0000 -63.01735 -62.24255 0.77479 1.68281 -61.93098 314.28117
8765.0000 -63.19011 -62.45482 0.73529 1.65031 -62.21623 271.00767
8770.0000 -62.57434 -61.47270 1.10164 1.68849 -61.88121 313.18293
8775.0000 -62.79256 -61.90894 0.88361 1.72075 -61.59803 346.47473
8780.0000 -62.66935 -62.02741 0.64194 1.68792 -61.88619 305.45271
8785.0000 -63.16620 -62.18309 0.98311 1.69899 -61.78902 331.02190
8790.0000 -62.91955 -62.05812 0.86144 1.65501 -62.17496 273.46281
8795.0000 -63.11107 -61.96868 1.14239 1.65993 -62.13180 292.86660
8800.0000 -63.02501 -62.14992 0.87509 1.66287 -62.10600 283.62551
8805.0000 -63.09710 -62.09982 0.99729 1.65736 -62.15436 276.42522
8810.0000 -62.98410 -62.07587 0.90823 1.65742 -62.15382 271.18259
8815.0000 -63.05371 -62.01639 1.03732 1.67381 -62.01003 296.81644
8820.0000 -63.09930 -61.71762 1.38168 1.70835 -61.70687 335.85346
8825.0000 -63.30084 -62.36094 0.93990 1.68341 -61.92575 313.94132
8830.0000 -62.79786 -61.62486 1.17301 1.66855 -62.05618 292.40324
8835.0000 -62.74446 -61.77483 0.96962 1.72037 -61.60140 344.96114
8840.0000 -62.96343 -61.71647 1.24695 1.71154 -61.67888 343.82794
8845.0000 -62.93864 -62.05022 0.88843 1.69588 -61.81634 323.80058
8850.0000 -62.89208 -62.05922 0.83286 1.67618 -61.98918 303.54448
8855.0000 -62.99465 -62.13000 0.86465 1.65994 -62.13174 267.50269
8860.0000 -63.06886 -62.21133 0.85753 1.64182 -62.29072 263.28093
8865.0000 -62.98438 -61.92403 1.06035 1.65156 -62.20524 280.09442
8870.0000 -62.75346 -61.93272 0.82074 1.69940 -61.78543 323.71652
8875.0000 -62.96938 -62.18206 0.78732 1.68254 -61.93341 306.13506
8880.0000 -63.19238 -61.82481 1.36757 1.67481 -62.00123 297.47329
8885.0000 -62.86487 -62.03843 0.82644 1.67033 -62.04050 289.74224
8890.0000 -63.08771 -61.83875 1.24896 1.66822 -62.05907 294.68724
8895.0000 -63.11632 -62.03244 1.08387 1.68601 -61.90292 323.63639
8900.0000 -63.18337 -62.25712 0.92625 1.64386 -62.27286 269.33546
8905.0000 -63.10459 -62.16404 0.94055 1.64158 -62.29288 267.29143
8910.0000 -62.93809 -61.84016 1.09793 1.66820 -62.05924 287.44765
8915.0000 -62.85365 -61.84213 1.01152 1.70068 -61.77421 332.42266
8920.0000 -63.05499 -61.93649 1.11850 1.67732 -61.97922 300.52945
8925.0000 -62.98590 -61.83133 1.15457 1.68680 -61.89602 307.36030
8930.0000 -62.85023 -61.47726 1.37296 1.70910 -61.70032 340.20671
8935.0000 -62.80564 -61.50597 1.29966 1.72554 -61.55598 365.62496
8940.0000 -62.93066 -61.82654 1.10412 1.73361 -61.48516 375.40596
8945.0000 -63.13912 -62.33740 0.80172 1.68679 -61.89608 313.55904
8950.0000 -63.21285 -62.18800 1.02485 1.64277 -62.28242 261.32358
8955.0000 -62.85922 -61.53080 1.32842 1.69086 -61.86034 326.11629
8960.0000 -62.77902 -61.72871 1.05031 1.72591 -61.55275 365.14101
8965.0000 -63.00065 -61.81230 1.18834 1.70020 -61.77839 326.68211
8970.0000 -63.02024 -61.62699 1.39325 1.71166 -61.67778 348.11716
8975.0000 -63.10203 -62.09243 1.00960 1.68748 -61.89006 313.37639
8980.0000 -63.12131 -61.99731 1.12400 1.67084 -62.03605 301.75203
8985.0000 -62.53052 -61.56829 0.96223 1.68889 -61.87765 320.64322
8990.0000 -62.81003 -61.62048 1.18955 1.72316 -61.57692 361.19620
8995.0000 -63.03146 -61.71601 1.31545 1.68255 -61.93327 303.75420
9000.0000 -62.71197 -61.55180 1.16017 1.69800 -61.79772 317.35760
main_MD> EXECUTION TIME: 0 [day], 0 [hour], 4 [min], 45.5228777 [s].
main_MD> Deallocating global variables
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