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nanoparticlesims/growth_Melting_Silver_ICO_3269/freezeSims/run_67/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_67.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 = 67 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: 67 6700
main_MD> Size of nv and nvoiz: 67 6700
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 = 67
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> 2.2983290394468142E-002 -2.1669489716356318E-002 4.0047080876039108E-002 initial drift of cluster / NP1 for coalescence
init> 0.28209416874300164 0.31145615979409119 0.30661519399111348 scaling for velocity /for coalescence NP1
init.f90 > facguy = 3.7346963606892220E-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) 1.37395 0.23233 0.55653
force_rgl> df(natom) 2.90303 -5.13450 -3.27677
preparo> THERMALIZATION PROCESS AT 1205.7011056072956
preparo> TOTAL ENERGY, KINETIC EN., POT. ENERGY, DELTA
5000 -150.69105976989755 7.7185259968294249 -158.40958576672696 6.1106867872703159E-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= 1185.0000000000000
main_MD> interactions number 1 at Temperature= 1185.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.89178 -5.77618 -3.40609
force_rgl> df(natom) 0.42921 -1.96088 -3.26388
5.0000 -157.88989 -148.23604 9.65385 2.92872 -149.33741 1114.14784
10.0000 -157.18983 -147.31519 9.87464 3.03412 -147.59859 1147.98630
15.0000 -156.88265 -145.30885 11.57380 3.10329 -146.45766 1224.17159
20.0000 -157.32018 -146.29465 11.02552 3.10141 -146.48864 1182.91852
25.0000 -157.31619 -147.52032 9.79587 3.02529 -147.74426 1163.33120
30.0000 -159.25577 -148.57959 10.67619 3.04774 -147.37395 1140.14275
35.0000 -157.54310 -147.02815 10.51494 3.00317 -148.10915 1144.39827
40.0000 -157.22490 -148.27051 8.95439 3.07999 -146.84201 1217.53390
45.0000 -157.44487 -147.08426 10.36061 3.05398 -147.27104 1140.87454
50.0000 -157.96301 -147.20550 10.75751 3.10029 -146.50706 1180.28931
55.0000 -155.85414 -146.47841 9.37573 3.06039 -147.16525 1141.14276
60.0000 -157.21172 -146.86833 10.34339 3.16382 -145.45903 1235.46953
65.0000 -155.74596 -145.33725 10.40871 3.13478 -145.93818 1234.90165
70.0000 -156.97190 -147.96800 9.00389 3.10648 -146.40490 1215.24105
75.0000 -159.33382 -148.80868 10.52513 3.00321 -148.10857 1128.49676
80.0000 -155.54221 -146.96704 8.57517 2.95962 -148.82760 1114.75882
85.0000 -156.89129 -145.75096 11.14032 3.11968 -146.18729 1189.84407
90.0000 -157.88368 -148.52408 9.35961 3.12009 -146.18040 1213.56068
95.0000 -158.44711 -146.40380 12.04331 3.05788 -147.20666 1208.51499
100.0000 -157.31296 -147.12813 10.18484 3.04352 -147.44359 1218.46274
105.0000 -156.95690 -146.86122 10.09569 3.07270 -146.96221 1164.55077
110.0000 -156.06305 -146.16262 9.90043 3.10509 -146.42790 1248.90386
115.0000 -155.55748 -145.99886 9.55862 3.08878 -146.69699 1194.91293
120.0000 -156.48049 -146.44631 10.03418 3.17572 -145.26273 1304.64895
125.0000 -157.91755 -147.66219 10.25536 3.03523 -147.58027 1166.94212
130.0000 -155.93793 -144.37352 11.56441 3.13834 -145.87944 1232.10571
135.0000 -157.11813 -146.15882 10.95932 3.17463 -145.28075 1257.69462
140.0000 -157.83862 -147.75509 10.08353 3.04115 -147.48268 1191.74010
145.0000 -158.91222 -149.53167 9.38055 2.94585 -149.05468 1096.39930
150.0000 -157.69549 -147.67395 10.02154 2.95478 -148.90746 1082.21917
155.0000 -159.02181 -148.04861 10.97320 3.03312 -147.61507 1163.79397
160.0000 -158.47102 -148.33580 10.13522 2.99819 -148.19133 1131.76495
165.0000 -157.88851 -149.43450 8.45401 3.00977 -148.00028 1165.59924
170.0000 -158.76374 -146.79671 11.96703 3.03939 -147.51169 1191.27828
175.0000 -156.82122 -147.52911 9.29210 3.01373 -147.93498 1170.20920
180.0000 -156.53396 -147.23813 9.29583 3.08045 -146.83444 1191.30289
185.0000 -159.15180 -148.03120 11.12060 3.05187 -147.30582 1191.94407
190.0000 -155.15659 -146.02440 9.13219 3.06863 -147.02932 1227.49425
195.0000 -156.42202 -144.39775 12.02426 3.17956 -145.19942 1264.71004
200.0000 -156.41559 -145.25597 11.15963 3.20501 -144.77966 1312.58419
205.0000 -155.79171 -146.47815 9.31357 3.15186 -145.65635 1251.41824
210.0000 -159.75535 -148.54695 11.20840 3.05744 -147.21388 1174.30508
215.0000 -159.43725 -151.38585 8.05139 2.85109 -150.61787 1046.89170
220.0000 -157.91844 -148.00668 9.91176 2.95877 -148.84155 1120.17978
225.0000 -158.70054 -148.28713 10.41341 3.01526 -147.90979 1160.31857
230.0000 -157.14977 -148.11217 9.03760 2.91359 -149.58686 1070.88029
235.0000 -156.39847 -145.68472 10.71375 2.99684 -148.21356 1106.50475
240.0000 -158.46800 -148.40118 10.06682 3.12617 -146.08023 1216.34923
245.0000 -158.26883 -145.06231 13.20652 3.05585 -147.24020 1200.16072
250.0000 -156.24431 -145.29882 10.94549 3.15081 -145.67369 1229.62866
FREEZING PROCESS: loop number 2 T-loop= 1160.0000000000000
main_MD> interactions number 2 at Temperature= 1160.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.36418 -2.42053 -0.08930
force_rgl> df(natom) 1.27522 2.11937 1.38947
255.0000 -156.17450 -145.14105 11.03345 3.22259 -144.48959 1275.49083
260.0000 -157.83291 -146.62484 11.20807 3.08474 -146.76353 1229.34961
265.0000 -157.61168 -146.96026 10.65142 3.06831 -147.03459 1183.45629
270.0000 -158.37452 -147.86001 10.51451 3.02743 -147.70899 1159.41169
275.0000 -159.69548 -149.66456 10.03091 3.02822 -147.69599 1164.33761
280.0000 -157.58805 -147.96740 9.62065 2.95131 -148.96475 1120.65364
285.0000 -158.01352 -148.19328 9.82024 3.04095 -147.48599 1171.24761
290.0000 -158.13461 -148.52833 9.60627 3.02582 -147.73551 1152.94608
295.0000 -160.56447 -151.54867 9.01581 2.92924 -149.32871 1108.12717
300.0000 -158.33374 -150.66958 7.66416 2.82286 -151.08361 1025.77297
305.0000 -158.20081 -147.78246 10.41836 2.92715 -149.36320 1048.61901
310.0000 -160.31177 -150.78230 9.52947 2.96856 -148.68019 1086.21354
315.0000 -160.27793 -151.50222 8.77571 2.81180 -151.26602 1021.77086
320.0000 -159.51956 -149.10267 10.41689 2.85859 -150.49422 1069.97250
325.0000 -156.76840 -146.80435 9.96404 3.00863 -148.01916 1156.34621
330.0000 -157.71359 -147.73892 9.97467 3.00791 -148.03094 1107.56472
335.0000 -158.25704 -149.56362 8.69341 3.00849 -148.02148 1142.37567
340.0000 -159.04521 -149.69965 9.34556 2.87350 -150.24824 1068.64818
345.0000 -158.31480 -150.23819 8.07661 2.91510 -149.56203 1075.63039
350.0000 -157.92577 -147.28681 10.63896 2.99578 -148.23104 1127.17470
355.0000 -158.53132 -147.70904 10.82228 2.99121 -148.30646 1128.05068
360.0000 -157.71630 -147.63547 10.08083 3.07070 -146.99516 1208.25151
365.0000 -157.60295 -149.59397 8.00898 2.94874 -149.00708 1104.55529
370.0000 -158.23593 -147.59592 10.64002 2.94598 -149.05253 1118.95210
375.0000 -156.35459 -146.81612 9.53847 2.96786 -148.69166 1110.97653
380.0000 -158.90411 -149.04049 9.86362 3.00138 -148.13879 1147.21885
385.0000 -155.49537 -146.83002 8.66535 3.01390 -147.93220 1131.54955
390.0000 -158.63042 -147.64992 10.98050 3.12535 -146.09374 1207.97583
395.0000 -157.23089 -146.63849 10.59240 3.02088 -147.81708 1157.74539
400.0000 -156.62966 -145.96587 10.66379 3.16414 -145.45380 1230.71459
405.0000 -157.35842 -146.57263 10.78579 3.09103 -146.65991 1205.96277
410.0000 -158.57805 -147.43222 11.14583 3.07166 -146.97942 1221.56025
415.0000 -154.16555 -145.35344 8.81211 3.06153 -147.14649 1151.80307
420.0000 -158.87868 -147.18493 11.69375 3.07754 -146.88238 1221.63582
425.0000 -157.66864 -148.51796 9.15069 2.93026 -149.31187 1097.58745
430.0000 -158.44330 -148.26833 10.17497 3.00896 -148.01364 1140.99521
435.0000 -158.36594 -148.09177 10.27417 3.04336 -147.44625 1152.51404
440.0000 -159.50944 -150.46022 9.04922 2.96493 -148.74007 1115.83362
445.0000 -157.39240 -148.04040 9.35200 2.91992 -149.48252 1057.26501
450.0000 -159.06131 -150.04751 9.01380 2.92888 -149.33470 1087.91603
455.0000 -155.35853 -146.30109 9.05744 3.04071 -147.48995 1140.88508
460.0000 -155.51041 -145.26225 10.24816 3.14980 -145.69042 1247.87960
465.0000 -156.93691 -146.43330 10.50361 3.14004 -145.85138 1199.24713
470.0000 -158.45618 -147.96436 10.49182 3.12112 -146.16353 1239.03465
475.0000 -156.56100 -145.37585 11.18515 3.12646 -146.07539 1267.39780
480.0000 -157.66795 -147.48365 10.18430 3.08630 -146.73794 1177.10326
485.0000 -158.59213 -148.55472 10.03741 3.03447 -147.59290 1126.13803
490.0000 -159.87809 -148.63180 11.24629 2.96331 -148.76669 1120.00481
495.0000 -157.71156 -147.21132 10.50025 3.01250 -147.95521 1168.12545
500.0000 -157.70684 -146.89929 10.80756 3.08192 -146.81009 1182.18979
FREEZING PROCESS: loop number 3 T-loop= 1135.0000000000000
main_MD> interactions number 3 at Temperature= 1135.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -9.52301 -2.90586 -2.49370
force_rgl> df(natom) 0.82442 1.35169 -5.22371
505.0000 -157.05692 -148.41082 8.64609 3.07794 -146.87577 1193.06647
510.0000 -158.87067 -149.84752 9.02315 3.01737 -147.87487 1168.78827
515.0000 -158.77597 -149.56330 9.21267 2.85200 -150.60284 1042.26399
520.0000 -154.81732 -145.46798 9.34934 3.06128 -147.15060 1142.42539
525.0000 -157.76031 -146.96692 10.79340 3.05181 -147.30683 1160.04005
530.0000 -157.32300 -147.98178 9.34122 3.02403 -147.76500 1128.75506
535.0000 -155.66622 -147.01695 8.64927 3.02286 -147.78433 1131.52473
540.0000 -157.75160 -147.05778 10.69382 3.07910 -146.85667 1157.96239
545.0000 -158.31449 -147.17576 11.13874 3.11621 -146.24445 1199.00529
550.0000 -159.14568 -148.57541 10.57027 3.00988 -147.99855 1137.14466
555.0000 -157.55143 -147.95548 9.59595 2.97895 -148.50870 1118.41297
560.0000 -158.62736 -147.86331 10.76405 2.86836 -150.33298 1037.61732
565.0000 -159.29468 -147.88027 11.41442 3.03405 -147.59981 1175.42616
570.0000 -158.94100 -148.25512 10.68588 2.99702 -148.21071 1121.96827
575.0000 -158.34449 -148.80805 9.53644 3.02754 -147.70724 1168.64969
580.0000 -159.58890 -149.91715 9.67175 2.84982 -150.63894 1035.85998
585.0000 -158.85539 -150.75155 8.10384 2.87784 -150.17661 1059.33669
590.0000 -155.59744 -146.16461 9.43282 2.95315 -148.93432 1080.24286
595.0000 -160.31499 -149.34563 10.96936 3.03272 -147.62167 1137.25469
600.0000 -159.14455 -148.20366 10.94089 2.95568 -148.89267 1113.14422
605.0000 -158.72968 -149.17197 9.55771 2.99771 -148.19931 1104.89656
610.0000 -157.02921 -148.31549 8.71372 2.95517 -148.90100 1105.66586
615.0000 -158.22262 -148.48302 9.73960 2.97988 -148.49337 1102.77085
620.0000 -154.63847 -144.40338 10.23509 3.10826 -146.37558 1217.62963
625.0000 -158.28009 -146.68911 11.59098 3.15897 -145.53901 1266.44950
630.0000 -159.71181 -149.64250 10.06931 2.99989 -148.16331 1139.02905
635.0000 -158.64166 -148.88512 9.75654 2.93176 -149.28724 1086.79400
640.0000 -156.72465 -147.99436 8.73029 3.01703 -147.88056 1157.73489
645.0000 -158.65797 -147.20291 11.45505 3.03950 -147.50980 1143.67881
650.0000 -155.47810 -146.78334 8.69476 2.98172 -148.46308 1114.95315
655.0000 -158.43766 -148.73319 9.70447 3.00360 -148.10202 1122.39858
660.0000 -157.78160 -148.24895 9.53265 3.01082 -147.98292 1120.69207
665.0000 -159.40687 -148.01426 11.39260 2.92023 -149.47743 1070.61182
670.0000 -158.01058 -147.52124 10.48934 3.00875 -148.01707 1158.49383
675.0000 -157.71591 -149.60687 8.10903 3.03371 -147.60534 1183.93317
680.0000 -158.59586 -149.53931 9.05656 2.93273 -149.27122 1080.11588
685.0000 -158.67286 -147.95041 10.72245 2.95673 -148.87526 1089.38854
690.0000 -158.80011 -149.44051 9.35960 2.99273 -148.28146 1134.08524
695.0000 -159.90754 -150.58876 9.31878 2.89262 -149.93288 1102.17393
700.0000 -158.94502 -149.14117 9.80386 2.90623 -149.70837 1064.29791
705.0000 -157.73673 -148.20614 9.53059 2.94885 -149.00526 1088.47654
710.0000 -159.46225 -148.55075 10.91150 2.95030 -148.98137 1115.13234
715.0000 -158.92053 -148.94525 9.97528 2.97951 -148.49941 1119.19519
720.0000 -157.15697 -146.46663 10.69033 3.06807 -147.03864 1169.08252
725.0000 -155.04080 -144.33630 10.70450 3.15528 -145.59998 1267.51411
730.0000 -156.54059 -145.05659 11.48400 3.27511 -143.62327 1325.04959
735.0000 -158.93662 -147.81154 11.12508 3.12368 -146.12120 1231.07128
740.0000 -158.23539 -149.37752 8.85787 2.92418 -149.41227 1071.39979
745.0000 -159.38721 -149.15104 10.23617 2.97507 -148.57273 1161.53380
750.0000 -156.13076 -148.02892 8.10184 2.97277 -148.61066 1125.14680
FREEZING PROCESS: loop number 4 T-loop= 1110.0000000000000
main_MD> interactions number 4 at Temperature= 1110.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -4.33630 2.67092 -0.75795
force_rgl> df(natom) 1.60343 1.49781 3.61602
755.0000 -159.00559 -148.32460 10.68098 2.96026 -148.81710 1138.00205
760.0000 -158.84398 -150.24728 8.59670 2.94478 -149.07234 1083.89205
765.0000 -156.33810 -147.19152 9.14658 2.91410 -149.57843 1112.87037
770.0000 -157.46415 -149.77252 7.69163 2.97974 -148.49572 1123.48337
775.0000 -158.40796 -149.01229 9.39567 2.89347 -149.91876 1093.21239
780.0000 -157.80634 -149.28331 8.52302 2.99031 -148.32135 1148.01153
785.0000 -159.73270 -149.56618 10.16652 2.93940 -149.16115 1078.15880
790.0000 -158.22398 -148.54665 9.67732 2.95387 -148.92241 1074.21208
795.0000 -159.91683 -149.93798 9.97885 2.98570 -148.39737 1091.73040
800.0000 -158.15399 -148.92635 9.22764 2.98139 -148.46845 1113.39437
805.0000 -157.56187 -146.33713 11.22474 3.05753 -147.21253 1157.71040
810.0000 -155.56266 -144.77559 10.78707 3.12644 -146.07567 1224.45681
815.0000 -154.26296 -144.14895 10.11401 3.23333 -144.31237 1249.21243
820.0000 -155.60687 -146.15422 9.45265 3.16746 -145.39896 1232.78540
825.0000 -156.32100 -145.83400 10.48699 3.14580 -145.75638 1233.58121
830.0000 -158.57643 -148.19882 10.37761 3.00271 -148.11670 1099.24145
835.0000 -157.11152 -149.00947 8.10206 2.94291 -149.10328 1112.39412
840.0000 -157.85221 -149.84736 8.00485 2.98128 -148.47030 1122.18850
845.0000 -158.06998 -148.15242 9.91756 2.97745 -148.53348 1091.03821
850.0000 -158.88655 -147.06345 11.82310 3.07047 -146.99892 1173.60504
855.0000 -160.42309 -149.95511 10.46798 2.94757 -149.02642 1083.19770
860.0000 -159.34271 -148.34979 10.99292 2.93474 -149.23804 1130.25520
865.0000 -157.78336 -147.80672 9.97664 3.05639 -147.23122 1153.61809
870.0000 -157.96418 -149.46646 8.49772 2.93085 -149.30213 1096.07427
875.0000 -158.51699 -149.21343 9.30356 2.89289 -149.92833 1065.21358
880.0000 -158.34404 -149.53721 8.80683 2.92693 -149.36681 1088.25204
885.0000 -162.39988 -152.08321 10.31666 2.84715 -150.68284 1026.21793
890.0000 -158.39365 -149.54451 8.84915 2.80772 -151.33330 1009.21140
895.0000 -159.02490 -149.07632 9.94858 2.97151 -148.63142 1120.60361
900.0000 -160.21627 -149.90661 10.30966 2.86699 -150.35559 1058.66363
905.0000 -158.12520 -149.38259 8.74260 2.96859 -148.67965 1112.71242
910.0000 -158.63539 -150.19421 8.44119 2.91723 -149.52685 1059.17992
915.0000 -158.47762 -149.65968 8.81794 2.87519 -150.22044 1033.75733
920.0000 -156.10984 -146.40720 9.70264 3.01681 -147.88418 1155.85122
925.0000 -157.99597 -146.72271 11.27326 3.10325 -146.45820 1182.27410
930.0000 -156.00957 -145.10904 10.90053 3.11623 -146.24408 1205.49041
935.0000 -160.60292 -151.12348 9.47943 3.04967 -147.34213 1188.65196
940.0000 -158.43189 -146.75662 11.67527 2.98249 -148.45038 1161.44546
945.0000 -156.59864 -147.09130 9.50734 3.09649 -146.56979 1228.84770
950.0000 -158.54470 -147.68111 10.86360 3.01180 -147.96688 1165.45545
955.0000 -158.30865 -149.24157 9.06708 3.06707 -147.05508 1161.44208
960.0000 -160.09134 -150.57771 9.51364 2.91440 -149.57358 1056.95387
965.0000 -158.13145 -149.37181 8.75964 2.96045 -148.81385 1157.16103
970.0000 -159.45575 -148.88729 10.56846 2.95516 -148.90121 1119.13301
975.0000 -154.83654 -146.83640 8.00014 3.04305 -147.45130 1205.43744
980.0000 -158.01305 -146.97323 11.03982 3.10718 -146.39343 1218.50567
985.0000 -155.42030 -144.13395 11.28635 3.13083 -146.00323 1232.22663
990.0000 -160.17104 -148.83672 11.33432 3.03542 -147.57720 1167.69452
995.0000 -159.27226 -149.67324 9.59902 2.93511 -149.23185 1096.04179
1000.0000 -159.50132 -148.75343 10.74789 2.94610 -149.05059 1090.16817
FREEZING PROCESS: loop number 5 T-loop= 1085.0000000000000
main_MD> interactions number 5 at Temperature= 1085.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.42297 0.40259 -1.61255
force_rgl> df(natom) 1.11589 4.05346 3.39011
1005.0000 -160.42433 -150.97426 9.45007 2.85605 -150.53604 1007.96147
1010.0000 -158.72094 -150.99774 7.72320 2.84245 -150.76040 1039.89540
1015.0000 -159.40109 -149.24665 10.15443 2.91809 -149.51273 1087.06401
1020.0000 -158.79464 -148.06494 10.72970 2.92468 -149.40400 1122.19506
1025.0000 -158.09930 -148.43164 9.66765 3.01901 -147.84785 1127.61348
1030.0000 -159.04575 -149.68007 9.36568 2.89147 -149.95187 1056.69183
1035.0000 -155.78729 -146.92534 8.86195 3.02637 -147.72653 1147.92240
1040.0000 -160.01204 -149.13392 10.87812 2.99391 -148.26199 1142.46344
1045.0000 -158.65916 -148.11637 10.54278 2.95657 -148.87794 1134.54147
1050.0000 -156.14247 -145.74688 10.39559 3.04995 -147.33744 1164.66805
1055.0000 -158.28664 -148.46858 9.81806 3.04314 -147.44985 1159.70915
1060.0000 -157.44344 -146.87933 10.56411 3.03389 -147.60239 1117.25165
1065.0000 -156.97786 -147.81268 9.16518 2.99044 -148.31914 1104.59814
1070.0000 -160.59268 -152.04203 8.55065 2.89708 -149.85919 1081.33925
1075.0000 -157.38218 -149.75741 7.62477 2.82700 -151.01535 1005.16888
1080.0000 -158.45982 -150.27656 8.18326 2.97263 -148.61292 1094.46391
1085.0000 -158.14164 -149.12822 9.01342 2.90610 -149.71054 1050.91474
1090.0000 -158.23000 -150.37199 7.85801 2.92642 -149.37530 1068.61080
1095.0000 -158.23113 -149.87968 8.35145 2.94784 -149.02191 1107.14916
1100.0000 -159.46035 -148.67870 10.78165 2.87972 -150.14559 1064.03628
1105.0000 -156.17782 -148.51608 7.66173 2.97132 -148.63458 1114.90230
1110.0000 -157.43598 -148.04086 9.39511 2.97998 -148.49167 1105.89605
1115.0000 -155.58525 -145.82323 9.76202 3.08027 -146.83738 1197.80532
1120.0000 -159.67856 -150.27585 9.40271 2.95713 -148.86871 1088.21814
1125.0000 -158.47152 -150.31769 8.15383 2.84798 -150.66918 1030.30864
1130.0000 -160.68761 -152.12671 8.56090 2.77944 -151.79996 986.25696
1135.0000 -157.24350 -147.89283 9.35067 2.89935 -149.82185 1096.91937
1140.0000 -158.05755 -148.63225 9.42529 2.99863 -148.18401 1103.48052
1145.0000 -159.68834 -150.95624 8.73210 2.88385 -150.07747 1045.70738
1150.0000 -162.14597 -152.45612 9.68986 2.76637 -152.01542 993.92017
1155.0000 -158.69977 -151.80316 6.89661 2.72907 -152.63084 932.34404
1160.0000 -158.98202 -149.66474 9.31728 2.86190 -150.43968 1039.44598
1165.0000 -159.26655 -148.63872 10.62783 2.93073 -149.30412 1069.04848
1170.0000 -158.71248 -147.98842 10.72406 2.97855 -148.51527 1113.61107
1175.0000 -158.85512 -148.71885 10.13627 2.93937 -149.16168 1122.34827
1180.0000 -158.89609 -148.04470 10.85139 2.99064 -148.31580 1142.52594
1185.0000 -158.96387 -146.77975 12.18411 3.11477 -146.26829 1230.23746
1190.0000 -157.67811 -149.22373 8.45438 3.01587 -147.89972 1097.93381
1195.0000 -156.35290 -146.63745 9.71545 2.98170 -148.46341 1059.03806
1200.0000 -158.87149 -148.57877 10.29272 2.97060 -148.64651 1105.74678
1205.0000 -159.91598 -150.91147 9.00451 2.89721 -149.85705 1058.41550
1210.0000 -159.60131 -151.72983 7.87148 2.81901 -151.14717 1019.42116
1215.0000 -158.52618 -150.86633 7.65986 2.82065 -151.12007 1030.70095
1220.0000 -160.36052 -152.26832 8.09220 2.81412 -151.22775 979.50397
1225.0000 -157.95032 -147.89665 10.05367 2.88911 -149.99069 1031.06785
1230.0000 -156.71051 -146.85806 9.85245 3.01524 -147.91013 1127.94519
1235.0000 -160.12606 -150.79087 9.33519 2.96231 -148.78315 1097.26738
1240.0000 -161.40187 -152.30162 9.10026 2.78704 -151.67448 1004.30285
1245.0000 -157.84254 -149.18571 8.65683 2.83476 -150.88724 1045.28245
1250.0000 -158.54183 -150.78944 7.75239 2.89150 -149.95124 1068.50197
FREEZING PROCESS: loop number 6 T-loop= 1060.0000000000000
main_MD> interactions number 6 at Temperature= 1060.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -3.37098 2.47851 -0.86599
force_rgl> df(natom) -3.73120 1.86932 0.04732
1255.0000 -158.73613 -147.72147 11.01466 2.96253 -148.77951 1077.32598
1260.0000 -158.51278 -150.20380 8.30898 2.92223 -149.44437 1091.01957
1265.0000 -159.04864 -147.58933 11.45931 3.01516 -147.91132 1130.19578
1270.0000 -157.26145 -146.77403 10.48742 3.02985 -147.66914 1182.47866
1275.0000 -157.06300 -147.58540 9.47760 3.06264 -147.12821 1184.72228
1280.0000 -157.41641 -149.29417 8.12224 2.95006 -148.98527 1083.11856
1285.0000 -161.57460 -152.59940 8.97521 2.84912 -150.65041 1038.43550
1290.0000 -161.15484 -151.32143 9.83341 2.77526 -151.86888 1000.09785
1295.0000 -158.07526 -149.24180 8.83345 2.85365 -150.57576 1039.23723
1300.0000 -160.65942 -150.77696 9.88246 2.85917 -150.48457 1048.47356
1305.0000 -158.46606 -148.52131 9.94475 2.92676 -149.36963 1083.79450
1310.0000 -159.56841 -149.58189 9.98653 2.97450 -148.58206 1131.32696
1315.0000 -158.19236 -149.81867 8.37369 2.92830 -149.34431 1086.63612
1320.0000 -158.96485 -150.29188 8.67297 2.89248 -149.93509 1069.81220
1325.0000 -159.66070 -148.85262 10.80808 2.90803 -149.67856 1061.84630
1330.0000 -156.84043 -147.76460 9.07583 2.98107 -148.47371 1090.11690
1335.0000 -159.79175 -150.30331 9.48845 2.90265 -149.76740 1082.81918
1340.0000 -160.57923 -150.84254 9.73669 2.84856 -150.65970 1057.44208
1345.0000 -160.54156 -152.06312 8.47844 2.76057 -152.11119 1023.23514
1350.0000 -160.01966 -151.46475 8.55491 2.77034 -151.94997 1009.40659
1355.0000 -159.46712 -149.48531 9.98180 2.78264 -151.74703 989.07057
1360.0000 -159.01623 -148.80611 10.21012 2.91007 -149.64496 1090.97983
1365.0000 -160.40624 -151.24516 9.16109 2.94721 -149.03232 1095.18158
1370.0000 -159.55129 -150.92620 8.62510 2.80197 -151.42818 1004.23838
1375.0000 -158.27480 -150.00190 8.27290 2.89238 -149.93680 1036.05989
1380.0000 -159.67433 -149.68271 9.99162 2.90779 -149.68262 1045.49176
1385.0000 -159.68346 -150.87701 8.80645 2.84808 -150.66764 1083.30107
1390.0000 -159.93539 -150.35022 9.58517 2.86842 -150.33202 1062.01787
1395.0000 -158.75278 -150.62662 8.12616 2.93915 -149.16521 1088.23982
1400.0000 -161.02291 -149.55907 11.46384 2.86360 -150.41151 1062.10936
1405.0000 -160.38229 -151.93764 8.44465 2.79471 -151.54798 1013.43907
1410.0000 -161.28933 -152.98412 8.30520 2.74909 -152.30059 984.24265
1415.0000 -159.26315 -150.41071 8.85243 2.80733 -151.33986 997.87881
1420.0000 -157.69438 -150.28468 7.40970 2.86743 -150.34830 1021.80699
1425.0000 -159.35035 -150.09065 9.25971 2.88711 -150.02380 1038.36869
1430.0000 -159.00604 -150.81618 8.18986 2.84905 -150.65164 1024.27390
1435.0000 -159.42697 -150.14580 9.28117 2.80851 -151.32028 1011.27310
1440.0000 -160.08727 -151.26213 8.82514 2.86116 -150.45177 1046.53511
1445.0000 -159.70046 -152.60992 7.09054 2.71452 -152.87087 960.22203
1450.0000 -158.79846 -147.70727 11.09119 2.91841 -149.50745 1085.39850
1455.0000 -159.12859 -149.42176 9.70683 2.94950 -148.99461 1111.28808
1460.0000 -158.94571 -150.32145 8.62426 2.90869 -149.66773 1047.78844
1465.0000 -158.84884 -149.10783 9.74100 2.96485 -148.74128 1131.72983
1470.0000 -158.83082 -149.16760 9.66322 2.95009 -148.98476 1092.39567
1475.0000 -158.60787 -149.14441 9.46346 2.99046 -148.31878 1133.11752
1480.0000 -159.36519 -150.13958 9.22561 2.92278 -149.43534 1079.17508
1485.0000 -160.01691 -150.26036 9.75655 2.83889 -150.81922 1069.73868
1490.0000 -159.31994 -150.69683 8.62310 2.92444 -149.40788 1074.66919
1495.0000 -159.72742 -148.97145 10.75597 2.93373 -149.25465 1093.25042
1500.0000 -160.46650 -150.95898 9.50752 2.85488 -150.55538 1032.99272
FREEZING PROCESS: loop number 7 T-loop= 1035.0000000000000
main_MD> interactions number 7 at Temperature= 1035.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.99192 -4.13159 -1.47349
force_rgl> df(natom) -1.77336 0.21538 4.07532
1505.0000 -159.47893 -150.29510 9.18383 2.80094 -151.44513 1027.56435
1510.0000 -158.67067 -150.08345 8.58722 2.90294 -149.76253 1071.54610
1515.0000 -160.19029 -150.62670 9.56359 2.89239 -149.93656 1063.35281
1520.0000 -162.12297 -153.58298 8.53998 2.80423 -151.39090 995.98081
1525.0000 -160.84070 -152.30868 8.53202 2.70100 -153.09383 945.19991
1530.0000 -159.56328 -152.97344 6.58984 2.76447 -152.04681 937.42892
1535.0000 -162.70701 -153.01111 9.69590 2.73519 -152.52978 978.99054
1540.0000 -159.27238 -150.98360 8.28878 2.76664 -152.01106 978.30059
1545.0000 -159.77744 -150.44147 9.33598 2.79842 -151.48678 971.25996
1550.0000 -157.05629 -150.16280 6.89349 2.90498 -149.72899 1091.99924
1555.0000 -160.16339 -152.93769 7.22571 2.83323 -150.91254 974.74277
1560.0000 -160.53974 -151.78651 8.75323 2.80951 -151.30377 1005.14855
1565.0000 -161.56809 -152.59529 8.97280 2.78236 -151.75163 972.00657
1570.0000 -161.28996 -152.22130 9.06866 2.73436 -152.54352 958.69682
1575.0000 -158.46582 -152.01248 6.45334 2.76986 -151.95787 962.47008
1580.0000 -161.19641 -151.29933 9.89708 2.75943 -152.12999 972.34172
1585.0000 -161.00389 -153.12268 7.88121 2.76764 -151.99459 968.03311
1590.0000 -158.41187 -150.02366 8.38822 2.78071 -151.77887 1030.74789
1595.0000 -161.37563 -152.53337 8.84226 2.79917 -151.47436 978.05860
1600.0000 -158.65280 -151.50739 7.14541 2.79599 -151.52690 1014.74254
1605.0000 -159.93008 -150.35033 9.57974 2.79919 -151.47402 1009.81547
1610.0000 -158.78219 -148.49445 10.28774 2.93016 -149.31357 1084.87057
1615.0000 -159.68362 -149.95586 9.72776 2.96863 -148.67891 1086.37914
1620.0000 -162.09914 -154.29629 7.80285 2.79379 -151.56315 990.70880
1625.0000 -158.84957 -149.51561 9.33397 2.77917 -151.80438 991.17853
1630.0000 -160.57927 -152.88575 7.69352 2.85552 -150.54484 1025.19706
1635.0000 -159.03435 -150.53582 8.49854 2.79322 -151.57250 979.96916
1640.0000 -159.11979 -150.10666 9.01313 2.84291 -150.75289 1019.93056
1645.0000 -159.34245 -150.85066 8.49179 2.90409 -149.74370 1062.97780
1650.0000 -158.24785 -148.60626 9.64159 2.90331 -149.75645 1064.09245
1655.0000 -159.74572 -149.94533 9.80039 2.93460 -149.24039 1098.19904
1660.0000 -159.73344 -148.99048 10.74296 2.88254 -150.09912 1067.13299
1665.0000 -156.96409 -146.81105 10.15304 2.97443 -148.58333 1118.28137
1670.0000 -158.79571 -149.13399 9.66172 2.99435 -148.25466 1135.28546
1675.0000 -160.69204 -152.11896 8.57308 2.77511 -151.87123 996.85601
1680.0000 -160.30217 -151.90341 8.39876 2.82066 -151.11983 986.04828
1685.0000 -158.31745 -150.88778 7.42967 2.80071 -151.44900 966.92318
1690.0000 -159.83116 -150.88165 8.94951 2.84600 -150.70186 1046.90103
1695.0000 -158.82462 -149.13233 9.69228 2.91240 -149.60654 1064.84192
1700.0000 -157.27336 -145.94353 11.32983 2.96445 -148.74796 1114.10573
1705.0000 -158.28203 -148.45871 9.82332 3.02736 -147.71014 1156.58768
1710.0000 -156.39560 -147.27672 9.11889 3.00053 -148.15280 1108.15822
1715.0000 -157.35977 -147.86271 9.49706 3.01307 -147.94580 1120.06062
1720.0000 -158.16233 -148.62259 9.53975 2.94739 -149.02938 1082.82476
1725.0000 -158.95909 -149.22969 9.72941 2.90027 -149.80665 1066.39629
1730.0000 -157.43307 -148.61320 8.81987 2.92287 -149.43385 1039.52472
1735.0000 -158.96539 -149.45891 9.50649 2.90838 -149.67293 1057.91792
1740.0000 -157.61843 -147.60519 10.01324 2.96278 -148.77546 1088.18317
1745.0000 -158.20537 -149.87772 8.32766 2.94384 -149.08789 1095.44789
1750.0000 -159.63890 -150.09905 9.53986 2.83918 -150.81439 1008.16862
FREEZING PROCESS: loop number 8 T-loop= 1010.0000000000000
main_MD> interactions number 8 at Temperature= 1010.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -3.51479 0.42546 -0.76094
force_rgl> df(natom) 3.84964 3.05802 3.91402
1755.0000 -158.98961 -150.87015 8.11946 2.83859 -150.82407 1033.02982
1760.0000 -159.00588 -150.70818 8.29770 2.85829 -150.49922 1024.94189
1765.0000 -161.23347 -151.89203 9.34143 2.78838 -151.65246 1036.38739
1770.0000 -160.31058 -153.23843 7.07214 2.71200 -152.91245 966.54821
1775.0000 -158.62053 -150.28909 8.33144 2.83910 -150.81570 975.89650
1780.0000 -158.10015 -148.90143 9.19871 2.94045 -149.14376 1069.95853
1785.0000 -157.66261 -148.18045 9.48216 2.96422 -148.75172 1088.67269
1790.0000 -159.57419 -150.16948 9.40471 2.93026 -149.31191 1104.23232
1795.0000 -158.54986 -149.23005 9.31982 2.96703 -148.70544 1118.98553
1800.0000 -159.47790 -151.19110 8.28680 2.83041 -150.95911 1022.95146
1805.0000 -160.14493 -151.84478 8.30015 2.80188 -151.42975 1021.48049
1810.0000 -161.40676 -152.45285 8.95391 2.67507 -153.52155 902.52831
1815.0000 -160.97355 -152.34603 8.62752 2.80511 -151.37648 1016.95098
1820.0000 -162.79006 -155.01080 7.77927 2.69308 -153.22441 933.48259
1825.0000 -161.70732 -151.49493 10.21240 2.70910 -152.96018 925.41081
1830.0000 -158.13755 -148.68402 9.45353 2.85669 -150.52557 1054.61945
1835.0000 -159.14415 -150.50824 8.63591 2.94805 -149.01843 1095.65437
1840.0000 -160.78033 -152.18098 8.59935 2.84535 -150.71263 1049.63764
1845.0000 -158.37902 -151.24436 7.13466 2.77000 -151.95567 959.71101
1850.0000 -157.04199 -149.09097 7.95102 2.85450 -150.56162 1057.55197
1855.0000 -159.47533 -149.77764 9.69769 2.92691 -149.36711 1118.79287
1860.0000 -159.57161 -150.55423 9.01738 2.86001 -150.47086 1041.36679
1865.0000 -161.46983 -151.82815 9.64168 2.81064 -151.28518 1012.45765
1870.0000 -159.58863 -151.17982 8.40881 2.81774 -151.16802 1009.37688
1875.0000 -159.19239 -151.64813 7.54426 2.81175 -151.26685 1027.54619
1880.0000 -157.23412 -150.59504 6.63908 2.82589 -151.03369 1021.22828
1885.0000 -159.12986 -151.61075 7.51910 2.82170 -151.10281 987.49411
1890.0000 -160.16140 -150.17866 9.98274 2.83100 -150.94935 992.57116
1895.0000 -159.69875 -151.70060 7.99815 2.83627 -150.86247 1036.11330
1900.0000 -158.86355 -150.76593 8.09763 2.81049 -151.28767 1000.67673
1905.0000 -161.77460 -153.36758 8.40702 2.76478 -152.04169 995.74413
1910.0000 -158.28283 -149.21358 9.06925 2.88326 -150.08727 1074.62886
1915.0000 -159.12654 -150.85629 8.27025 2.88508 -150.05714 1078.12275
1920.0000 -158.85220 -149.40772 9.44448 2.85905 -150.48669 1071.53962
1925.0000 -159.43999 -150.97317 8.46682 2.95572 -148.89197 1099.17199
1930.0000 -161.33080 -152.56254 8.76826 2.79577 -151.53045 993.00120
1935.0000 -159.13891 -150.35883 8.78008 2.86632 -150.36670 1054.78808
1940.0000 -158.27313 -149.54261 8.73053 2.89318 -149.92359 1056.99866
1945.0000 -158.20329 -147.78252 10.42077 2.93028 -149.31153 1063.99962
1950.0000 -157.67599 -148.55569 9.12030 2.99152 -148.30132 1080.51239
1955.0000 -159.00724 -150.03949 8.96775 2.93526 -149.22947 1132.58438
1960.0000 -158.34979 -149.11804 9.23175 2.85896 -150.48814 1029.18140
1965.0000 -160.22076 -152.66040 7.56035 2.84920 -150.64918 1032.99512
1970.0000 -158.69957 -151.06883 7.63075 2.78318 -151.73820 969.65498
1975.0000 -160.28065 -151.73964 8.54101 2.76831 -151.98345 954.72369
1980.0000 -161.10070 -152.33135 8.76935 2.78828 -151.65404 1007.18224
1985.0000 -159.24749 -152.10410 7.14339 2.76549 -152.03007 958.07589
1990.0000 -161.47274 -150.75143 10.72131 2.88170 -150.11294 1057.14112
1995.0000 -158.70215 -148.79724 9.90491 2.84393 -150.73607 1038.30610
2000.0000 -159.60465 -151.10180 8.50285 2.86859 -150.32917 1038.94377
FREEZING PROCESS: loop number 9 T-loop= 985.00000000000000
main_MD> interactions number 9 at Temperature= 985.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.16158 1.93864 -1.31460
force_rgl> df(natom) 0.31646 2.85936 0.82337
2005.0000 -161.05073 -152.55329 8.49744 2.75430 -152.21454 986.96653
2010.0000 -162.03101 -154.12860 7.90240 2.65736 -153.81375 914.83966
2015.0000 -159.67655 -151.35060 8.32595 2.79523 -151.53938 991.79050
2020.0000 -159.34894 -150.62002 8.72891 2.84332 -150.74603 1005.07272
2025.0000 -158.22521 -149.16123 9.06398 2.92923 -149.32886 1076.29763
2030.0000 -161.52094 -152.81710 8.70384 2.83071 -150.95418 1018.71378
2035.0000 -159.55517 -150.85739 8.69778 2.77440 -151.88295 963.41454
2040.0000 -160.87970 -152.00701 8.87269 2.79814 -151.49134 1014.87953
2045.0000 -160.42339 -151.45572 8.96767 2.75967 -152.12600 974.86892
2050.0000 -160.27579 -153.16461 7.11118 2.78234 -151.75201 1006.48016
2055.0000 -161.96929 -152.31516 9.65413 2.73013 -152.61335 923.62020
2060.0000 -159.00996 -151.08582 7.92414 2.84403 -150.73440 1034.46944
2065.0000 -160.63616 -150.81205 9.82411 2.87779 -150.17749 1046.97704
2070.0000 -159.50122 -150.90473 8.59649 2.82839 -150.99242 1037.37265
2075.0000 -159.23667 -149.63791 9.59876 2.87658 -150.19746 1005.34634
2080.0000 -159.40412 -151.60474 7.79937 2.83882 -150.82039 1028.87846
2085.0000 -160.85641 -151.38518 9.47123 2.81247 -151.25498 989.39505
2090.0000 -161.05426 -153.40826 7.64601 2.77103 -151.93862 983.81617
2095.0000 -162.92612 -155.11311 7.81301 2.62796 -154.29867 865.24384
2100.0000 -161.25382 -154.14198 7.11184 2.65561 -153.84257 916.85518
2105.0000 -161.97603 -153.51167 8.46436 2.71697 -152.83047 940.93123
2110.0000 -161.44173 -153.70881 7.73292 2.65956 -153.77741 924.47480
2115.0000 -160.11003 -152.87654 7.23349 2.70526 -153.02358 929.76959
2120.0000 -161.85772 -152.49562 9.36210 2.75762 -152.15985 991.72753
2125.0000 -161.60097 -153.40265 8.19832 2.73971 -152.45531 973.38409
2130.0000 -160.31358 -152.26649 8.04709 2.74669 -152.34009 977.85768
2135.0000 -159.82046 -151.91893 7.90153 2.73449 -152.54136 936.99077
2140.0000 -161.57181 -153.01968 8.55213 2.75623 -152.18273 957.94813
2145.0000 -159.50537 -151.81194 7.69343 2.75836 -152.14762 950.74011
2150.0000 -161.47093 -153.56087 7.91005 2.70730 -152.98993 941.00455
2155.0000 -161.43282 -151.91221 9.52061 2.70344 -153.05362 960.97120
2160.0000 -158.58561 -151.35482 7.23079 2.80977 -151.29959 1009.36984
2165.0000 -159.77722 -149.59786 10.17937 2.87496 -150.22419 1045.48852
2170.0000 -159.29225 -150.12952 9.16273 2.89700 -149.86051 1083.21507
2175.0000 -158.32097 -150.07673 8.24424 2.88720 -150.02230 1046.97113
2180.0000 -158.58949 -150.39631 8.19317 2.85709 -150.51892 1046.24010
2185.0000 -160.58736 -151.32356 9.26379 2.85297 -150.58697 1048.43705
2190.0000 -160.99608 -153.32735 7.66872 2.72672 -152.66954 954.16091
2195.0000 -160.87142 -152.14535 8.72607 2.71659 -152.83674 944.55181
2200.0000 -157.68815 -149.78493 7.90323 2.84668 -150.69071 1041.37791
2205.0000 -158.98672 -148.94400 10.04272 2.97655 -148.54827 1109.82477
2210.0000 -158.41185 -149.85711 8.55474 2.94214 -149.11590 1106.40310
2215.0000 -159.11541 -152.34777 6.76764 2.86931 -150.31742 1036.73265
2220.0000 -161.33573 -153.44073 7.89500 2.69475 -153.19694 930.65634
2225.0000 -162.09723 -154.84793 7.24930 2.61165 -154.56769 875.91139
2230.0000 -161.79348 -153.22382 8.56966 2.63051 -154.25663 886.79103
2235.0000 -161.77199 -155.21026 6.56173 2.66069 -153.75880 888.34842
2240.0000 -160.71709 -153.02081 7.69628 2.64842 -153.96114 903.53807
2245.0000 -158.72805 -151.38897 7.33909 2.74222 -152.41381 980.89399
2250.0000 -161.59776 -152.65589 8.94187 2.71085 -152.93141 943.03121
FREEZING PROCESS: loop number 10 T-loop= 960.00000000000000
main_MD> interactions number 10 at Temperature= 960.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.61140 2.09977 -2.23327
force_rgl> df(natom) 4.70082 -3.97821 -1.24142
2255.0000 -162.29202 -154.14964 8.14238 2.66464 -153.69370 890.03085
2260.0000 -158.96978 -152.00238 6.96740 2.71857 -152.80400 969.17508
2265.0000 -160.72183 -153.01069 7.71115 2.80862 -151.31852 1013.72420
2270.0000 -160.43323 -152.66044 7.77280 2.74230 -152.41260 974.16948
2275.0000 -161.64852 -151.93920 9.70932 2.67160 -153.57877 924.40492
2280.0000 -162.22520 -154.80816 7.41705 2.65568 -153.84147 930.01847
2285.0000 -160.23148 -152.40795 7.82353 2.65470 -153.85758 926.89468
2290.0000 -159.83363 -152.10600 7.72762 2.76226 -152.08323 963.72374
2295.0000 -160.73639 -152.89468 7.84172 2.71810 -152.81175 948.09416
2300.0000 -160.97914 -152.90342 8.07572 2.75638 -152.18026 937.98983
2305.0000 -162.30465 -155.61974 6.68491 2.63445 -154.19167 872.46563
2310.0000 -160.63085 -152.94882 7.68203 2.66126 -153.74943 899.72819
2315.0000 -160.45994 -151.58694 8.87300 2.76658 -152.01196 965.11432
2320.0000 -158.86469 -150.31901 8.54567 2.82091 -151.11582 1021.72516
2325.0000 -160.23260 -153.77213 6.46047 2.76604 -152.02091 965.51850
2330.0000 -161.08805 -153.00533 8.08272 2.65994 -153.77123 888.06468
2335.0000 -161.41034 -153.20556 8.20478 2.62649 -154.32294 863.69244
2340.0000 -161.39384 -153.92085 7.47299 2.67571 -153.51109 884.94821
2345.0000 -161.15205 -151.43215 9.71990 2.77650 -151.84838 974.47185
2350.0000 -160.63959 -151.86703 8.77256 2.70791 -152.97983 943.48459
2355.0000 -159.34778 -149.87222 9.47555 2.78935 -151.63643 969.35913
2360.0000 -160.22033 -152.49210 7.72823 2.78471 -151.71286 989.34530
2365.0000 -161.57536 -153.87811 7.69725 2.68423 -153.37052 910.76168
2370.0000 -162.65244 -155.90027 6.75217 2.64506 -154.01665 870.96613
2375.0000 -162.46420 -154.60848 7.85572 2.57619 -155.15278 836.98415
2380.0000 -162.58745 -155.27708 7.31038 2.59536 -154.83654 860.28854
2385.0000 -159.49069 -151.41387 8.07682 2.67329 -153.55100 925.17435
2390.0000 -159.18869 -151.60869 7.58000 2.78742 -151.66830 947.59252
2395.0000 -160.85593 -151.67547 9.18046 2.79860 -151.48377 969.04110
2400.0000 -159.65530 -149.95246 9.70285 2.83118 -150.94644 1032.75112
2405.0000 -159.56700 -151.40997 8.15703 2.78488 -151.71018 986.58466
2410.0000 -160.30547 -152.56699 7.73848 2.75984 -152.12315 974.08186
2415.0000 -160.96711 -151.45235 9.51476 2.77233 -151.91709 997.77898
2420.0000 -161.25717 -153.77961 7.47755 2.69023 -153.27148 964.43729
2425.0000 -161.57491 -153.34292 8.23199 2.64446 -154.02656 888.37900
2430.0000 -162.01986 -153.90764 8.11223 2.64590 -154.00279 915.33216
2435.0000 -160.96321 -153.27854 7.68467 2.61712 -154.47758 867.98951
2440.0000 -158.69263 -149.25094 9.44169 2.77486 -151.87550 925.07161
2445.0000 -158.97418 -150.49576 8.47842 2.83092 -150.95070 1009.94658
2450.0000 -160.05216 -152.92983 7.12233 2.72645 -152.67402 954.76619
2455.0000 -159.36835 -151.96323 7.40512 2.76904 -151.97144 989.65853
2460.0000 -160.04079 -152.17818 7.86261 2.71937 -152.79085 945.26445
2465.0000 -160.79822 -152.85629 7.94193 2.80004 -151.46004 990.45682
2470.0000 -160.55762 -153.02246 7.53515 2.74520 -152.36468 971.41361
2475.0000 -162.14375 -154.37138 7.77238 2.62565 -154.33688 884.16182
2480.0000 -162.41897 -154.83629 7.58268 2.61523 -154.50875 889.75812
2485.0000 -160.59859 -151.86091 8.73768 2.69158 -153.24923 919.08585
2490.0000 -161.51817 -153.68003 7.83814 2.72117 -152.76106 961.59229
2495.0000 -162.55893 -154.58188 7.97705 2.61741 -154.47279 883.91598
2500.0000 -161.77219 -153.51997 8.25222 2.60099 -154.74362 887.70004
FREEZING PROCESS: loop number 11 T-loop= 935.00000000000000
main_MD> interactions number 11 at Temperature= 935.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.79693 -1.74417 -0.51428
force_rgl> df(natom) 0.47648 -8.81289 -2.81640
2505.0000 -161.86910 -153.78021 8.08889 2.65970 -153.77512 875.42072
2510.0000 -163.16374 -155.49921 7.66454 2.58369 -155.02901 841.36909
2515.0000 -161.75110 -153.75607 7.99503 2.60171 -154.73178 853.11679
2520.0000 -160.84892 -150.95651 9.89241 2.70589 -153.01323 935.12706
2525.0000 -161.12354 -151.89465 9.22889 2.82762 -151.00509 1017.39035
2530.0000 -160.48816 -153.36137 7.12679 2.75622 -152.18285 972.27857
2535.0000 -160.71982 -153.28423 7.43560 2.70148 -153.08590 951.50212
2540.0000 -161.75102 -153.70411 8.04691 2.63441 -154.19229 893.82614
2545.0000 -161.87078 -153.01716 8.85362 2.66468 -153.69295 937.32831
2550.0000 -161.53675 -152.60897 8.92778 2.72501 -152.69776 977.69535
2555.0000 -161.49709 -155.45567 6.04142 2.62652 -154.32243 899.40990
2560.0000 -160.67577 -152.99513 7.68065 2.63840 -154.12644 894.98794
2565.0000 -161.46945 -153.46441 8.00504 2.68338 -153.38447 901.04538
2570.0000 -160.18046 -151.85601 8.32444 2.69910 -153.12522 915.63497
2575.0000 -159.53670 -150.38254 9.15417 2.84810 -150.66725 1047.05831
2580.0000 -158.81211 -150.99766 7.81445 2.80963 -151.30186 997.91934
2585.0000 -159.40666 -151.75176 7.65490 2.80981 -151.29892 988.57319
2590.0000 -159.54805 -150.94662 8.60143 2.78526 -151.70383 987.71023
2595.0000 -158.21148 -149.94781 8.26367 2.89656 -149.86783 1040.76855
2600.0000 -160.10362 -150.55155 9.55207 2.85905 -150.48659 1014.08003
2605.0000 -160.83589 -152.96938 7.86652 2.74132 -152.42874 950.66508
2610.0000 -160.59711 -152.46991 8.12720 2.69176 -153.24633 945.13866
2615.0000 -161.23531 -153.40105 7.83426 2.72863 -152.63801 922.14099
2620.0000 -160.20920 -152.86278 7.34642 2.66530 -153.68273 891.40250
2625.0000 -161.98644 -153.97512 8.01132 2.76595 -152.02243 966.88631
2630.0000 -162.29324 -153.12026 9.17298 2.65466 -153.85827 916.69342
2635.0000 -160.66451 -153.17083 7.49368 2.72561 -152.68795 951.39092
2640.0000 -162.30010 -153.71922 8.58088 2.68638 -153.33505 935.42999
2645.0000 -160.74631 -154.02170 6.72461 2.62374 -154.36828 868.90699
2650.0000 -162.01104 -153.86086 8.15018 2.69356 -153.21663 902.37295
2655.0000 -162.12839 -154.02648 8.10192 2.63796 -154.13376 900.35311
2660.0000 -160.28066 -152.00263 8.27803 2.68475 -153.36193 939.10265
2665.0000 -161.22721 -153.39613 7.83108 2.70297 -153.06131 922.16073
2670.0000 -160.42843 -152.73644 7.69199 2.72193 -152.74857 930.80080
2675.0000 -160.64414 -150.72762 9.91651 2.79200 -151.59275 992.58538
2680.0000 -161.62920 -153.03675 8.59245 2.71752 -152.82130 946.54502
2685.0000 -159.40789 -151.65945 7.74844 2.67802 -153.47299 892.71969
2690.0000 -159.35312 -150.99499 8.35813 2.81105 -151.27840 976.99004
2695.0000 -160.77161 -150.96689 9.80472 2.81189 -151.26458 996.03237
2700.0000 -160.35158 -153.49049 6.86109 2.77489 -151.87497 982.87402
2705.0000 -161.34651 -152.91466 8.43184 2.76322 -152.06745 955.50174
2710.0000 -160.50183 -153.37889 7.12294 2.73235 -152.57669 907.06191
2715.0000 -160.21013 -152.96867 7.24146 2.72398 -152.71469 927.34566
2720.0000 -160.89608 -151.42546 9.47062 2.74420 -152.38126 972.33827
2725.0000 -161.84030 -153.56482 8.27547 2.72104 -152.76328 924.99407
2730.0000 -161.27752 -153.15808 8.11944 2.68879 -153.29526 911.07098
2735.0000 -159.84175 -150.73066 9.11109 2.74474 -152.37225 932.05606
2740.0000 -163.05235 -154.24320 8.80915 2.74349 -152.39295 969.30825
2745.0000 -161.91406 -153.08783 8.82623 2.63844 -154.12578 913.67520
2750.0000 -160.18676 -152.08743 8.09933 2.71888 -152.79896 941.29454
FREEZING PROCESS: loop number 12 T-loop= 910.00000000000000
main_MD> interactions number 12 at Temperature= 910.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.05125 -5.79396 -0.65946
force_rgl> df(natom) -2.84058 3.26920 4.61481
2755.0000 -161.42195 -153.37157 8.05038 2.72757 -152.65550 943.20467
2760.0000 -162.26228 -154.02686 8.23543 2.66784 -153.64078 917.09351
2765.0000 -161.64534 -152.89299 8.75235 2.68964 -153.28129 939.41781
2770.0000 -161.36670 -152.73032 8.63638 2.73218 -152.57957 954.19735
2775.0000 -159.54214 -152.15105 7.39109 2.75620 -152.18329 958.81842
2780.0000 -161.30602 -152.24856 9.05746 2.72455 -152.70537 946.78575
2785.0000 -161.19409 -153.66015 7.53395 2.73300 -152.56600 931.93414
2790.0000 -161.11665 -152.47109 8.64556 2.67735 -153.48390 913.57459
2795.0000 -160.71789 -152.43588 8.28201 2.71426 -152.87511 943.92589
2800.0000 -161.51608 -154.56419 6.95188 2.66633 -153.66578 878.36979
2805.0000 -162.24995 -155.26095 6.98899 2.56122 -155.39963 860.59929
2810.0000 -160.52411 -152.90559 7.61852 2.68539 -153.35129 933.53523
2815.0000 -161.57388 -154.20828 7.36561 2.66967 -153.61072 928.19014
2820.0000 -161.73654 -153.21939 8.51715 2.65966 -153.77582 908.69376
2825.0000 -162.15545 -153.32624 8.82921 2.63846 -154.12555 926.51192
2830.0000 -161.90988 -154.13393 7.77595 2.62486 -154.34979 884.68839
2835.0000 -162.04532 -154.54521 7.50010 2.63097 -154.24898 913.25617
2840.0000 -162.10202 -154.64726 7.45476 2.60934 -154.60590 870.90215
2845.0000 -160.67127 -153.28373 7.38754 2.64383 -154.03690 865.66684
2850.0000 -160.33757 -153.90792 6.42966 2.67379 -153.54277 902.84216
2855.0000 -161.49002 -152.84513 8.64489 2.66590 -153.67288 920.73273
2860.0000 -159.84030 -151.79013 8.05018 2.79357 -151.56672 1002.84560
2865.0000 -160.47987 -152.11964 8.36023 2.79443 -151.55264 1004.24390
2870.0000 -162.00916 -154.94010 7.06907 2.63494 -154.18358 889.52602
2875.0000 -161.45276 -154.43713 7.01563 2.63445 -154.19166 872.11151
2880.0000 -161.89258 -153.89316 7.99942 2.62450 -154.35573 890.18581
2885.0000 -162.03154 -153.77454 8.25700 2.65071 -153.92347 913.13586
2890.0000 -161.20002 -153.26803 7.93199 2.70584 -153.01405 934.06442
2895.0000 -162.30466 -154.35931 7.94535 2.67966 -153.44589 914.71223
2900.0000 -163.08644 -155.20868 7.87776 2.58530 -155.00245 850.71659
2905.0000 -160.21655 -151.78276 8.43379 2.68119 -153.42068 899.77772
2910.0000 -162.41912 -154.57856 7.84055 2.72203 -152.74699 967.97600
2915.0000 -163.70238 -154.32310 9.37928 2.60346 -154.70293 879.58230
2920.0000 -161.21779 -154.84916 6.36863 2.62367 -154.36945 869.06073
2925.0000 -162.23354 -154.33592 7.89763 2.61613 -154.49393 882.95077
2930.0000 -161.20375 -152.04032 9.16342 2.68124 -153.41988 896.29975
2935.0000 -160.69256 -152.06028 8.63228 2.74593 -152.35273 961.19049
2940.0000 -161.86568 -152.84361 9.02206 2.73415 -152.54700 971.83250
2945.0000 -162.27213 -154.06285 8.20928 2.65193 -153.90330 924.04526
2950.0000 -161.33788 -153.29199 8.04589 2.61836 -154.45710 876.61243
2955.0000 -161.55117 -154.19976 7.35141 2.63302 -154.21532 898.52552
2960.0000 -161.85755 -154.65161 7.20594 2.58199 -155.05702 839.67334
2965.0000 -162.17636 -155.03567 7.14069 2.57869 -155.11146 867.94600
2970.0000 -160.29727 -151.98709 8.31019 2.72548 -152.68994 932.11239
2975.0000 -162.28441 -153.93060 8.35380 2.70221 -153.07388 957.03058
2980.0000 -163.59452 -154.78159 8.81292 2.59640 -154.81927 845.54661
2985.0000 -161.65316 -154.35058 7.30259 2.63808 -154.13176 894.83726
2990.0000 -161.50295 -153.43690 8.06605 2.65390 -153.87075 881.05931
2995.0000 -161.97247 -152.96199 9.01048 2.70708 -152.99362 934.14198
3000.0000 -161.46456 -153.30958 8.15498 2.72065 -152.76965 963.69860
FREEZING PROCESS: loop number 13 T-loop= 885.00000000000000
main_MD> interactions number 13 at Temperature= 885.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.25242 2.44894 -0.04070
force_rgl> df(natom) -2.99078 -0.18123 0.46523
3005.0000 -160.40364 -152.41711 7.98653 2.70255 -153.06834 910.75677
3010.0000 -161.26215 -153.37254 7.88961 2.70627 -153.00692 924.51076
3015.0000 -160.49270 -152.97457 7.51813 2.69905 -153.12598 905.77233
3020.0000 -161.36603 -154.05422 7.31182 2.70275 -153.06503 934.82670
3025.0000 -162.60597 -155.58769 7.01828 2.61755 -154.47052 853.21501
3030.0000 -162.00898 -153.98903 8.01995 2.55526 -155.49792 819.75376
3035.0000 -160.99096 -154.61239 6.37857 2.62718 -154.31151 874.81799
3040.0000 -160.58068 -154.00465 6.57603 2.63210 -154.23042 891.84210
3045.0000 -161.15526 -154.20797 6.94728 2.62106 -154.41257 887.62164
3050.0000 -162.95575 -155.30511 7.65064 2.54313 -155.69807 840.73473
3055.0000 -162.61304 -154.84713 7.76591 2.59822 -154.78937 850.17574
3060.0000 -162.78323 -154.94152 7.84172 2.60379 -154.69735 880.55652
3065.0000 -163.76924 -156.45040 7.31884 2.56356 -155.36112 826.34462
3070.0000 -163.08455 -155.70207 7.38249 2.51224 -156.20764 839.84263
3075.0000 -162.81334 -155.30386 7.50949 2.60705 -154.64365 858.91586
3080.0000 -160.00344 -153.18151 6.82192 2.58384 -155.02645 820.48525
3085.0000 -161.25108 -152.86145 8.38963 2.70772 -152.98299 923.16156
3090.0000 -163.54942 -154.99899 8.55043 2.65989 -153.77206 909.15876
3095.0000 -160.69432 -152.45741 8.23691 2.65293 -153.88683 910.34319
3100.0000 -161.48051 -153.79638 7.68413 2.72051 -152.77203 930.66462
3105.0000 -162.76948 -155.43472 7.33475 2.60181 -154.73006 854.43213
3110.0000 -161.95338 -155.94522 6.00816 2.56847 -155.28004 819.49757
3115.0000 -162.42597 -155.78110 6.64488 2.59402 -154.85862 862.50590
3120.0000 -161.77239 -154.96877 6.80361 2.57282 -155.20828 834.74581
3125.0000 -161.48691 -154.32132 7.16559 2.59671 -154.81415 867.90657
3130.0000 -163.11331 -156.74085 6.37246 2.54841 -155.61106 820.35020
3135.0000 -160.95728 -153.79183 7.16544 2.61116 -154.57590 869.06809
3140.0000 -160.78185 -152.84122 7.94063 2.67914 -153.45448 932.84537
3145.0000 -162.23060 -153.65323 8.57737 2.70706 -152.99386 924.76569
3150.0000 -162.83785 -155.24503 7.59282 2.62308 -154.37924 898.10886
3155.0000 -161.09240 -154.69662 6.39578 2.63679 -154.15302 894.64794
3160.0000 -160.55155 -153.66254 6.88901 2.64977 -153.93889 902.35310
3165.0000 -162.55819 -155.23405 7.32414 2.64212 -154.06518 888.69977
3170.0000 -161.47490 -153.94790 7.52700 2.60401 -154.69387 850.44139
3175.0000 -161.26441 -154.50924 6.75517 2.61447 -154.52127 889.85075
3180.0000 -161.98182 -154.77694 7.20488 2.61957 -154.43716 853.27288
3185.0000 -161.85867 -152.91923 8.93944 2.61217 -154.55916 840.62550
3190.0000 -161.33676 -154.69313 6.64363 2.65530 -153.84770 900.56647
3195.0000 -162.20648 -154.11489 8.09160 2.62567 -154.33653 895.16636
3200.0000 -161.70078 -154.15793 7.54285 2.60160 -154.73363 874.85630
3205.0000 -161.72979 -153.76657 7.96322 2.66907 -153.62058 928.14006
3210.0000 -161.38311 -155.60225 5.78086 2.61004 -154.59434 847.33745
3215.0000 -161.49080 -153.65531 7.83549 2.59804 -154.79223 845.57926
3220.0000 -160.92092 -153.59957 7.32135 2.68456 -153.36497 914.70822
3225.0000 -161.07772 -152.62417 8.45355 2.69958 -153.11727 925.70234
3230.0000 -159.79709 -152.03163 7.76546 2.74841 -152.31182 920.21579
3235.0000 -162.17211 -153.70948 8.46263 2.65660 -153.82630 857.24230
3240.0000 -161.02796 -153.39911 7.62886 2.67567 -153.51170 891.07619
3245.0000 -161.54248 -154.67404 6.86844 2.65505 -153.85185 865.81286
3250.0000 -162.83953 -155.36144 7.47808 2.62806 -154.29715 866.53106
FREEZING PROCESS: loop number 14 T-loop= 860.00000000000000
main_MD> interactions number 14 at Temperature= 860.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -2.91008 2.30229 -3.39153
force_rgl> df(natom) 4.41410 2.74132 -0.61512
3255.0000 -163.04561 -155.32843 7.71718 2.57410 -155.18716 841.46548
3260.0000 -162.43807 -154.49482 7.94325 2.55523 -155.49851 860.14065
3265.0000 -162.16168 -154.39290 7.76878 2.62528 -154.34297 875.13863
3270.0000 -161.05690 -152.80981 8.24709 2.61643 -154.48894 884.34123
3275.0000 -160.63530 -151.64106 8.99424 2.73736 -152.49410 941.01028
3280.0000 -160.96296 -153.28412 7.67884 2.72220 -152.74417 950.35860
3285.0000 -161.99806 -153.84690 8.15117 2.64848 -153.96015 897.37266
3290.0000 -161.62581 -154.98759 6.63822 2.56258 -155.37717 831.24197
3295.0000 -160.63285 -154.75693 5.87592 2.62831 -154.29296 915.96297
3300.0000 -162.66612 -155.60713 7.05900 2.57903 -155.10594 804.68008
3305.0000 -162.07259 -154.92562 7.14696 2.50869 -156.26627 790.38280
3310.0000 -162.04280 -155.07652 6.96628 2.60026 -154.75560 894.84512
3315.0000 -162.66631 -155.54625 7.12006 2.58295 -155.04127 836.27308
3320.0000 -165.61623 -158.42004 7.19619 2.49793 -156.44365 802.02977
3325.0000 -163.67826 -156.52494 7.15332 2.43878 -157.41948 795.24326
3330.0000 -161.38203 -153.62523 7.75680 2.62117 -154.41069 884.23737
3335.0000 -161.60808 -153.23109 8.37699 2.65507 -153.85149 896.39861
3340.0000 -160.62026 -153.21496 7.40530 2.68398 -153.37461 925.20964
3345.0000 -161.86885 -153.62266 8.24619 2.68179 -153.41067 920.21500
3350.0000 -160.85107 -152.49446 8.35661 2.69961 -153.11684 949.86149
3355.0000 -160.66167 -153.22576 7.43591 2.65433 -153.86372 914.31323
3360.0000 -162.21075 -154.73128 7.47947 2.64852 -153.95952 889.93230
3365.0000 -160.64619 -152.67345 7.97274 2.64792 -153.96939 894.88223
3370.0000 -161.57084 -153.84052 7.73033 2.68842 -153.30138 923.47595
3375.0000 -163.60779 -157.62307 5.98473 2.54686 -155.63649 824.76343
3380.0000 -163.14965 -155.73120 7.41845 2.43175 -157.53550 737.75028
3385.0000 -161.87607 -155.49557 6.38051 2.54683 -155.63709 819.68839
3390.0000 -162.24179 -155.81608 6.42570 2.57423 -155.18501 845.58457
3395.0000 -162.86811 -157.16506 5.70305 2.51052 -156.23603 804.97989
3400.0000 -163.55600 -156.28080 7.27520 2.49770 -156.44752 804.83129
3405.0000 -162.30504 -155.15904 7.14600 2.58342 -155.03338 843.21446
3410.0000 -160.81609 -154.99611 5.81998 2.62652 -154.32243 905.73184
3415.0000 -161.80143 -154.02980 7.77163 2.63270 -154.22053 860.46523
3420.0000 -162.10908 -154.52057 7.58851 2.66703 -153.65427 913.59371
3425.0000 -162.60011 -155.01119 7.58892 2.61120 -154.57518 887.67083
3430.0000 -163.18677 -156.05288 7.13389 2.54922 -155.59755 859.30998
3435.0000 -163.30721 -154.80850 8.49871 2.55527 -155.49788 820.91647
3440.0000 -161.51258 -152.87431 8.63827 2.63413 -154.19688 902.73970
3445.0000 -164.30360 -155.82135 8.48224 2.53154 -155.88933 825.01931
3450.0000 -161.18122 -153.88079 7.30043 2.63378 -154.20271 872.35607
3455.0000 -163.82135 -156.28121 7.54014 2.58615 -154.98840 862.62213
3460.0000 -163.16841 -156.19405 6.97436 2.52398 -156.01400 817.66137
3465.0000 -164.17416 -156.93421 7.23995 2.53312 -155.86327 819.14863
3470.0000 -164.73737 -156.62448 8.11289 2.50273 -156.36450 832.18197
3475.0000 -163.69594 -155.44305 8.25288 2.51439 -156.17219 823.89313
3480.0000 -163.65507 -155.71792 7.93715 2.54856 -155.60847 868.34724
3485.0000 -162.47900 -155.23232 7.24669 2.61799 -154.46316 883.30685
3490.0000 -162.56146 -156.12829 6.43318 2.57772 -155.12742 845.19769
3495.0000 -163.47258 -156.02364 7.44893 2.52620 -155.97730 784.45638
3500.0000 -163.09839 -155.97915 7.11924 2.54386 -155.68605 816.20062
FREEZING PROCESS: loop number 15 T-loop= 835.00000000000000
main_MD> interactions number 15 at Temperature= 835.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.36111 1.12906 -0.84293
force_rgl> df(natom) -3.80949 -0.70540 -2.96452
3505.0000 -162.55375 -156.27775 6.27600 2.53702 -155.79895 803.54127
3510.0000 -163.82318 -155.74865 8.07454 2.52776 -155.95160 813.27178
3515.0000 -162.53186 -157.11264 5.41921 2.56498 -155.33767 834.10110
3520.0000 -162.97162 -156.06861 6.90301 2.52471 -156.00189 819.52003
3525.0000 -161.54853 -154.88120 6.66734 2.57421 -155.18542 829.11271
3530.0000 -161.51854 -153.91665 7.60188 2.66359 -153.71092 901.56394
3535.0000 -161.29995 -153.36837 7.93159 2.66975 -153.60936 916.39207
3540.0000 -161.40744 -154.09893 7.30851 2.63729 -154.14489 904.32692
3545.0000 -162.35605 -154.12796 8.22808 2.62360 -154.37065 852.27444
3550.0000 -163.67864 -156.41583 7.26280 2.58352 -155.03177 866.84228
3555.0000 -161.97717 -155.72426 6.25291 2.51840 -156.10602 818.38294
3560.0000 -163.05270 -156.82676 6.22594 2.53389 -155.85057 823.39583
3565.0000 -163.37893 -156.32364 7.05529 2.49585 -156.47804 785.16662
3570.0000 -162.90374 -155.60985 7.29388 2.54803 -155.61734 838.06937
3575.0000 -163.97446 -156.77715 7.19731 2.50084 -156.39578 803.95979
3580.0000 -164.21656 -157.93908 6.27748 2.43957 -157.40646 757.32414
3585.0000 -163.87018 -156.34822 7.52196 2.45288 -157.18690 775.64487
3590.0000 -162.92639 -156.23220 6.69419 2.52033 -156.07416 841.61641
3595.0000 -161.92500 -154.67085 7.25415 2.59416 -154.85630 853.19553
3600.0000 -161.96537 -154.70240 7.26297 2.59639 -154.81956 852.31188
3605.0000 -161.81833 -155.25184 6.56650 2.56240 -155.38013 847.65883
3610.0000 -161.27444 -153.66360 7.61084 2.57568 -155.16120 816.49856
3615.0000 -161.25759 -154.52342 6.73417 2.66346 -153.71312 912.09648
3620.0000 -162.98253 -154.49211 8.49042 2.65116 -153.91599 903.44934
3625.0000 -161.75666 -154.66845 7.08821 2.61441 -154.52232 882.07391
3630.0000 -162.56137 -155.47479 7.08658 2.54614 -155.64836 822.31508
3635.0000 -162.44657 -155.50328 6.94329 2.54531 -155.66216 815.43270
3640.0000 -162.91883 -155.02917 7.88966 2.59335 -154.86961 864.33019
3645.0000 -162.75466 -155.35187 7.40279 2.56401 -155.35373 856.78851
3650.0000 -162.92968 -155.92894 7.00074 2.55773 -155.45730 861.96327
3655.0000 -164.06500 -157.36321 6.70179 2.46228 -157.03178 767.61260
3660.0000 -162.61337 -156.77216 5.84122 2.51540 -156.15550 774.90849
3665.0000 -161.97768 -154.97882 6.99886 2.54905 -155.60042 810.99758
3670.0000 -161.98453 -153.82173 8.16280 2.63147 -154.24074 893.97323
3675.0000 -162.48575 -157.78201 4.70374 2.54823 -155.61398 839.76992
3680.0000 -164.16553 -157.22580 6.93974 2.48617 -156.63775 800.99747
3685.0000 -162.31161 -155.17829 7.13332 2.49959 -156.41634 800.12100
3690.0000 -163.94960 -155.82048 8.12912 2.55846 -155.44524 818.42273
3695.0000 -163.77825 -156.53468 7.24357 2.50379 -156.34712 808.83341
3700.0000 -162.95089 -156.56705 6.38384 2.50675 -156.29823 809.99691
3705.0000 -162.60497 -156.47962 6.12534 2.49422 -156.50493 772.12171
3710.0000 -162.35601 -155.32323 7.03278 2.61849 -154.45500 858.59893
3715.0000 -160.98230 -153.23786 7.74444 2.58156 -155.06421 865.60477
3720.0000 -162.15500 -154.82905 7.32595 2.62190 -154.39865 879.11406
3725.0000 -162.80977 -154.94263 7.86714 2.58646 -154.98325 839.02220
3730.0000 -161.02881 -153.38222 7.64658 2.62524 -154.34352 854.36146
3735.0000 -162.57150 -155.21887 7.35263 2.56820 -155.28450 845.10007
3740.0000 -162.93964 -155.51337 7.42627 2.59133 -154.90299 849.53741
3745.0000 -161.71144 -153.81352 7.89792 2.64757 -153.97518 898.23208
3750.0000 -162.45405 -155.22773 7.22632 2.62953 -154.27289 893.63160
FREEZING PROCESS: loop number 16 T-loop= 810.00000000000000
main_MD> interactions number 16 at Temperature= 810.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.17344 -0.90930 -0.24692
force_rgl> df(natom) 0.16786 0.73270 1.03646
3755.0000 -163.43036 -156.47056 6.95980 2.52984 -155.91725 813.93003
3760.0000 -161.48046 -154.79081 6.68965 2.57715 -155.13696 850.08630
3765.0000 -161.27660 -154.26282 7.01378 2.68221 -153.40384 941.95539
3770.0000 -161.55006 -153.31432 8.23574 2.64941 -153.94489 861.84949
3775.0000 -161.90634 -154.92061 6.98574 2.65556 -153.84347 893.67542
3780.0000 -161.34248 -155.50651 5.83597 2.58740 -154.96779 850.32722
3785.0000 -163.51765 -156.28516 7.23249 2.56001 -155.41968 831.13603
3790.0000 -163.10431 -156.64189 6.46242 2.52151 -156.05472 805.16618
3795.0000 -164.52411 -158.28586 6.23825 2.39808 -158.09088 704.19998
3800.0000 -162.54618 -156.08438 6.46180 2.47607 -156.80426 776.18768
3805.0000 -164.29963 -157.13279 7.16684 2.52895 -155.93193 840.48980
3810.0000 -163.14752 -156.79068 6.35685 2.45619 -157.13218 773.68333
3815.0000 -162.26066 -156.01644 6.24422 2.48861 -156.59750 756.91325
3820.0000 -162.67121 -155.00935 7.66187 2.59652 -154.81733 838.72879
3825.0000 -162.05499 -155.04667 7.00833 2.58042 -155.08288 856.00024
3830.0000 -162.70041 -154.92616 7.77424 2.54054 -155.74073 823.11795
3835.0000 -163.55522 -157.81931 5.73591 2.53097 -155.89870 815.13753
3840.0000 -162.59578 -154.97106 7.62472 2.47484 -156.82466 753.80535
3845.0000 -162.54225 -155.69974 6.84251 2.60012 -154.75800 861.76923
3850.0000 -162.02068 -155.35837 6.66231 2.61792 -154.46434 862.45573
3855.0000 -163.14541 -156.40800 6.73741 2.51513 -156.15999 804.62633
3860.0000 -163.19915 -156.05720 7.14195 2.54591 -155.65218 833.89408
3865.0000 -163.77050 -156.25473 7.51577 2.53448 -155.84082 819.73521
3870.0000 -163.38400 -156.85654 6.52746 2.46560 -156.97697 772.01604
3875.0000 -163.68821 -155.81992 7.86829 2.52306 -156.02925 835.70695
3880.0000 -161.69397 -153.20115 8.49282 2.61473 -154.51694 874.45562
3885.0000 -162.01753 -156.07925 5.93827 2.59101 -154.90829 877.86276
3890.0000 -163.57841 -156.84472 6.73369 2.50188 -156.37852 805.02264
3895.0000 -164.14633 -157.24864 6.89769 2.45209 -157.19995 759.94841
3900.0000 -164.26111 -157.44217 6.81894 2.42918 -157.57781 743.44476
3905.0000 -163.93976 -156.36125 7.57852 2.45755 -157.10988 790.28673
3910.0000 -164.09285 -157.99083 6.10202 2.49494 -156.49304 816.76616
3915.0000 -165.35904 -158.68063 6.67841 2.39400 -158.15809 758.56047
3920.0000 -164.78125 -158.26105 6.52020 2.38461 -158.31314 712.07373
3925.0000 -164.30583 -156.96971 7.33613 2.43418 -157.49533 743.57496
3930.0000 -163.21581 -155.60229 7.61352 2.50809 -156.27606 822.72385
3935.0000 -162.66209 -155.92288 6.73921 2.50440 -156.33693 788.93867
3940.0000 -163.89586 -156.58515 7.31072 2.54955 -155.59224 844.91761
3945.0000 -163.57989 -156.98556 6.59433 2.44124 -157.37892 759.44056
3950.0000 -164.29974 -157.05323 7.24652 2.44001 -157.39923 772.08420
3955.0000 -162.01006 -154.56962 7.44045 2.53326 -155.86085 805.24998
3960.0000 -162.99126 -156.31273 6.67853 2.53140 -155.89157 802.72495
3965.0000 -163.68371 -157.43824 6.24547 2.49687 -156.46120 790.72153
3970.0000 -164.32380 -157.90401 6.41978 2.42196 -157.69694 745.53219
3975.0000 -164.35907 -158.69860 5.66048 2.37147 -158.52982 735.83947
3980.0000 -165.13151 -157.52012 7.61139 2.41224 -157.85729 763.78887
3985.0000 -162.26731 -155.96789 6.29942 2.47871 -156.76071 798.24878
3990.0000 -162.63558 -156.28604 6.34954 2.52823 -155.94384 802.75729
3995.0000 -161.52981 -154.54642 6.98339 2.59433 -154.85346 861.19734
4000.0000 -163.31014 -156.64550 6.66465 2.53964 -155.75569 809.42904
FREEZING PROCESS: loop number 17 T-loop= 785.00000000000000
main_MD> interactions number 17 at Temperature= 785.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.05960 2.43099 0.53172
force_rgl> df(natom) 0.00551 -1.29687 0.41823
4005.0000 -161.34037 -155.00438 6.33599 2.51148 -156.22017 837.49661
4010.0000 -163.17705 -155.92078 7.25627 2.56102 -155.40299 829.28999
4015.0000 -162.28934 -155.28447 7.00487 2.52479 -156.00062 793.08662
4020.0000 -162.19552 -153.89345 8.30207 2.62162 -154.40339 852.66021
4025.0000 -163.60727 -157.52725 6.08002 2.58679 -154.97785 866.91235
4030.0000 -163.47655 -155.92669 7.54986 2.44722 -157.28025 766.62064
4035.0000 -163.59480 -156.66762 6.92718 2.46377 -157.00722 764.88243
4040.0000 -162.88641 -155.55388 7.33253 2.53303 -155.86473 817.95906
4045.0000 -164.30953 -157.66260 6.64692 2.51280 -156.19837 839.78578
4050.0000 -164.58693 -157.34279 7.24414 2.46277 -157.02379 776.58435
4055.0000 -163.08188 -156.54901 6.53287 2.49175 -156.54566 802.34311
4060.0000 -162.91392 -156.70724 6.20668 2.52417 -156.01082 803.42607
4065.0000 -163.54012 -157.29933 6.24079 2.46111 -157.05108 748.80027
4070.0000 -163.48816 -156.63315 6.85501 2.49593 -156.47669 802.68362
4075.0000 -162.70071 -156.27043 6.43028 2.52018 -156.07667 828.67611
4080.0000 -161.71906 -154.52402 7.19504 2.54820 -155.61451 808.68624
4085.0000 -162.91362 -156.59334 6.32028 2.54904 -155.60053 821.96923
4090.0000 -164.12641 -157.14776 6.97866 2.48888 -156.59300 794.15219
4095.0000 -162.27977 -155.65895 6.62082 2.47653 -156.79678 761.19391
4100.0000 -161.48402 -154.33761 7.14641 2.60738 -154.63813 878.20660
4105.0000 -161.88188 -153.30216 8.57972 2.66771 -153.64298 938.08073
4110.0000 -164.30582 -157.21671 7.08911 2.54161 -155.72313 821.48346
4115.0000 -164.28008 -157.75581 6.52427 2.46087 -157.05500 782.64992
4120.0000 -163.48782 -156.75418 6.73364 2.44527 -157.31240 747.50274
4125.0000 -162.76986 -155.57812 7.19174 2.49193 -156.54261 791.61883
4130.0000 -165.49712 -157.58994 7.90718 2.45132 -157.21259 765.05732
4135.0000 -164.40488 -158.04352 6.36136 2.44215 -157.36386 793.24922
4140.0000 -162.20418 -156.04726 6.15692 2.45675 -157.12305 786.73317
4145.0000 -163.66193 -157.41012 6.25180 2.48521 -156.65350 766.48064
4150.0000 -164.04519 -157.80967 6.23553 2.42961 -157.57067 728.97898
4155.0000 -165.25875 -159.12493 6.13382 2.40272 -158.01430 725.93526
4160.0000 -164.59331 -158.82266 5.77065 2.34184 -159.01864 673.12126
4165.0000 -162.67022 -154.93529 7.73493 2.47109 -156.88642 778.21911
4170.0000 -163.49210 -156.57222 6.91988 2.54570 -155.65573 857.80514
4175.0000 -164.17625 -156.68870 7.48755 2.49201 -156.54138 801.73570
4180.0000 -164.60481 -157.92101 6.68381 2.47765 -156.77826 794.11541
4185.0000 -163.33760 -156.09184 7.24576 2.48447 -156.66581 807.91517
4190.0000 -164.21913 -157.51737 6.70176 2.48334 -156.68433 798.72435
4195.0000 -161.50967 -154.88795 6.62171 2.52998 -155.91496 830.02263
4200.0000 -162.26378 -154.34168 7.92209 2.59943 -154.76939 870.11709
4205.0000 -162.89841 -155.73897 7.15943 2.58918 -154.93842 851.87681
4210.0000 -163.99452 -157.24889 6.74563 2.54414 -155.68141 825.20575
4215.0000 -165.33286 -157.65403 7.67883 2.41284 -157.84744 727.25152
4220.0000 -164.36385 -157.73756 6.62629 2.42930 -157.57586 744.22029
4225.0000 -164.28546 -157.07764 7.20782 2.44484 -157.31948 754.78241
4230.0000 -164.28112 -158.39844 5.88268 2.46375 -157.00749 772.84901
4235.0000 -163.76425 -155.98426 7.77999 2.45675 -157.12305 782.10247
4240.0000 -163.30244 -156.70972 6.59272 2.53473 -155.83661 833.68670
4245.0000 -163.27950 -156.07735 7.20215 2.52397 -156.01423 800.20490
4250.0000 -163.71685 -156.63563 7.08123 2.52256 -156.03749 803.29661
FREEZING PROCESS: loop number 18 T-loop= 760.00000000000000
main_MD> interactions number 18 at Temperature= 760.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.27032 0.26527 -1.87932
force_rgl> df(natom) -1.96848 0.81415 1.88274
4255.0000 -165.02096 -157.26269 7.75826 2.44723 -157.28002 772.13780
4260.0000 -164.74048 -158.10734 6.63315 2.42832 -157.59196 771.40733
4265.0000 -164.93594 -157.23513 7.70081 2.43327 -157.51034 789.17883
4270.0000 -163.41514 -157.37562 6.03952 2.45527 -157.14739 767.89832
4275.0000 -163.87648 -156.53808 7.33840 2.46410 -157.00178 755.53908
4280.0000 -163.96235 -156.77326 7.18909 2.51296 -156.19573 799.48268
4285.0000 -163.49989 -156.20949 7.29040 2.48227 -156.70196 793.78953
4290.0000 -163.42918 -157.49734 5.93183 2.45376 -157.17230 773.94384
4295.0000 -164.31492 -157.55456 6.76036 2.47231 -156.86629 799.92462
4300.0000 -164.52087 -158.18184 6.33903 2.43310 -157.51323 786.19771
4305.0000 -163.91591 -157.43730 6.47862 2.44115 -157.38044 765.39914
4310.0000 -163.56502 -157.36501 6.20002 2.47376 -156.84245 778.37013
4315.0000 -164.72319 -157.52462 7.19856 2.44754 -157.27502 784.80064
4320.0000 -164.17653 -157.92758 6.24894 2.45653 -157.12666 774.58344
4325.0000 -162.64249 -156.52177 6.12073 2.45163 -157.20748 743.46797
4330.0000 -162.87258 -155.28531 7.58727 2.52216 -156.04404 801.34047
4335.0000 -162.32331 -155.80645 6.51686 2.55902 -155.43592 831.61641
4340.0000 -164.05989 -157.37232 6.68757 2.46571 -156.97524 766.72622
4345.0000 -163.63896 -156.58676 7.05220 2.50337 -156.35400 772.10789
4350.0000 -164.80245 -157.42525 7.37720 2.46487 -156.98908 775.68835
4355.0000 -164.98803 -157.49234 7.49569 2.50829 -156.27279 804.81737
4360.0000 -163.83710 -156.93587 6.90123 2.40422 -157.98963 719.38017
4365.0000 -163.31168 -157.48159 5.83009 2.45193 -157.20246 744.22381
4370.0000 -164.24483 -157.67561 6.56922 2.45414 -157.16615 777.89493
4375.0000 -162.83417 -156.35943 6.47474 2.42410 -157.66169 749.20197
4380.0000 -162.88358 -156.06299 6.82059 2.52836 -155.94181 809.05816
4385.0000 -165.59990 -158.34864 7.25126 2.44696 -157.28453 770.97695
4390.0000 -164.56211 -158.91139 5.65072 2.37408 -158.48676 720.95129
4395.0000 -163.54191 -157.48176 6.06016 2.40486 -157.97893 721.36075
4400.0000 -164.65780 -159.23449 5.42331 2.35955 -158.72647 709.35090
4405.0000 -164.55928 -158.70929 5.84999 2.32652 -159.27134 688.64605
4410.0000 -164.75893 -157.71234 7.04660 2.36034 -158.71349 732.69248
4415.0000 -164.59793 -159.31024 5.28769 2.36447 -158.64524 705.46833
4420.0000 -164.61060 -157.87290 6.73769 2.36022 -158.71539 702.49388
4425.0000 -163.76617 -156.59029 7.17589 2.48122 -156.71935 780.12879
4430.0000 -163.77298 -155.94166 7.83132 2.52814 -155.94532 808.32224
4435.0000 -163.09859 -156.46940 6.62919 2.48221 -156.70300 780.35023
4440.0000 -164.37975 -156.95291 7.42685 2.46900 -156.92098 772.26528
4445.0000 -162.89955 -156.52972 6.36983 2.46376 -157.00731 770.88692
4450.0000 -165.16545 -158.41183 6.75362 2.43538 -157.47562 767.43083
4455.0000 -164.37404 -159.78714 4.58690 2.34741 -158.92675 703.17599
4460.0000 -164.81366 -158.41056 6.40309 2.32501 -159.29626 688.74715
4465.0000 -163.55902 -158.59456 4.96446 2.36483 -158.63935 725.08771
4470.0000 -163.42297 -159.06062 4.36235 2.36658 -158.61056 703.94068
4475.0000 -163.71778 -157.04682 6.67096 2.41055 -157.88516 768.78316
4480.0000 -164.69742 -158.44239 6.25503 2.45379 -157.17177 755.32469
4485.0000 -166.62610 -160.22578 6.40032 2.33706 -159.09749 708.93514
4490.0000 -164.87831 -157.89480 6.98351 2.35693 -158.76975 717.30036
4495.0000 -164.61151 -158.69877 5.91274 2.37929 -158.40089 720.51902
4500.0000 -163.92586 -158.39953 5.52633 2.36803 -158.58657 727.21545
FREEZING PROCESS: loop number 19 T-loop= 735.00000000000000
main_MD> interactions number 19 at Temperature= 735.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.92609 1.32550 -0.92253
force_rgl> df(natom) -0.55424 0.84330 -2.27920
4505.0000 -164.64318 -156.35722 8.28596 2.43363 -157.50446 737.25913
4510.0000 -164.08277 -157.81977 6.26300 2.40605 -157.95943 746.60036
4515.0000 -165.01535 -158.52520 6.49015 2.41496 -157.81242 733.72664
4520.0000 -163.03966 -156.84419 6.19547 2.43452 -157.48980 730.43419
4525.0000 -163.33283 -156.77844 6.55439 2.47363 -156.84455 795.93936
4530.0000 -164.33366 -158.66723 5.66643 2.46379 -157.00693 787.61701
4535.0000 -163.72210 -158.16853 5.55356 2.37447 -158.48031 711.39009
4540.0000 -164.91268 -158.45197 6.46071 2.40319 -158.00660 705.46149
4545.0000 -164.16466 -158.02611 6.13855 2.37192 -158.52235 702.98905
4550.0000 -163.06872 -156.63348 6.43524 2.46445 -156.99605 778.69610
4555.0000 -163.87395 -156.88096 6.99299 2.47751 -156.78062 803.80757
4560.0000 -163.78532 -157.74490 6.04043 2.44883 -157.25369 786.92017
4565.0000 -164.40937 -159.00824 5.40113 2.33184 -159.18349 667.73820
4570.0000 -165.94746 -159.98243 5.96503 2.32115 -159.35995 673.72667
4575.0000 -165.27271 -160.08119 5.19152 2.25145 -160.50973 649.96853
4580.0000 -164.73949 -158.68286 6.05663 2.29396 -159.80852 667.57453
4585.0000 -164.09707 -156.85404 7.24303 2.42334 -157.67418 748.11447
4590.0000 -164.72737 -157.11213 7.61524 2.48421 -156.67009 798.72425
4595.0000 -163.82243 -155.79424 8.02819 2.52331 -156.02497 809.53825
4600.0000 -164.72838 -157.74178 6.98659 2.45310 -157.18321 773.75325
4605.0000 -164.37417 -158.61504 5.75912 2.36009 -158.71748 700.21712
4610.0000 -165.17005 -159.46699 5.70306 2.31816 -159.40917 662.76502
4615.0000 -164.14126 -157.92135 6.21991 2.34291 -159.00101 692.47398
4620.0000 -165.03495 -159.56279 5.47216 2.33744 -159.09112 692.61760
4625.0000 -164.53668 -158.52985 6.00683 2.32077 -159.36610 667.23246
4630.0000 -164.80182 -158.33688 6.46493 2.33263 -159.17048 698.34352
4635.0000 -163.77292 -157.66793 6.10499 2.36692 -158.60485 733.43840
4640.0000 -163.96867 -157.77608 6.19259 2.45405 -157.16749 758.67477
4645.0000 -164.26190 -157.99741 6.26449 2.37548 -158.46365 719.04787
4650.0000 -164.85308 -157.75883 7.09426 2.45423 -157.16456 772.10667
4655.0000 -162.45761 -154.89409 7.56351 2.50921 -156.25760 811.45796
4660.0000 -164.93520 -157.00400 7.93120 2.51823 -156.10881 816.40950
4665.0000 -163.69266 -157.23519 6.45747 2.46554 -156.97798 767.38388
4670.0000 -163.26576 -157.27106 5.99470 2.42463 -157.65287 712.37895
4675.0000 -163.64600 -158.02166 5.62435 2.39244 -158.18391 719.29303
4680.0000 -164.60900 -157.81085 6.79815 2.38656 -158.28087 725.97047
4685.0000 -163.92661 -157.06410 6.86251 2.45163 -157.20753 737.13209
4690.0000 -164.56591 -158.48542 6.08049 2.42524 -157.64277 751.89570
4695.0000 -163.92836 -158.38636 5.54199 2.38973 -158.22867 726.66385
4700.0000 -164.81777 -157.33131 7.48647 2.42339 -157.67342 746.05628
4705.0000 -163.80625 -157.98600 5.82026 2.42194 -157.69732 768.09756
4710.0000 -163.90627 -157.83295 6.07332 2.40433 -157.98779 728.27668
4715.0000 -164.82859 -157.93084 6.89776 2.40471 -157.98149 724.44838
4720.0000 -165.54115 -160.36385 5.17730 2.34147 -159.02469 674.65017
4725.0000 -164.77327 -158.16444 6.60883 2.36176 -158.68992 664.15639
4730.0000 -164.48922 -158.48709 6.00212 2.38644 -158.28283 721.42674
4735.0000 -164.72859 -157.75424 6.97435 2.37065 -158.54333 719.60087
4740.0000 -163.30632 -158.06653 5.23979 2.37795 -158.42292 716.96149
4745.0000 -163.65512 -157.17641 6.47870 2.40734 -157.93817 724.40131
4750.0000 -164.56092 -158.61898 5.94194 2.40387 -157.99528 717.06889
FREEZING PROCESS: loop number 20 T-loop= 710.00000000000000
main_MD> interactions number 20 at Temperature= 710.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 3.64457 -1.75520 7.53695
force_rgl> df(natom) 1.87511 -1.55292 1.52678
4755.0000 -165.30282 -158.45101 6.85181 2.36086 -158.70487 720.44945
4760.0000 -165.12483 -159.29889 5.82594 2.34486 -158.96872 703.61215
4765.0000 -164.77757 -158.48567 6.29190 2.36385 -158.65547 736.87296
4770.0000 -165.56562 -158.77552 6.79010 2.36091 -158.70408 705.93486
4775.0000 -164.95818 -159.59276 5.36542 2.37362 -158.49428 683.67798
4780.0000 -164.07601 -156.84889 7.22711 2.38498 -158.30688 699.58272
4785.0000 -165.66155 -158.77380 6.88776 2.39682 -158.11171 755.80754
4790.0000 -165.58799 -159.30406 6.28392 2.35839 -158.74561 733.69129
4795.0000 -166.05029 -159.31068 6.73961 2.29685 -159.76077 659.53032
4800.0000 -165.48669 -159.75191 5.73478 2.27455 -160.12860 653.87586
4805.0000 -165.11461 -159.04799 6.06662 2.31042 -159.53697 681.98037
4810.0000 -165.69440 -159.35347 6.34093 2.31402 -159.47749 665.70438
4815.0000 -164.89550 -158.49238 6.40312 2.36188 -158.68806 727.51736
4820.0000 -164.32496 -157.73284 6.59212 2.38747 -158.26596 715.96617
4825.0000 -163.38031 -157.71302 5.66729 2.45224 -157.19746 781.41377
4830.0000 -163.88904 -156.85720 7.03184 2.43194 -157.53234 758.61722
4835.0000 -163.29684 -156.94245 6.35439 2.45417 -157.16562 773.90773
4840.0000 -164.60172 -158.30625 6.29547 2.39785 -158.09466 741.09883
4845.0000 -163.79078 -158.40450 5.38629 2.35530 -158.79648 694.75254
4850.0000 -163.88054 -158.92762 4.95292 2.35432 -158.81267 692.95882
4855.0000 -164.55158 -158.93062 5.62096 2.39043 -158.21704 707.63608
4860.0000 -165.81151 -159.48860 6.32290 2.35761 -158.75838 692.85333
4865.0000 -164.65380 -157.56143 7.09237 2.33683 -159.10125 678.06924
4870.0000 -163.94062 -159.03687 4.90375 2.39349 -158.16652 728.53354
4875.0000 -165.03533 -159.41941 5.61592 2.29675 -159.76243 638.58598
4880.0000 -164.91086 -158.77352 6.13734 2.32188 -159.34786 682.50623
4885.0000 -164.79820 -157.67108 7.12712 2.37068 -158.54285 697.37391
4890.0000 -163.39079 -156.56315 6.82765 2.47866 -156.76156 782.77017
4895.0000 -164.75741 -157.93469 6.82272 2.44803 -157.26682 787.64617
4900.0000 -165.21515 -159.92374 5.29141 2.31728 -159.42379 719.69822
4905.0000 -162.67727 -156.48201 6.19526 2.40077 -158.04651 761.09645
4910.0000 -164.38747 -157.22298 7.16448 2.46231 -157.03131 750.39575
4915.0000 -165.68117 -159.98849 5.69268 2.35802 -158.75171 695.07898
4920.0000 -166.42797 -159.82000 6.60798 2.29202 -159.84044 671.47419
4925.0000 -164.91785 -159.98440 4.93345 2.26766 -160.24225 633.30444
4930.0000 -165.66682 -159.44774 6.21908 2.30193 -159.67699 677.00002
4935.0000 -164.61452 -158.54030 6.07422 2.35234 -158.84545 687.22594
4940.0000 -164.69946 -159.50049 5.19897 2.37442 -158.48119 713.06612
4945.0000 -164.80414 -158.82425 5.97990 2.35242 -158.84414 683.74172
4950.0000 -164.64957 -159.27907 5.37050 2.33547 -159.12361 713.13518
4955.0000 -164.66696 -156.93584 7.73112 2.38042 -158.38223 721.97906
4960.0000 -163.50711 -157.68155 5.82555 2.46516 -156.98424 773.59441
4965.0000 -164.99794 -158.22431 6.77363 2.40518 -157.97374 719.58229
4970.0000 -163.46306 -158.14152 5.32154 2.39852 -158.08362 742.63746
4975.0000 -164.31544 -157.74337 6.57207 2.39524 -158.13767 726.33054
4980.0000 -164.82094 -159.56634 5.25460 2.33965 -159.05465 680.93550
4985.0000 -166.10759 -161.04565 5.06194 2.30371 -159.64764 672.39439
4990.0000 -165.96469 -161.01520 4.94949 2.23649 -160.75645 626.05390
4995.0000 -165.64883 -160.11036 5.53847 2.25332 -160.47884 650.25767
5000.0000 -165.48942 -159.60946 5.87995 2.28495 -159.95712 687.37183
FREEZING PROCESS: loop number 21 T-loop= 685.00000000000000
main_MD> interactions number 21 at Temperature= 685.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.44025 -0.84757 -0.51229
force_rgl> df(natom) 0.81869 -1.29736 0.84639
5005.0000 -164.99265 -159.34614 5.64651 2.31850 -159.40355 679.92949
5010.0000 -164.69563 -159.01119 5.68444 2.34200 -159.01598 703.87287
5015.0000 -164.41198 -157.53260 6.87938 2.40063 -158.04874 718.14390
5020.0000 -162.57783 -155.57590 7.00193 2.48390 -156.67509 772.25848
5025.0000 -164.09311 -158.66802 5.42509 2.48208 -156.70517 756.36504
5030.0000 -164.48378 -158.08724 6.39654 2.37478 -158.47516 704.02654
5035.0000 -165.01784 -159.38236 5.63548 2.33129 -159.19264 686.14622
5040.0000 -165.54188 -160.69797 4.84391 2.28310 -159.98758 684.20149
5045.0000 -164.85016 -160.01886 4.83130 2.25825 -160.39752 616.59547
5050.0000 -163.95926 -159.30682 4.65243 2.29729 -159.75357 631.28412
5055.0000 -165.04735 -159.33231 5.71503 2.29586 -159.77710 663.96269
5060.0000 -165.67370 -159.77209 5.90161 2.28328 -159.98461 653.97475
5065.0000 -166.02147 -160.43395 5.58752 2.28005 -160.03794 678.75588
5070.0000 -164.16051 -158.42496 5.73555 2.31709 -159.42682 669.56869
5075.0000 -164.70635 -158.66815 6.03820 2.40251 -158.01777 747.88422
5080.0000 -164.43159 -158.55547 5.87612 2.36386 -158.65542 709.61680
5085.0000 -164.52242 -159.13521 5.38721 2.33929 -159.06065 677.87098
5090.0000 -165.54946 -158.89159 6.65787 2.34020 -159.04560 690.36542
5095.0000 -164.44834 -158.05517 6.39318 2.36799 -158.58717 727.92868
5100.0000 -163.39221 -157.36237 6.02984 2.40981 -157.89733 729.90376
5105.0000 -165.12145 -159.07801 6.04343 2.41294 -157.84568 719.61752
5110.0000 -166.58621 -160.09806 6.48815 2.28642 -159.93288 662.15511
5115.0000 -166.08439 -158.10582 7.97856 2.34829 -158.91217 715.93961
5120.0000 -165.03905 -158.71921 6.31984 2.32330 -159.32445 718.88843
5125.0000 -165.39387 -159.96604 5.42783 2.32603 -159.27945 715.11805
5130.0000 -165.65474 -159.14071 6.51403 2.34970 -158.88900 712.05607
5135.0000 -164.95469 -159.47575 5.47895 2.34153 -159.02379 703.35548
5140.0000 -165.65089 -158.50499 7.14591 2.34251 -159.00761 694.83765
5145.0000 -164.52956 -158.92362 5.60594 2.36034 -158.71345 698.59252
5150.0000 -166.25957 -159.25160 7.00797 2.34488 -158.96844 695.93043
5155.0000 -165.18595 -159.02014 6.16581 2.32363 -159.31908 669.19632
5160.0000 -164.12871 -157.88225 6.24646 2.42668 -157.61914 752.06491
5165.0000 -163.76265 -156.90253 6.86012 2.41458 -157.81871 747.01702
5170.0000 -164.08287 -157.93268 6.15019 2.44257 -157.35691 757.51744
5175.0000 -165.62158 -158.94997 6.67161 2.36721 -158.60007 724.51084
5180.0000 -166.56931 -160.21454 6.35477 2.33753 -159.08968 699.85752
5185.0000 -166.73695 -160.04362 6.69332 2.27212 -160.16868 673.13514
5190.0000 -166.70813 -160.61474 6.09339 2.25466 -160.45682 641.47669
5195.0000 -165.43373 -160.36025 5.07348 2.23839 -160.72516 623.27422
5200.0000 -166.35952 -159.57089 6.78862 2.30202 -159.67541 667.41097
5205.0000 -165.41854 -159.67199 5.74656 2.31569 -159.45001 684.20258
5210.0000 -164.94492 -158.49314 6.45178 2.33122 -159.19386 668.02493
5215.0000 -164.76981 -158.88489 5.88492 2.35956 -158.72622 686.42386
5220.0000 -165.16194 -159.02951 6.13242 2.33767 -159.08744 685.10728
5225.0000 -164.82555 -160.20682 4.61873 2.29364 -159.81365 645.03592
5230.0000 -165.49727 -159.44891 6.04836 2.28040 -160.03214 651.30929
5235.0000 -166.11118 -160.66232 5.44887 2.28039 -160.03237 666.32204
5240.0000 -165.87839 -159.96048 5.91791 2.22311 -160.97725 625.78869
5245.0000 -165.54648 -159.42077 6.12571 2.34548 -158.95848 703.52684
5250.0000 -165.19683 -158.71663 6.48020 2.30206 -159.67477 649.29515
FREEZING PROCESS: loop number 22 T-loop= 660.00000000000000
main_MD> interactions number 22 at Temperature= 660.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.44387 1.71855 0.81168
force_rgl> df(natom) -1.39900 -3.36328 -1.50795
5255.0000 -164.33466 -158.06169 6.27297 2.34960 -158.89055 693.38159
5260.0000 -164.74250 -159.17995 5.56255 2.39634 -158.11957 702.65838
5265.0000 -166.66480 -160.52826 6.13655 2.28662 -159.92945 675.18493
5270.0000 -166.06206 -159.90878 6.15328 2.24587 -160.60180 636.56542
5275.0000 -164.82590 -158.68444 6.14145 2.28123 -160.01848 648.44394
5280.0000 -165.20507 -159.71863 5.48645 2.33288 -159.16648 671.42787
5285.0000 -165.37073 -159.83171 5.53902 2.26393 -160.30375 625.90137
5290.0000 -166.08210 -160.29802 5.78408 2.28045 -160.03136 632.96943
5295.0000 -165.67324 -160.29913 5.37411 2.24289 -160.65086 631.46693
5300.0000 -166.88828 -161.85677 5.03151 2.20650 -161.25115 599.27654
5305.0000 -165.82281 -161.02187 4.80095 2.18757 -161.56351 580.60065
5310.0000 -166.80999 -160.44858 6.36141 2.25938 -160.37880 629.26675
5315.0000 -165.73233 -160.46751 5.26482 2.25369 -160.47269 627.79805
5320.0000 -166.42292 -161.35794 5.06498 2.26586 -160.27204 635.33253
5325.0000 -165.40827 -159.12266 6.28562 2.26409 -160.30126 645.79556
5330.0000 -164.66345 -158.77562 5.88783 2.34470 -158.97147 694.41967
5335.0000 -165.76855 -160.47324 5.29531 2.30077 -159.69617 673.81552
5340.0000 -166.06973 -160.92327 5.14646 2.23277 -160.81786 612.47157
5345.0000 -166.49795 -161.19003 5.30793 2.19933 -161.36952 584.61570
5350.0000 -165.71336 -159.21398 6.49938 2.28997 -159.87421 677.63329
5355.0000 -165.74166 -160.34279 5.39887 2.26777 -160.24044 688.20852
5360.0000 -165.46292 -160.61528 4.84764 2.23965 -160.70438 637.19857
5365.0000 -166.10570 -160.44097 5.66473 2.27339 -160.14768 632.62782
5370.0000 -166.61959 -160.54909 6.07050 2.22698 -160.91329 617.02884
5375.0000 -165.65559 -159.58107 6.07452 2.24375 -160.63663 637.83698
5380.0000 -166.08850 -160.74649 5.34201 2.25241 -160.49382 645.30408
5385.0000 -165.57781 -159.97395 5.60385 2.22921 -160.87654 607.37491
5390.0000 -164.72333 -159.51032 5.21301 2.30703 -159.59289 683.22187
5395.0000 -165.86797 -160.99756 4.87041 2.31130 -159.52232 671.28982
5400.0000 -165.29079 -160.21207 5.07872 2.24757 -160.57369 632.50942
5405.0000 -165.77747 -160.22518 5.55229 2.25552 -160.44247 645.74716
5410.0000 -166.02068 -159.71272 6.30795 2.28857 -159.89735 669.84891
5415.0000 -164.69661 -159.44245 5.25417 2.29399 -159.80795 635.41438
5420.0000 -165.04366 -159.50766 5.53599 2.31465 -159.46713 671.91760
5425.0000 -165.85316 -159.52552 6.32764 2.27720 -160.08495 648.07634
5430.0000 -164.33655 -159.05600 5.28055 2.33999 -159.04909 707.30447
5435.0000 -165.65775 -159.35643 6.30132 2.31534 -159.45573 692.38928
5440.0000 -166.52710 -160.73648 5.79063 2.25974 -160.37301 648.39863
5445.0000 -166.21528 -161.55030 4.66498 2.23985 -160.70100 628.96088
5450.0000 -164.99589 -160.05193 4.94396 2.19614 -161.42207 592.10123
5455.0000 -164.93699 -159.74276 5.19423 2.29029 -159.86893 676.36153
5460.0000 -166.29042 -159.73150 6.55892 2.34595 -158.95086 703.69162
5465.0000 -165.37263 -159.86774 5.50489 2.28130 -160.01733 673.70012
5470.0000 -165.02654 -159.58583 5.44071 2.31879 -159.39884 693.11664
5475.0000 -166.16171 -160.69967 5.46204 2.27133 -160.18167 667.61809
5480.0000 -166.29069 -159.72565 6.56504 2.25869 -160.39020 643.03346
5485.0000 -165.63341 -160.18511 5.44829 2.26783 -160.23955 638.31948
5490.0000 -166.28827 -159.54336 6.74490 2.32898 -159.23074 686.89927
5495.0000 -164.21198 -158.34038 5.87160 2.38601 -158.28997 701.88565
5500.0000 -165.17188 -159.52925 5.64263 2.31985 -159.38130 683.23381
FREEZING PROCESS: loop number 23 T-loop= 635.00000000000000
main_MD> interactions number 23 at Temperature= 635.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.54015 -0.59471 -2.70746
force_rgl> df(natom) -2.84729 0.88603 -1.67782
5505.0000 -164.86618 -159.81853 5.04765 2.29070 -159.86229 656.97670
5510.0000 -165.75377 -159.89232 5.86145 2.26591 -160.27119 639.04393
5515.0000 -165.23025 -160.41969 4.81056 2.26469 -160.29136 658.45687
5520.0000 -165.62154 -159.15413 6.46741 2.29448 -159.79989 639.32537
5525.0000 -165.62471 -160.32619 5.29852 2.27397 -160.13820 645.73179
5530.0000 -166.11269 -160.56389 5.54880 2.23954 -160.70618 592.85882
5535.0000 -165.43686 -160.28176 5.15510 2.24458 -160.62296 615.37929
5540.0000 -165.20962 -159.94319 5.26644 2.30166 -159.68145 656.59632
5545.0000 -166.30342 -161.32675 4.97667 2.23646 -160.75694 618.51377
5550.0000 -166.45813 -160.36500 6.09312 2.21004 -161.19274 587.63283
5555.0000 -165.18392 -158.78140 6.40252 2.28548 -159.94825 658.88084
5560.0000 -166.58945 -160.82187 5.76758 2.28531 -159.95117 646.81757
5565.0000 -166.53607 -161.06875 5.46733 2.25861 -160.39158 629.28276
5570.0000 -166.21744 -160.31753 5.89992 2.25740 -160.41161 639.87855
5575.0000 -165.04247 -160.02071 5.02176 2.24753 -160.57434 634.07775
5580.0000 -165.83896 -161.28904 4.54992 2.25175 -160.50470 634.01774
5585.0000 -166.41446 -161.27340 5.14107 2.20975 -161.19763 606.62953
5590.0000 -165.21939 -160.04591 5.17348 2.23822 -160.72795 628.35469
5595.0000 -166.31570 -160.19012 6.12559 2.25318 -160.48112 615.27468
5600.0000 -164.84998 -159.47278 5.37719 2.33332 -159.15915 678.64993
5605.0000 -166.97338 -161.56468 5.40871 2.27494 -160.12212 665.92412
5610.0000 -166.60397 -160.98961 5.61436 2.23930 -160.71010 657.64275
5615.0000 -166.56118 -161.56524 4.99594 2.22493 -160.94719 638.34400
5620.0000 -165.80864 -161.09381 4.71483 2.20280 -161.31219 605.91732
5625.0000 -167.41964 -161.77334 5.64630 2.22967 -160.86890 639.60093
5630.0000 -166.89041 -161.21423 5.67618 2.18277 -161.64260 581.26968
5635.0000 -165.84139 -159.63031 6.21108 2.26913 -160.21799 646.66513
5640.0000 -166.67884 -161.81684 4.86200 2.24287 -160.65124 638.43137
5645.0000 -167.40092 -162.19998 5.20095 2.15563 -162.09043 561.56999
5650.0000 -167.10808 -162.52202 4.58605 2.14021 -162.34469 555.78399
5655.0000 -166.37796 -161.73224 4.64572 2.18326 -161.63456 596.51990
5660.0000 -166.07675 -160.87873 5.19801 2.18717 -161.57005 586.97730
5665.0000 -165.54881 -160.28970 5.25911 2.29094 -159.85831 649.53111
5670.0000 -166.81420 -161.87071 4.94350 2.21995 -161.02936 615.60190
5675.0000 -166.00617 -160.74692 5.25925 2.23492 -160.78239 627.67453
5680.0000 -166.13772 -161.34539 4.79232 2.23813 -160.72945 626.09256
5685.0000 -166.18442 -160.67289 5.51153 2.21679 -161.08153 617.41355
5690.0000 -165.72988 -161.54294 4.18694 2.24413 -160.63039 626.56392
5695.0000 -165.89417 -160.89228 5.00189 2.20243 -161.31825 608.31810
5700.0000 -166.29173 -161.07628 5.21545 2.22451 -160.95408 620.56578
5705.0000 -164.73469 -159.54933 5.18536 2.27875 -160.05929 649.15342
5710.0000 -165.16928 -159.91874 5.25054 2.33027 -159.20950 665.53295
5715.0000 -165.88782 -160.96519 4.92263 2.31861 -159.40185 660.17393
5720.0000 -166.29117 -160.81905 5.47212 2.23493 -160.78225 594.06316
5725.0000 -167.90712 -162.10977 5.79735 2.20530 -161.27103 633.22303
5730.0000 -166.66140 -161.30578 5.35562 2.16327 -161.96429 587.33759
5735.0000 -165.08020 -160.12917 4.95103 2.26396 -160.30338 639.20805
5740.0000 -165.18270 -160.17650 5.00620 2.23861 -160.72154 648.55356
5745.0000 -165.51077 -160.25128 5.25949 2.25982 -160.37159 652.44147
5750.0000 -165.60015 -159.27946 6.32070 2.26521 -160.28268 635.90275
FREEZING PROCESS: loop number 24 T-loop= 610.00000000000000
main_MD> interactions number 24 at Temperature= 610.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -2.10737 -1.56796 4.69829
force_rgl> df(natom) 1.68819 -1.33107 -0.65975
5755.0000 -166.66571 -160.43620 6.22951 2.30179 -159.67928 670.44661
5760.0000 -165.78929 -161.08549 4.70381 2.22934 -160.87441 635.57899
5765.0000 -165.94161 -160.96612 4.97548 2.20593 -161.26056 598.30470
5770.0000 -166.37198 -160.95577 5.41621 2.21679 -161.08142 585.85731
5775.0000 -167.16407 -161.71319 5.45088 2.18236 -161.64948 586.13289
5780.0000 -167.80439 -162.36348 5.44090 2.17021 -161.84985 581.22449
5785.0000 -167.99489 -161.21823 6.77666 2.17533 -161.76534 597.64659
5790.0000 -167.23701 -161.14044 6.09656 2.19060 -161.51347 633.42227
5795.0000 -166.90531 -161.94845 4.95685 2.18522 -161.60230 617.55173
5800.0000 -166.37812 -161.59130 4.78682 2.19075 -161.51097 624.23466
5805.0000 -165.45983 -160.34489 5.11494 2.21772 -161.06610 621.19692
5810.0000 -165.12910 -158.52749 6.60161 2.31885 -159.39791 707.05700
5815.0000 -165.71009 -160.51325 5.19684 2.30087 -159.69452 673.26646
5820.0000 -166.75064 -161.48635 5.26429 2.24132 -160.67678 623.68199
5825.0000 -166.99401 -160.99407 5.99993 2.21162 -161.16678 605.70207
5830.0000 -166.25066 -160.70820 5.54246 2.22620 -160.92617 622.61929
5835.0000 -166.90337 -161.19483 5.70854 2.18727 -161.56843 565.84546
5840.0000 -165.59281 -160.67783 4.91498 2.20970 -161.19836 573.63415
5845.0000 -166.38579 -161.32174 5.06405 2.21571 -161.09934 598.19107
5850.0000 -167.06195 -161.69277 5.36918 2.21749 -161.06989 606.44016
5855.0000 -165.96496 -160.89628 5.06868 2.23492 -160.78238 623.17651
5860.0000 -165.51175 -159.97108 5.54067 2.24150 -160.67388 625.69348
5865.0000 -166.34257 -161.42494 4.91763 2.25636 -160.42872 642.37331
5870.0000 -166.09973 -160.53212 5.56761 2.25961 -160.37501 644.13603
5875.0000 -166.28759 -161.32967 4.95792 2.24990 -160.53526 603.96272
5880.0000 -167.31847 -161.64934 5.66912 2.17788 -161.72329 577.75183
5885.0000 -166.30145 -160.74029 5.56115 2.21553 -161.10221 612.29209
5890.0000 -167.10081 -161.52858 5.57223 2.22436 -160.95652 616.68504
5895.0000 -167.10708 -161.61953 5.48754 2.18416 -161.61969 606.53294
5900.0000 -167.70473 -162.44590 5.25883 2.13076 -162.50070 610.76299
5905.0000 -167.74070 -161.93778 5.80292 2.15791 -162.05268 616.35757
5910.0000 -168.13842 -163.15089 4.98753 2.14418 -162.27922 590.14670
5915.0000 -167.75028 -162.46431 5.28598 2.10982 -162.84611 572.52797
5920.0000 -166.50352 -161.40337 5.10015 2.17468 -161.77607 593.53578
5925.0000 -167.37219 -162.41425 4.95795 2.17640 -161.74780 596.73609
5930.0000 -166.48281 -161.24123 5.24158 2.17649 -161.74631 591.23323
5935.0000 -166.15053 -161.09507 5.05546 2.18964 -161.52938 576.93735
5940.0000 -165.29553 -159.38910 5.90643 2.22071 -161.01674 583.46123
5945.0000 -165.74185 -160.13022 5.61163 2.27937 -160.04911 619.86909
5950.0000 -165.81023 -159.60670 6.20353 2.27431 -160.13251 629.12503
5955.0000 -166.08694 -160.63693 5.45001 2.28967 -159.87923 658.67704
5960.0000 -166.54755 -161.38255 5.16500 2.22840 -160.88989 640.15880
5965.0000 -166.49825 -161.34351 5.15474 2.19404 -161.45670 600.49574
5970.0000 -167.61247 -161.80552 5.80695 2.14340 -162.29206 583.40563
5975.0000 -167.20332 -162.10421 5.09911 2.17346 -161.79622 616.79324
5980.0000 -165.93099 -161.49053 4.44046 2.17256 -161.81100 583.63668
5985.0000 -167.06261 -162.51303 4.54958 2.15402 -162.11694 582.45766
5990.0000 -167.13153 -162.03934 5.09219 2.10080 -162.99479 521.90728
5995.0000 -167.29420 -161.11093 6.18326 2.18006 -161.68728 601.23816
6000.0000 -166.22325 -160.90545 5.31779 2.22309 -160.97753 627.85111
FREEZING PROCESS: loop number 25 T-loop= 585.00000000000000
main_MD> interactions number 25 at Temperature= 585.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.81146 1.96308 -1.82907
force_rgl> df(natom) -1.39654 2.70901 1.49619
6005.0000 -167.35103 -161.96926 5.38177 2.21832 -161.05616 634.80453
6010.0000 -168.23786 -162.89298 5.34488 2.14307 -162.29752 579.21820
6015.0000 -167.50006 -162.09105 5.40901 2.13464 -162.43656 564.16128
6020.0000 -166.86117 -161.31309 5.54809 2.20113 -161.33979 625.34689
6025.0000 -165.64641 -161.17859 4.46782 2.25952 -160.37652 650.91572
6030.0000 -166.62620 -162.34289 4.28331 2.20009 -161.35692 588.18852
6035.0000 -166.46477 -160.94981 5.51496 2.17334 -161.79828 568.61938
6040.0000 -166.85947 -161.35955 5.49991 2.18440 -161.61571 617.06295
6045.0000 -166.56700 -161.71148 4.85552 2.17755 -161.72872 587.65098
6050.0000 -166.05880 -161.42794 4.63086 2.18358 -161.62932 582.23329
6055.0000 -166.16958 -161.95389 4.21569 2.17784 -161.72393 556.51512
6060.0000 -167.16890 -162.70976 4.45914 2.11938 -162.68842 535.31794
6065.0000 -167.46352 -162.54796 4.91557 2.15076 -162.17073 563.70826
6070.0000 -166.25581 -161.28566 4.97015 2.16256 -161.97607 566.81223
6075.0000 -167.84964 -162.23006 5.61958 2.19656 -161.41513 609.16219
6080.0000 -167.89046 -161.79654 6.09391 2.15713 -162.06555 586.35314
6085.0000 -167.28771 -162.87969 4.40802 2.13651 -162.40574 580.88785
6090.0000 -166.40555 -162.04435 4.36120 2.14160 -162.32187 545.43348
6095.0000 -165.86024 -160.91479 4.94544 2.17529 -161.76606 568.96957
6100.0000 -166.54730 -160.54721 6.00009 2.21867 -161.05037 595.94828
6105.0000 -166.72937 -161.83218 4.89719 2.21971 -161.03326 627.92942
6110.0000 -167.75601 -162.05908 5.69693 2.16493 -161.93691 600.73954
6115.0000 -166.86133 -161.49582 5.36551 2.16793 -161.88737 592.52722
6120.0000 -167.11797 -162.80269 4.31528 2.15416 -162.11465 579.95896
6125.0000 -167.22693 -162.12180 5.10514 2.14780 -162.21947 566.23686
6130.0000 -166.51451 -161.45244 5.06207 2.14944 -162.19249 572.06862
6135.0000 -168.14274 -162.23471 5.90803 2.17246 -161.81275 583.09427
6140.0000 -167.38293 -161.96761 5.41533 2.16612 -161.91724 586.69810
6145.0000 -166.14917 -161.57883 4.57034 2.20147 -161.33417 611.83185
6150.0000 -167.12036 -161.35040 5.76995 2.19248 -161.48240 602.82953
6155.0000 -166.54911 -160.80962 5.73949 2.21854 -161.05256 624.52720
6160.0000 -166.16418 -160.94357 5.22061 2.22803 -160.89607 630.64154
6165.0000 -165.88354 -160.49244 5.39109 2.20454 -161.28355 595.85610
6170.0000 -167.24522 -162.47784 4.76737 2.18841 -161.54967 582.45857
6175.0000 -166.63503 -160.89132 5.74371 2.16250 -161.97706 567.47873
6180.0000 -167.67696 -162.86889 4.80807 2.14607 -162.24812 565.25091
6185.0000 -167.12675 -162.71140 4.41535 2.12378 -162.61584 541.09613
6190.0000 -166.85057 -162.04758 4.80298 2.17132 -161.83154 587.44171
6195.0000 -166.72561 -161.43419 5.29143 2.21196 -161.16112 633.42516
6200.0000 -166.70048 -161.74197 4.95851 2.18009 -161.68691 605.42932
6205.0000 -167.56804 -162.47577 5.09228 2.14734 -162.22708 583.83156
6210.0000 -166.65336 -160.89276 5.76060 2.15691 -162.06922 580.75204
6215.0000 -166.60361 -161.13692 5.46669 2.20724 -161.23898 619.56614
6220.0000 -165.96248 -160.83605 5.12643 2.17706 -161.73690 584.73692
6225.0000 -166.14676 -161.49413 4.65263 2.21268 -161.14922 585.50520
6230.0000 -166.52000 -161.48707 5.03293 2.20075 -161.34600 595.57722
6235.0000 -168.36175 -162.85633 5.50542 2.12857 -162.53668 542.03705
6240.0000 -166.58660 -161.68970 4.89690 2.15714 -162.06539 568.26092
6245.0000 -167.06880 -162.20226 4.86654 2.14801 -162.21603 555.76324
6250.0000 -165.83450 -160.77909 5.05541 2.20328 -161.30438 590.41919
FREEZING PROCESS: loop number 26 T-loop= 560.00000000000000
main_MD> interactions number 26 at Temperature= 560.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.80240 -0.17065 0.33295
force_rgl> df(natom) -0.38764 -1.12175 -1.80502
6255.0000 -166.48749 -161.68817 4.79932 2.19432 -161.45213 568.11090
6260.0000 -165.81629 -161.93494 3.88134 2.20056 -161.34924 577.34689
6265.0000 -167.23148 -161.78968 5.44180 2.19118 -161.50396 597.49761
6270.0000 -167.68486 -162.83404 4.85082 2.13192 -162.48150 548.40070
6275.0000 -168.09300 -163.71413 4.37887 2.07507 -163.41930 507.25405
6280.0000 -167.64485 -162.19799 5.44687 2.13358 -162.45415 573.68147
6285.0000 -168.12379 -162.93347 5.19032 2.13632 -162.40892 578.53615
6290.0000 -166.81513 -162.74058 4.07456 2.08608 -163.23774 533.21255
6295.0000 -168.06197 -161.97560 6.08637 2.16535 -161.93007 586.52708
6300.0000 -167.75124 -162.45332 5.29792 2.16835 -161.88050 614.20806
6305.0000 -167.22314 -162.34206 4.88108 2.10054 -162.99916 553.02863
6310.0000 -167.37732 -161.96889 5.40843 2.14073 -162.33613 578.08189
6315.0000 -166.88040 -162.30572 4.57468 2.15702 -162.06738 582.56525
6320.0000 -167.44289 -163.73147 3.71142 2.15230 -162.14536 581.59795
6325.0000 -168.08111 -163.40495 4.67615 2.08156 -163.31227 530.27878
6330.0000 -168.62411 -163.77398 4.85013 2.07482 -163.42343 535.38720
6335.0000 -167.27122 -162.51347 4.75775 2.10713 -162.89041 535.25769
6340.0000 -166.85040 -162.61422 4.23618 2.14054 -162.33930 562.14893
6345.0000 -166.65479 -162.50493 4.14986 2.12450 -162.60385 528.51466
6350.0000 -165.61799 -161.31114 4.30686 2.16122 -161.99809 557.73602
6355.0000 -165.42750 -160.05606 5.37145 2.22142 -161.00510 589.99954
6360.0000 -166.33960 -160.99414 5.34547 2.25384 -160.47027 603.91053
6365.0000 -166.38555 -162.19490 4.19065 2.15490 -162.10244 534.59663
6370.0000 -167.56368 -162.86662 4.69706 2.12253 -162.63645 499.78465
6375.0000 -167.49384 -162.04921 5.44462 2.16024 -162.01437 576.87387
6380.0000 -166.82811 -161.86747 4.96065 2.16714 -161.90042 570.97559
6385.0000 -166.49790 -161.48640 5.01151 2.18416 -161.61971 575.47994
6390.0000 -166.36264 -160.36824 5.99441 2.22247 -160.98770 616.53629
6395.0000 -165.87260 -160.90619 4.96641 2.28165 -160.01147 627.50438
6400.0000 -166.36858 -161.65690 4.71168 2.22039 -161.02214 593.80137
6405.0000 -165.98802 -161.35886 4.62916 2.18747 -161.56517 569.19116
6410.0000 -167.38008 -162.52792 4.85216 2.14103 -162.33122 533.39676
6415.0000 -167.68590 -162.43747 5.24843 2.13750 -162.38945 539.60112
6420.0000 -168.19206 -162.43240 5.75965 2.14492 -162.26702 555.36461
6425.0000 -167.21306 -162.20153 5.01153 2.13978 -162.35177 579.68541
6430.0000 -167.07338 -161.79189 5.28149 2.15224 -162.14635 553.18994
6435.0000 -167.00749 -162.29869 4.70880 2.20016 -161.35585 575.04768
6440.0000 -167.94333 -163.08656 4.85677 2.13199 -162.48040 550.96523
6445.0000 -167.44405 -162.92173 4.52232 2.11683 -162.73035 543.56120
6450.0000 -166.28734 -162.05505 4.23229 2.12911 -162.52782 545.54203
6455.0000 -166.70480 -161.76570 4.93910 2.13525 -162.42651 554.71048
6460.0000 -167.43790 -162.30523 5.13267 2.13456 -162.43785 558.00878
6465.0000 -166.07200 -161.11632 4.95568 2.17313 -161.80160 575.06794
6470.0000 -166.02873 -161.40416 4.62458 2.19672 -161.41258 575.32478
6475.0000 -167.36248 -162.06338 5.29909 2.19118 -161.50397 575.24588
6480.0000 -167.05905 -162.02065 5.03840 2.16941 -161.86309 584.39139
6485.0000 -167.20051 -162.09160 5.10891 2.14949 -162.19171 555.73672
6490.0000 -166.13565 -161.60294 4.53271 2.15136 -162.16079 570.14343
6495.0000 -165.85789 -160.21206 5.64582 2.21248 -161.15262 599.62028
6500.0000 -167.04148 -161.93800 5.10348 2.15951 -162.02634 564.77810
FREEZING PROCESS: loop number 27 T-loop= 535.00000000000000
main_MD> interactions number 27 at Temperature= 535.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.69758 -0.48780 -0.65196
force_rgl> df(natom) -0.72769 -0.70209 -0.98000
6505.0000 -167.09355 -162.95880 4.13474 2.12455 -162.60310 538.25372
6510.0000 -167.70184 -163.28229 4.41955 2.09471 -163.09535 503.51279
6515.0000 -167.79961 -163.45477 4.34485 2.07102 -163.48605 492.50456
6520.0000 -166.63199 -162.09744 4.53456 2.11990 -162.67970 530.34759
6525.0000 -166.69304 -162.23493 4.45811 2.15292 -162.13510 550.08625
6530.0000 -167.86127 -162.72785 5.13342 2.13526 -162.42643 558.89686
6535.0000 -168.20437 -163.75506 4.44931 2.08220 -163.30175 515.69362
6540.0000 -167.76612 -163.53781 4.22830 2.06739 -163.54596 516.12462
6545.0000 -167.80762 -162.33660 5.47102 2.11793 -162.71227 541.61304
6550.0000 -168.18783 -163.76206 4.42577 2.11416 -162.77439 542.68050
6555.0000 -168.66376 -163.71898 4.94478 2.07011 -163.50112 508.65360
6560.0000 -168.17393 -163.83967 4.33426 2.08995 -163.17384 514.21446
6565.0000 -166.85697 -162.32437 4.53260 2.10436 -162.93612 533.26717
6570.0000 -167.23384 -161.70166 5.53218 2.13806 -162.38026 558.74709
6575.0000 -167.67161 -162.44838 5.22323 2.15458 -162.10763 591.38131
6580.0000 -166.87614 -162.60316 4.27297 2.11354 -162.78474 531.42238
6585.0000 -167.69959 -162.22602 5.47357 2.17229 -161.81548 582.21970
6590.0000 -167.54914 -163.03333 4.51581 2.10314 -162.95627 520.62230
6595.0000 -166.99607 -162.94575 4.05033 2.11041 -162.83624 523.45991
6600.0000 -167.16989 -161.97240 5.19749 2.11677 -162.73146 550.21904
6605.0000 -166.93026 -162.91934 4.01092 2.12386 -162.61447 548.06292
6610.0000 -167.89777 -163.24806 4.64972 2.10140 -162.98496 520.86620
6615.0000 -167.47189 -162.95803 4.51386 2.05899 -163.68448 505.95187
6620.0000 -167.79857 -162.97767 4.82090 2.12095 -162.66241 533.84227
6625.0000 -167.80611 -162.99553 4.81058 2.10166 -162.98065 542.49412
6630.0000 -168.28929 -163.09656 5.19272 2.12309 -162.62715 572.14444
6635.0000 -167.43671 -163.11768 4.31903 2.10199 -162.97529 544.66361
6640.0000 -169.13553 -164.48859 4.64694 2.05785 -163.70340 487.52029
6645.0000 -168.06522 -163.48610 4.57912 2.06655 -163.55984 546.67356
6650.0000 -167.79595 -162.93697 4.85898 2.08035 -163.33216 556.95322
6655.0000 -167.28396 -162.44379 4.84017 2.09957 -163.01516 550.54643
6660.0000 -167.05761 -162.47542 4.58220 2.13212 -162.47824 576.06519
6665.0000 -167.99510 -163.69322 4.30189 2.10271 -162.96335 558.53914
6670.0000 -168.42886 -163.50682 4.92204 2.02836 -164.18984 486.04933
6675.0000 -166.50665 -162.33103 4.17562 2.11565 -162.74980 570.63118
6680.0000 -167.53576 -162.87798 4.65778 2.11222 -162.80651 554.63854
6685.0000 -167.71616 -163.19476 4.52140 2.09558 -163.08102 537.33906
6690.0000 -167.29745 -162.47856 4.81889 2.10314 -162.95623 527.58676
6695.0000 -167.80678 -163.68071 4.12607 2.10969 -162.84824 551.87737
6700.0000 -166.19168 -162.25166 3.94003 2.09504 -163.08988 521.20191
6705.0000 -167.37103 -162.70418 4.66685 2.17399 -161.78754 568.40731
6710.0000 -167.45813 -162.91430 4.54384 2.09682 -163.06054 511.51958
6715.0000 -166.41570 -161.93804 4.47766 2.14471 -162.27046 547.32567
6720.0000 -165.95286 -160.86595 5.08691 2.17725 -161.73378 562.98835
6725.0000 -166.83800 -162.16174 4.67626 2.21174 -161.16475 622.64674
6730.0000 -168.31404 -163.45023 4.86381 2.09013 -163.17081 528.53670
6735.0000 -168.88536 -163.03795 5.84741 2.07776 -163.37498 520.33801
6740.0000 -167.79018 -162.96212 4.82805 2.11612 -162.74211 554.89953
6745.0000 -167.67988 -163.54184 4.13804 2.07517 -163.41764 519.43261
6750.0000 -167.23937 -162.12250 5.11687 2.10610 -162.90749 548.85377
FREEZING PROCESS: loop number 28 T-loop= 510.00000000000000
main_MD> interactions number 28 at Temperature= 510.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.71054 0.03509 3.21881
force_rgl> df(natom) 2.08217 -0.78252 0.10421
6755.0000 -167.85258 -163.19512 4.65745 2.10552 -162.91704 546.40169
6760.0000 -166.86541 -162.49905 4.36636 2.11713 -162.72541 547.59571
6765.0000 -167.95623 -162.77651 5.17972 2.14075 -162.33575 571.04575
6770.0000 -167.76568 -163.10279 4.66290 2.15010 -162.18151 598.36718
6775.0000 -167.94133 -163.30277 4.63856 2.07076 -163.49037 544.97775
6780.0000 -168.08329 -163.23478 4.84851 2.07994 -163.33898 540.37972
6785.0000 -169.03084 -164.10756 4.92328 2.04772 -163.87049 497.94131
6790.0000 -167.83470 -163.99985 3.83485 2.03253 -164.12098 488.18494
6795.0000 -168.43654 -164.15275 4.28379 2.02438 -164.25547 479.00025
6800.0000 -167.89442 -162.98182 4.91260 2.08002 -163.33771 538.62650
6805.0000 -168.23558 -163.63138 4.60421 2.06966 -163.50846 533.06362
6810.0000 -168.02266 -164.10216 3.92050 2.07013 -163.50070 505.72293
6815.0000 -168.54286 -164.35917 4.18369 2.03368 -164.10210 480.85519
6820.0000 -168.07120 -163.17930 4.89191 2.04118 -163.97827 494.27348
6825.0000 -167.75891 -164.12018 3.63872 2.06370 -163.60682 505.58767
6830.0000 -168.23293 -164.20505 4.02788 2.04666 -163.88801 491.08383
6835.0000 -167.88126 -163.63284 4.24842 2.02883 -164.18201 473.45839
6840.0000 -168.01557 -163.68777 4.32780 2.06022 -163.66431 493.74802
6845.0000 -168.67157 -164.36450 4.30706 2.06435 -163.59605 498.08879
6850.0000 -168.55297 -164.74448 3.80849 1.99352 -164.76462 459.86127
6855.0000 -168.88896 -164.77049 4.11847 1.98575 -164.89277 460.37462
6860.0000 -167.80007 -163.91854 3.88154 2.01315 -164.44077 492.22406
6865.0000 -167.34330 -163.35911 3.98419 2.03852 -164.02216 508.69705
6870.0000 -168.16456 -163.07394 5.09061 2.09683 -163.06025 558.74758
6875.0000 -168.51516 -163.37087 5.14429 2.06655 -163.55981 546.01528
6880.0000 -168.86575 -164.38477 4.48098 2.03757 -164.03793 518.80257
6885.0000 -167.84273 -164.13702 3.70571 2.04004 -163.99707 525.15260
6890.0000 -168.99377 -164.19783 4.79594 2.04447 -163.92409 545.03876
6895.0000 -168.82507 -164.54911 4.27596 1.99229 -164.78478 490.49437
6900.0000 -168.95602 -164.62635 4.32968 2.00034 -164.65197 496.19598
6905.0000 -169.60859 -165.51369 4.09490 1.96258 -165.27490 469.62036
6910.0000 -168.29351 -164.72188 3.57163 1.96722 -165.19832 459.77144
6915.0000 -169.15906 -165.19305 3.96601 1.96855 -165.17650 466.49477
6920.0000 -168.74821 -164.93120 3.81701 1.95462 -165.40617 470.74833
6925.0000 -169.29425 -164.86886 4.42539 1.98124 -164.96713 489.00444
6930.0000 -169.24823 -164.77349 4.47474 1.99686 -164.70937 504.52658
6935.0000 -169.73163 -165.80979 3.92184 1.96859 -165.17573 487.41760
6940.0000 -169.02720 -164.50849 4.51871 1.99059 -164.81281 503.07772
6945.0000 -168.62434 -164.42807 4.19627 2.02755 -164.20320 525.96945
6950.0000 -169.59595 -164.80533 4.79062 1.97878 -165.00770 489.82477
6955.0000 -169.37701 -164.75078 4.62622 1.96559 -165.22530 477.60650
6960.0000 -168.46214 -163.86949 4.59265 2.01828 -164.35618 512.06304
6965.0000 -168.60704 -164.86096 3.74607 2.01549 -164.40205 515.25750
6970.0000 -168.45230 -163.85962 4.59268 2.00303 -164.60764 503.36642
6975.0000 -168.14316 -163.46141 4.68175 2.06306 -163.61736 541.10635
6980.0000 -168.25263 -163.42141 4.83122 2.06858 -163.52631 533.68079
6985.0000 -167.83750 -163.58422 4.25328 2.08412 -163.27007 532.07104
6990.0000 -168.39396 -164.20688 4.18708 2.03878 -164.01797 494.21841
6995.0000 -168.82197 -165.62420 3.19777 1.97871 -165.00883 448.71170
7000.0000 -169.32873 -165.38372 3.94501 1.95324 -165.42902 440.43041
FREEZING PROCESS: loop number 29 T-loop= 485.00000000000000
main_MD> interactions number 29 at Temperature= 485.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.00220 -0.88662 1.40751
force_rgl> df(natom) -1.18015 -1.60598 0.26914
7005.0000 -168.96241 -165.28170 3.68072 1.96369 -165.25660 450.89860
7010.0000 -168.93188 -165.00705 3.92483 1.97090 -165.13773 456.78510
7015.0000 -169.45320 -165.84310 3.61009 1.95866 -165.33962 449.92534
7020.0000 -169.51554 -166.19985 3.31569 1.90195 -166.27513 408.43513
7025.0000 -168.99255 -164.64455 4.34801 1.96078 -165.30470 451.24755
7030.0000 -168.99201 -164.90655 4.08547 2.01662 -164.38344 495.94379
7035.0000 -169.27554 -165.26481 4.01074 1.98699 -164.87229 479.89255
7040.0000 -169.60500 -165.70755 3.89744 1.94972 -165.48708 438.56116
7045.0000 -169.40775 -164.89658 4.51117 1.95610 -165.38191 458.74855
7050.0000 -168.85904 -164.74568 4.11335 1.99160 -164.79614 479.67417
7055.0000 -169.29162 -164.97656 4.31506 1.99069 -164.81128 493.46754
7060.0000 -169.53459 -165.03351 4.50109 1.98253 -164.94585 483.80845
7065.0000 -168.60231 -164.16850 4.43381 1.97333 -165.09757 477.70479
7070.0000 -168.93007 -165.31634 3.61373 1.98540 -164.89849 488.49583
7075.0000 -169.30807 -164.81483 4.49325 1.96409 -165.25000 484.51944
7080.0000 -168.69467 -164.13286 4.56180 2.00016 -164.65499 500.74377
7085.0000 -168.63729 -164.49536 4.14193 1.99878 -164.67778 497.96167
7090.0000 -169.86109 -165.46288 4.39821 1.95222 -165.44592 460.45863
7095.0000 -169.57544 -165.35451 4.22093 1.94665 -165.53780 455.71055
7100.0000 -168.75607 -165.27597 3.48011 1.96827 -165.18115 457.90895
7105.0000 -169.74661 -165.48932 4.25729 1.94676 -165.53591 450.22101
7110.0000 -169.92255 -166.12790 3.79466 1.93701 -165.69674 440.23585
7115.0000 -169.88253 -166.12322 3.75932 1.89961 -166.31375 423.38465
7120.0000 -170.05600 -165.99330 4.06269 1.94039 -165.64092 456.96924
7125.0000 -169.47839 -164.95297 4.52542 1.94851 -165.50702 465.44544
7130.0000 -169.35839 -165.14869 4.20970 1.96790 -165.18715 476.83894
7135.0000 -168.79473 -164.64133 4.15340 1.99445 -164.74924 484.12598
7140.0000 -168.88578 -164.61075 4.27502 1.97907 -165.00290 465.14341
7145.0000 -168.64403 -164.41927 4.22476 2.02880 -164.18255 515.17001
7150.0000 -169.68570 -165.72275 3.96296 1.98756 -164.86281 474.21098
7155.0000 -169.38588 -165.45447 3.93141 1.94872 -165.50360 456.51997
7160.0000 -168.58464 -164.27863 4.30600 1.99263 -164.77918 489.00287
7165.0000 -168.47334 -164.08115 4.39219 2.01283 -164.44608 496.53885
7170.0000 -168.94249 -165.23487 3.70762 1.98954 -164.83028 475.89156
7175.0000 -168.78823 -165.55674 3.23148 1.93030 -165.80736 416.11644
7180.0000 -169.45191 -166.04450 3.40741 1.94840 -165.50884 427.66696
7185.0000 -169.29278 -165.87895 3.41384 1.94896 -165.49956 427.05110
7190.0000 -169.07552 -164.97247 4.10305 1.97353 -165.09432 452.33919
7195.0000 -168.58959 -164.21366 4.37594 2.00371 -164.59647 466.55309
7200.0000 -169.53056 -164.94362 4.58693 2.00451 -164.58325 481.05921
7205.0000 -168.85392 -165.33367 3.52025 1.95721 -165.36355 465.16676
7210.0000 -168.90806 -164.39217 4.51589 2.00307 -164.60698 488.12048
7215.0000 -168.70584 -164.68233 4.02351 2.01918 -164.34129 499.09322
7220.0000 -169.32312 -165.17166 4.15146 1.97351 -165.09464 479.12043
7225.0000 -168.56981 -164.30954 4.26027 2.00410 -164.59000 505.12074
7230.0000 -168.14115 -163.29849 4.84266 2.05201 -163.79974 534.84398
7235.0000 -168.69023 -163.64336 5.04688 2.08890 -163.19115 534.14480
7240.0000 -168.23845 -164.14434 4.09411 2.04447 -163.92403 468.83973
7245.0000 -167.91712 -162.88875 5.02837 2.06226 -163.63054 511.06954
7250.0000 -168.17546 -163.54472 4.63074 2.08061 -163.32789 529.05300
FREEZING PROCESS: loop number 30 T-loop= 460.00000000000000
main_MD> interactions number 30 at Temperature= 460.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -3.04906 -3.46854 -2.65001
force_rgl> df(natom) 1.78996 -1.42662 0.22589
7255.0000 -168.44906 -163.65311 4.79595 2.06334 -163.61282 505.73797
7260.0000 -168.22083 -164.24723 3.97360 2.02572 -164.23334 474.91711
7265.0000 -168.50322 -164.51830 3.98492 2.02387 -164.26385 485.15262
7270.0000 -168.81763 -164.24592 4.57170 2.02831 -164.19064 501.11179
7275.0000 -168.88998 -165.54128 3.34870 1.97837 -165.01446 431.41890
7280.0000 -168.65032 -165.52582 3.12450 1.95061 -165.47236 409.60864
7285.0000 -169.11803 -164.93341 4.18462 1.98092 -164.97233 443.63708
7290.0000 -167.90341 -164.08019 3.82322 1.98638 -164.88226 446.36073
7295.0000 -169.04110 -164.76322 4.27788 2.00837 -164.51951 475.87600
7300.0000 -168.20733 -163.97326 4.23407 2.01950 -164.33604 493.44256
7305.0000 -168.31701 -164.37654 3.94048 2.04075 -163.98545 487.99668
7310.0000 -168.71069 -165.10491 3.60577 1.99937 -164.66806 461.87454
7315.0000 -168.79420 -165.06256 3.73164 1.98831 -164.85048 456.22899
7320.0000 -169.31963 -165.70451 3.61512 1.94427 -165.57704 424.02994
7325.0000 -169.62079 -166.11271 3.50808 1.94624 -165.54453 440.38341
7330.0000 -169.53690 -165.71860 3.81830 1.92763 -165.85150 425.51808
7335.0000 -169.87898 -165.94958 3.92941 1.94446 -165.57391 434.74727
7340.0000 -169.35139 -165.13209 4.21930 1.96867 -165.17443 451.49155
7345.0000 -169.53431 -165.74478 3.78952 1.95628 -165.37883 455.74749
7350.0000 -169.72573 -165.99716 3.72857 1.94796 -165.51612 456.82041
7355.0000 -169.36007 -165.50554 3.85453 1.90682 -166.19469 418.01507
7360.0000 -169.35833 -165.92945 3.42888 1.93015 -165.80997 449.73609
7365.0000 -169.76081 -166.16616 3.59466 1.90507 -166.22362 428.99380
7370.0000 -169.47721 -165.66309 3.81413 1.91604 -166.04275 435.37913
7375.0000 -168.73152 -164.86942 3.86209 1.96138 -165.29476 460.89377
7380.0000 -168.68454 -164.80833 3.87620 2.01037 -164.48663 487.75487
7385.0000 -169.38333 -165.95308 3.43025 1.94953 -165.49017 439.45508
7390.0000 -169.63094 -165.29877 4.33218 1.92945 -165.82142 439.06677
7395.0000 -168.85074 -164.63062 4.22011 1.96903 -165.16850 468.12842
7400.0000 -168.39734 -164.65291 3.74442 2.03028 -164.15822 499.01258
7405.0000 -169.33666 -165.38438 3.95229 1.96719 -165.19889 462.77918
7410.0000 -169.23894 -164.80266 4.43629 1.95498 -165.40024 459.21556
7415.0000 -169.37528 -165.27910 4.09618 1.97515 -165.06758 473.12087
7420.0000 -169.51191 -165.42653 4.08538 1.94691 -165.53338 448.86967
7425.0000 -169.31125 -165.23352 4.07773 1.94882 -165.50186 442.89028
7430.0000 -169.98079 -165.87459 4.10621 1.93072 -165.80051 425.83436
7435.0000 -168.22093 -164.87837 3.34256 1.97248 -165.11159 454.47415
7440.0000 -169.45315 -165.57380 3.87935 1.95499 -165.40007 453.25379
7445.0000 -169.55119 -165.58976 3.96143 1.95151 -165.45750 455.68970
7450.0000 -169.56772 -165.97247 3.59525 1.94501 -165.56482 441.33741
7455.0000 -169.67571 -165.40362 4.27209 1.94318 -165.59489 435.95523
7460.0000 -169.37279 -165.67396 3.69883 1.95780 -165.35372 460.14592
7465.0000 -169.80870 -166.40618 3.40252 1.89742 -166.34976 409.53131
7470.0000 -170.20396 -166.76329 3.44067 1.88464 -166.56072 401.35955
7475.0000 -169.99426 -166.45579 3.53847 1.90326 -166.25355 425.60443
7480.0000 -168.91370 -164.88585 4.02785 1.96798 -165.18583 480.14870
7485.0000 -169.54895 -165.20650 4.34245 1.96812 -165.18361 484.10058
7490.0000 -169.03656 -165.24208 3.79449 1.95919 -165.33090 471.75418
7495.0000 -168.68516 -164.77053 3.91462 1.93486 -165.73217 461.09091
7500.0000 -168.52035 -164.30112 4.21923 1.99776 -164.69457 507.86141
FREEZING PROCESS: loop number 31 T-loop= 435.00000000000000
main_MD> interactions number 31 at Temperature= 435.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.07665 0.36699 0.15490
force_rgl> df(natom) -4.29940 4.19022 2.36253
7505.0000 -169.42174 -165.39769 4.02405 1.99868 -164.67937 504.82382
7510.0000 -168.70069 -165.02656 3.67413 2.00049 -164.64954 504.31598
7515.0000 -169.58253 -165.79824 3.78429 1.93537 -165.72383 445.53031
7520.0000 -169.91416 -166.29808 3.61608 1.93732 -165.69162 447.03245
7525.0000 -169.80492 -166.49795 3.30697 1.88564 -166.54424 404.86371
7530.0000 -169.58719 -165.74932 3.83787 1.91589 -166.04512 428.90879
7535.0000 -170.30113 -166.50922 3.79191 1.90669 -166.19691 433.48633
7540.0000 -169.63372 -165.91083 3.72289 1.88675 -166.52584 412.42278
7545.0000 -169.61584 -165.73326 3.88258 1.93033 -165.80693 451.91178
7550.0000 -169.76462 -165.90470 3.85991 1.91412 -166.07434 447.84438
7555.0000 -169.64196 -165.55394 4.08802 1.96071 -165.30573 482.17252
7560.0000 -169.50739 -165.45114 4.05625 1.92119 -165.95767 448.38978
7565.0000 -169.06166 -165.44727 3.61439 1.93438 -165.74008 429.74188
7570.0000 -169.55807 -165.59388 3.96419 1.94266 -165.60347 444.08224
7575.0000 -169.91299 -166.75396 3.15903 1.90554 -166.21596 422.29786
7580.0000 -169.96676 -165.69558 4.27118 1.87989 -166.63906 413.91440
7585.0000 -169.85719 -165.73642 4.12078 1.93703 -165.69648 451.85725
7590.0000 -170.06977 -166.70638 3.36339 1.89367 -166.41174 408.51150
7595.0000 -169.87816 -166.39336 3.48480 1.88100 -166.62068 399.99188
7600.0000 -169.63094 -166.17615 3.45479 1.89246 -166.43173 410.34969
7605.0000 -169.30143 -165.31615 3.98528 1.91906 -165.99282 434.94756
7610.0000 -170.20631 -165.81762 4.38869 1.90341 -166.25103 417.93644
7615.0000 -170.21398 -165.95619 4.25779 1.94146 -165.62335 450.34704
7620.0000 -169.38266 -165.17626 4.20641 1.95831 -165.34544 459.13932
7625.0000 -169.73298 -165.99331 3.73966 1.94100 -165.63098 449.86815
7630.0000 -169.88275 -165.74499 4.13776 1.92981 -165.81544 445.66776
7635.0000 -169.53044 -165.86296 3.66749 1.91704 -166.02623 435.29642
7640.0000 -169.66797 -165.39514 4.27283 1.93582 -165.71640 450.18602
7645.0000 -169.52485 -164.99298 4.53187 1.95094 -165.46692 467.26981
7650.0000 -169.73950 -166.23507 3.50444 1.92612 -165.87638 452.06583
7655.0000 -170.61633 -166.17621 4.44012 1.88484 -166.55730 418.67921
7660.0000 -170.42930 -166.91420 3.51510 1.90805 -166.17444 438.04737
7665.0000 -169.79708 -166.11075 3.68633 1.90804 -166.17465 426.98455
7670.0000 -170.16758 -166.01271 4.15487 1.90518 -166.22179 427.70810
7675.0000 -169.53787 -165.77538 3.76249 1.91504 -166.05924 441.70246
7680.0000 -170.03711 -166.02499 4.01212 1.91931 -165.98877 447.41888
7685.0000 -170.39458 -166.45889 3.93569 1.88930 -166.48371 419.08595
7690.0000 -170.50463 -166.50647 3.99816 1.90013 -166.30507 425.38441
7695.0000 -169.90246 -166.22701 3.67546 1.88321 -166.58424 414.16701
7700.0000 -170.29049 -165.90709 4.38340 1.89831 -166.33510 417.23715
7705.0000 -169.96902 -166.17256 3.79646 1.93466 -165.73549 464.73147
7710.0000 -170.05998 -166.38050 3.67948 1.91517 -166.05703 449.53485
7715.0000 -170.09232 -166.35446 3.73786 1.90570 -166.21317 438.59665
7720.0000 -169.71148 -166.66417 3.04731 1.89378 -166.40982 421.79119
7725.0000 -170.38369 -166.86145 3.52224 1.88348 -166.57985 417.76510
7730.0000 -170.54918 -167.06446 3.48472 1.87167 -166.77459 414.97239
7735.0000 -170.27932 -166.93505 3.34427 1.86962 -166.80839 411.98388
7740.0000 -170.15680 -166.26107 3.89574 1.87844 -166.66294 425.63326
7745.0000 -169.94842 -166.65580 3.29262 1.89167 -166.44473 430.11753
7750.0000 -170.06742 -166.36060 3.70682 1.87551 -166.71125 424.60918
FREEZING PROCESS: loop number 32 T-loop= 410.00000000000000
main_MD> interactions number 32 at Temperature= 410.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.00995 -0.66416 2.18994
force_rgl> df(natom) 0.42247 0.15980 -0.56485
7755.0000 -170.16016 -166.70461 3.45554 1.85073 -167.11999 392.07463
7760.0000 -170.43039 -166.87001 3.56038 1.86881 -166.82184 412.47711
7765.0000 -170.61446 -167.32799 3.28646 1.83695 -167.34732 384.15867
7770.0000 -169.98523 -166.83017 3.15506 1.85730 -167.01164 399.83089
7775.0000 -170.06718 -166.64863 3.41855 1.86075 -166.95470 385.54702
7780.0000 -170.54479 -166.76582 3.77897 1.87565 -166.70892 397.47217
7785.0000 -170.37583 -166.96233 3.41350 1.87619 -166.69996 398.14352
7790.0000 -170.27748 -167.15484 3.12263 1.85021 -167.12868 370.30639
7795.0000 -170.27118 -167.05133 3.21985 1.86712 -166.84972 390.34387
7800.0000 -170.07293 -166.83673 3.23620 1.86204 -166.93342 390.43932
7805.0000 -170.53744 -166.77903 3.75841 1.90284 -166.26048 417.36039
7810.0000 -169.78888 -166.73396 3.05492 1.88093 -166.62180 403.31523
7815.0000 -169.64378 -165.95772 3.68606 1.87745 -166.67927 393.94427
7820.0000 -170.04306 -166.55913 3.48393 1.90811 -166.17341 422.62103
7825.0000 -169.77026 -166.57750 3.19275 1.89073 -166.46016 404.15362
7830.0000 -169.68681 -166.05351 3.63330 1.90883 -166.16155 420.78114
7835.0000 -170.23022 -166.49822 3.73201 1.91111 -166.12394 423.39135
7840.0000 -169.35460 -166.15918 3.19542 1.90544 -166.21749 424.29432
7845.0000 -169.84684 -166.12643 3.72041 1.89932 -166.31844 419.49789
7850.0000 -169.40295 -165.64935 3.75360 1.93662 -165.70314 445.57145
7855.0000 -170.18771 -166.59206 3.59565 1.87637 -166.69706 399.91685
7860.0000 -170.22105 -167.03622 3.18483 1.89799 -166.34035 423.02750
7865.0000 -169.69697 -166.15163 3.54534 1.90519 -166.22165 438.69826
7870.0000 -169.64321 -166.24856 3.39465 1.89600 -166.37332 430.96470
7875.0000 -170.06769 -166.26327 3.80442 1.89033 -166.46674 419.78098
7880.0000 -170.26983 -166.29556 3.97427 1.90348 -166.24991 430.85805
7885.0000 -170.21459 -166.93953 3.27505 1.86796 -166.83589 400.49233
7890.0000 -170.40388 -167.05743 3.34645 1.86383 -166.90396 397.34382
7895.0000 -169.12191 -166.28480 2.83711 1.88559 -166.54495 415.07489
7900.0000 -170.23485 -166.77303 3.46181 1.86294 -166.91855 404.98871
7905.0000 -169.91752 -166.32250 3.59503 1.87337 -166.74650 406.67288
7910.0000 -170.24353 -166.45277 3.79076 1.89978 -166.31097 436.87205
7915.0000 -170.63356 -167.21492 3.41864 1.86301 -166.91747 401.81641
7920.0000 -170.71629 -166.52344 4.19285 1.87572 -166.70782 404.02241
7925.0000 -169.69829 -166.61091 3.08738 1.88989 -166.47401 411.95726
7930.0000 -169.70129 -166.91255 2.78874 1.89267 -166.42815 416.75949
7935.0000 -170.27084 -166.44997 3.82087 1.89844 -166.33300 421.94149
7940.0000 -170.38555 -167.34392 3.04163 1.83746 -167.33902 368.60455
7945.0000 -170.63940 -167.50690 3.13249 1.82896 -167.47924 362.09854
7950.0000 -170.26072 -166.94968 3.31104 1.84636 -167.19206 381.64819
7955.0000 -170.28700 -166.54223 3.74477 1.89489 -166.39153 422.70963
7960.0000 -170.20193 -166.63566 3.56627 1.90462 -166.23112 434.43905
7965.0000 -169.96488 -166.57415 3.39073 1.86385 -166.90356 381.82437
7970.0000 -170.34330 -167.17356 3.16974 1.86312 -166.91559 380.73972
7975.0000 -170.23341 -166.70501 3.52840 1.86590 -166.86979 384.80005
7980.0000 -170.34634 -167.10540 3.24094 1.87197 -166.76964 389.69594
7985.0000 -170.04302 -166.65949 3.38353 1.89677 -166.36059 414.16326
7990.0000 -170.23667 -166.32090 3.91577 1.90643 -166.20120 426.51792
7995.0000 -169.91889 -166.22505 3.69384 1.89875 -166.32797 410.77227
8000.0000 -169.99967 -166.16888 3.83080 1.91898 -165.99420 437.49158
FREEZING PROCESS: loop number 33 T-loop= 385.00000000000000
main_MD> interactions number 33 at Temperature= 385.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.84824 0.39200 -0.93346
force_rgl> df(natom) -0.73010 -3.63839 0.46221
8005.0000 -170.34749 -166.80138 3.54610 1.90972 -166.14699 429.15190
8010.0000 -170.64306 -167.52731 3.11576 1.84544 -167.20731 377.71418
8015.0000 -170.63386 -167.33330 3.30057 1.85391 -167.06760 393.22738
8020.0000 -170.82354 -167.91780 2.90573 1.81655 -167.68395 357.82366
8025.0000 -170.71678 -167.32610 3.39068 1.81232 -167.75373 359.33249
8030.0000 -170.47853 -167.12421 3.35433 1.83777 -167.33387 372.23439
8035.0000 -169.48477 -166.40180 3.08297 1.86736 -166.84572 399.37662
8040.0000 -170.19343 -166.71754 3.47589 1.86800 -166.83521 402.99124
8045.0000 -170.39810 -167.16686 3.23124 1.85888 -166.98555 392.48856
8050.0000 -170.51268 -167.30938 3.20330 1.86122 -166.94693 399.03853
8055.0000 -170.44816 -167.25656 3.19161 1.85532 -167.04427 389.59281
8060.0000 -171.22007 -167.52557 3.69450 1.85139 -167.10910 391.19165
8065.0000 -170.02641 -166.78756 3.23885 1.82769 -167.50005 366.79580
8070.0000 -169.78918 -167.18206 2.60712 1.87259 -166.75936 405.38917
8075.0000 -170.90131 -167.84867 3.05264 1.82377 -167.56477 362.74848
8080.0000 -170.52087 -167.51335 3.00752 1.81678 -167.68006 357.68255
8085.0000 -170.34089 -167.32584 3.01506 1.85031 -167.12694 374.25142
8090.0000 -170.07663 -166.73362 3.34301 1.89818 -166.33722 406.62528
8095.0000 -169.84370 -167.14805 2.69565 1.87723 -166.68285 402.98272
8100.0000 -170.84207 -167.69462 3.14745 1.84937 -167.14242 380.14052
8105.0000 -169.93247 -166.24488 3.68760 1.85039 -167.12565 375.43137
8110.0000 -170.28022 -166.72855 3.55166 1.88587 -166.54034 416.11380
8115.0000 -170.44213 -167.50719 2.93494 1.85639 -167.02665 392.76503
8120.0000 -170.43350 -167.39783 3.03567 1.82500 -167.54452 355.16381
8125.0000 -170.95639 -167.49006 3.46633 1.84503 -167.21400 382.13709
8130.0000 -170.53858 -167.05275 3.48582 1.83977 -167.30087 374.66654
8135.0000 -170.33515 -166.54588 3.78926 1.85888 -166.98566 386.79722
8140.0000 -170.05414 -166.51174 3.54240 1.86558 -166.87504 395.81910
8145.0000 -170.62617 -167.06223 3.56394 1.88005 -166.63642 409.85178
8150.0000 -170.84482 -167.53750 3.30732 1.83149 -167.43745 365.64491
8155.0000 -170.58122 -167.05890 3.52232 1.83527 -167.37514 374.29166
8160.0000 -170.58585 -167.09106 3.49479 1.86609 -166.86672 387.55401
8165.0000 -170.76746 -167.71310 3.05436 1.82893 -167.47962 350.75023
8170.0000 -170.11343 -167.10369 3.00974 1.84562 -167.20425 369.15885
8175.0000 -170.61810 -166.78845 3.82965 1.85649 -167.02509 375.80410
8180.0000 -170.09771 -166.40657 3.69114 1.88479 -166.55822 401.45681
8185.0000 -170.29430 -167.07756 3.21674 1.86594 -166.86916 390.48132
8190.0000 -170.72653 -167.63393 3.09260 1.82241 -167.58725 350.07770
8195.0000 -169.90124 -166.95676 2.94448 1.85360 -167.07269 379.74178
8200.0000 -170.43368 -166.75647 3.67721 1.87324 -166.74872 395.30183
8205.0000 -170.30309 -166.26137 4.04173 1.88943 -166.48164 413.69450
8210.0000 -169.62064 -166.58757 3.03307 1.91525 -166.05573 431.59358
8215.0000 -170.06049 -166.63476 3.42573 1.87130 -166.78071 389.13123
8220.0000 -169.99992 -167.27682 2.72309 1.85734 -167.01095 369.55253
8225.0000 -170.09750 -167.07555 3.02195 1.85468 -167.05495 371.85879
8230.0000 -170.17230 -166.74868 3.42362 1.87231 -166.76401 388.37697
8235.0000 -169.68189 -166.36734 3.31454 1.88638 -166.53198 408.23966
8240.0000 -170.49398 -166.33937 4.15461 1.88610 -166.53655 412.84871
8245.0000 -170.31810 -167.51374 2.80437 1.84963 -167.13815 380.66253
8250.0000 -170.56061 -167.49576 3.06485 1.82200 -167.59394 358.64446
FREEZING PROCESS: loop number 34 T-loop= 360.00000000000000
main_MD> interactions number 34 at Temperature= 360.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.62242 3.52256 0.18467
force_rgl> df(natom) 1.34215 -1.72090 1.45801
8255.0000 -170.04721 -167.22938 2.81784 1.85108 -167.11433 381.23491
8260.0000 -170.74220 -167.25547 3.48673 1.85177 -167.10294 378.05998
8265.0000 -170.33486 -166.78743 3.54742 1.85816 -166.99746 391.52384
8270.0000 -170.64307 -167.35067 3.29240 1.84800 -167.16507 378.97013
8275.0000 -170.55549 -167.39756 3.15792 1.83156 -167.43626 361.09367
8280.0000 -170.08310 -166.70804 3.37506 1.85760 -167.00678 379.63466
8285.0000 -171.25129 -167.87200 3.37929 1.86069 -166.95576 393.70060
8290.0000 -170.58769 -167.86461 2.72308 1.79958 -167.96387 340.40783
8295.0000 -170.58760 -167.37879 3.20881 1.81377 -167.72978 356.39727
8300.0000 -171.66053 -168.71803 2.94250 1.80604 -167.85717 347.95404
8305.0000 -170.63312 -167.67493 2.95819 1.77561 -168.35925 317.34336
8310.0000 -170.96717 -167.32911 3.63806 1.82710 -167.50987 368.03747
8315.0000 -170.41042 -167.34014 3.07027 1.83254 -167.42006 371.04660
8320.0000 -170.37352 -166.96839 3.40513 1.85468 -167.05485 389.11394
8325.0000 -170.36648 -167.37492 2.99156 1.83237 -167.42286 369.39737
8330.0000 -170.45840 -167.12628 3.33212 1.83483 -167.38225 372.86188
8335.0000 -170.34776 -166.91524 3.43252 1.84675 -167.18561 388.62014
8340.0000 -170.12417 -167.42437 2.69981 1.84366 -167.23673 378.55120
8345.0000 -170.29736 -167.52594 2.77142 1.82273 -167.58199 359.45018
8350.0000 -170.83440 -167.35114 3.48326 1.82687 -167.51371 367.83528
8355.0000 -170.84849 -167.66562 3.18287 1.84804 -167.16441 379.30620
8360.0000 -170.26016 -167.76480 2.49536 1.82122 -167.60688 350.45203
8365.0000 -170.68121 -167.40165 3.27956 1.82825 -167.49081 349.53800
8370.0000 -170.53301 -167.67597 2.85704 1.83375 -167.40020 359.72039
8375.0000 -170.63429 -167.41292 3.22137 1.82312 -167.57550 354.46053
8380.0000 -170.78073 -167.30704 3.47369 1.82597 -167.52843 364.62602
8385.0000 -170.83571 -167.98694 2.84877 1.80374 -167.89512 348.11463
8390.0000 -170.32903 -167.13761 3.19142 1.81845 -167.65249 353.57926
8395.0000 -170.90639 -167.37870 3.52769 1.87668 -166.69195 405.46837
8400.0000 -170.97174 -167.90315 3.06859 1.81937 -167.63734 357.02901
8405.0000 -171.09989 -167.96743 3.13246 1.79290 -168.07405 340.39740
8410.0000 -170.98840 -167.54225 3.44615 1.81003 -167.79140 347.82958
8415.0000 -171.01835 -167.65518 3.36317 1.83630 -167.35810 373.66693
8420.0000 -171.25771 -168.64680 2.61090 1.78425 -168.21665 332.78849
8425.0000 -171.13956 -168.13181 3.00775 1.80141 -167.93362 336.85463
8430.0000 -170.32375 -167.25589 3.06785 1.80079 -167.94389 335.19671
8435.0000 -170.79186 -167.79834 2.99352 1.81899 -167.64369 353.11090
8440.0000 -170.81336 -167.44392 3.36944 1.81453 -167.71721 352.88935
8445.0000 -171.28635 -168.02538 3.26098 1.81208 -167.75756 345.62432
8450.0000 -170.87252 -167.93206 2.94046 1.77511 -168.36745 312.19516
8455.0000 -170.64108 -168.10851 2.53256 1.78825 -168.15065 319.54585
8460.0000 -170.64275 -167.37857 3.26418 1.80597 -167.85841 332.40731
8465.0000 -170.74467 -167.52769 3.21698 1.82870 -167.48338 360.70118
8470.0000 -170.98614 -167.96447 3.02167 1.82369 -167.56615 353.55310
8475.0000 -170.12663 -167.54715 2.57947 1.82036 -167.62101 358.37494
8480.0000 -170.78096 -167.29309 3.48788 1.83762 -167.33627 366.08315
8485.0000 -170.36361 -167.24119 3.12243 1.84505 -167.21377 371.42291
8490.0000 -169.88782 -167.24761 2.64021 1.85352 -167.07398 359.21506
8495.0000 -170.33694 -167.78473 2.55220 1.83352 -167.40398 348.94429
8500.0000 -170.25011 -167.03931 3.21080 1.82383 -167.56375 350.12972
FREEZING PROCESS: loop number 35 T-loop= 335.00000000000000
main_MD> interactions number 35 at Temperature= 335.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.47120 0.52438 2.03470
force_rgl> df(natom) 2.34815 -0.57969 -1.14989
8505.0000 -170.48129 -167.60705 2.87424 1.84914 -167.14624 369.60211
8510.0000 -170.35204 -167.31242 3.03962 1.83062 -167.45176 361.51419
8515.0000 -170.65514 -167.59376 3.06138 1.83729 -167.34175 362.15497
8520.0000 -170.89690 -167.61716 3.27974 1.81955 -167.63438 346.68196
8525.0000 -170.24338 -167.40095 2.84243 1.83848 -167.32212 361.67411
8530.0000 -170.02013 -167.42629 2.59384 1.83324 -167.40857 351.69012
8535.0000 -170.58323 -167.44542 3.13781 1.83038 -167.45566 344.43536
8540.0000 -170.45928 -168.02809 2.43119 1.80997 -167.79236 333.11679
8545.0000 -170.76298 -167.39993 3.36305 1.80068 -167.94563 329.41359
8550.0000 -170.78678 -168.27370 2.51309 1.81019 -167.78871 335.90185
8555.0000 -170.70217 -168.01139 2.69078 1.80317 -167.90457 320.87385
8560.0000 -170.78661 -167.97791 2.80871 1.78432 -168.21557 319.85543
8565.0000 -171.24055 -167.85596 3.38459 1.79425 -168.05173 330.72888
8570.0000 -171.27240 -168.62420 2.64819 1.76304 -168.56664 304.72737
8575.0000 -170.95508 -168.09180 2.86328 1.76809 -168.48336 308.55048
8580.0000 -171.22844 -168.07515 3.15329 1.79614 -168.02049 326.51523
8585.0000 -169.98715 -167.40326 2.58390 1.80194 -167.92491 335.99799
8590.0000 -171.04273 -167.98712 3.05561 1.82512 -167.54251 351.81602
8595.0000 -171.12809 -168.24805 2.88004 1.79595 -168.02377 323.52360
8600.0000 -170.71546 -167.03805 3.67741 1.82920 -167.47518 351.36130
8605.0000 -170.43903 -167.68081 2.75822 1.82566 -167.53367 359.98169
8610.0000 -171.14400 -168.28281 2.86119 1.80443 -167.88383 344.98066
8615.0000 -171.16976 -168.64935 2.52041 1.78100 -168.27025 319.07520
8620.0000 -171.22942 -168.05940 3.17002 1.76988 -168.45377 319.17616
8625.0000 -170.52299 -167.47946 3.04353 1.79895 -167.97429 346.39551
8630.0000 -170.71911 -168.35300 2.36611 1.79926 -167.96912 337.00151
8635.0000 -171.08661 -168.12843 2.95818 1.77202 -168.41847 316.26945
8640.0000 -170.72266 -167.67379 3.04887 1.78386 -168.22312 317.65206
8645.0000 -171.20536 -168.73904 2.46632 1.76927 -168.46380 308.92097
8650.0000 -170.74677 -167.81986 2.92691 1.78598 -168.18824 324.92524
8655.0000 -170.67901 -167.78821 2.89080 1.80579 -167.86140 350.06528
8660.0000 -170.16546 -167.15230 3.01317 1.82083 -167.61334 352.96927
8665.0000 -171.20807 -167.66553 3.54253 1.84855 -167.15595 380.25486
8670.0000 -171.04550 -167.93411 3.11139 1.81000 -167.79185 350.01152
8675.0000 -171.40331 -168.56285 2.84046 1.76417 -168.54790 309.22127
8680.0000 -170.57605 -168.11572 2.46033 1.75859 -168.63997 299.76649
8685.0000 -170.74694 -168.17030 2.57664 1.77942 -168.29640 318.99778
8690.0000 -170.81468 -167.19058 3.62409 1.79788 -167.99179 337.99786
8695.0000 -171.35622 -167.88515 3.47107 1.82162 -167.60017 352.34736
8700.0000 -170.67160 -167.74108 2.93052 1.80109 -167.93892 338.98120
8705.0000 -171.07402 -167.97395 3.10007 1.80404 -167.89027 340.97818
8710.0000 -170.93658 -168.21675 2.71983 1.78736 -168.16548 327.87378
8715.0000 -170.90152 -168.48234 2.41918 1.78817 -168.15206 330.17613
8720.0000 -170.91377 -167.86782 3.04595 1.77465 -168.37500 314.54583
8725.0000 -170.98295 -168.37737 2.60559 1.78350 -168.22914 322.42049
8730.0000 -170.51442 -167.94504 2.56938 1.78759 -168.16164 327.59933
8735.0000 -171.02394 -168.29078 2.73316 1.76680 -168.50464 308.32193
8740.0000 -170.42294 -167.63660 2.78634 1.79042 -168.11491 329.44458
8745.0000 -170.89833 -168.13255 2.76579 1.81096 -167.77604 352.56926
8750.0000 -171.28342 -168.69820 2.58522 1.76750 -168.49295 311.48312
FREEZING PROCESS: loop number 36 T-loop= 310.00000000000000
main_MD> interactions number 36 at Temperature= 310.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 4.99324 -0.79638 -3.58429
force_rgl> df(natom) 2.09409 1.70459 1.06763
8755.0000 -171.01819 -168.32410 2.69409 1.77104 -168.43470 315.74118
8760.0000 -171.17917 -168.37509 2.80408 1.76904 -168.46762 309.71316
8765.0000 -170.91263 -168.11439 2.79825 1.77266 -168.40798 313.98770
8770.0000 -171.27425 -168.51231 2.76194 1.78530 -168.19945 325.76809
8775.0000 -171.33331 -168.75613 2.57718 1.75340 -168.72563 297.23252
8780.0000 -171.29739 -167.86516 3.43223 1.77026 -168.44748 311.70668
8785.0000 -171.13027 -168.29030 2.83997 1.80376 -167.89485 344.35458
8790.0000 -171.62881 -168.96662 2.66219 1.75273 -168.73661 299.12691
8795.0000 -171.07981 -167.77180 3.30801 1.76722 -168.49761 312.33058
8800.0000 -170.94558 -168.21981 2.72577 1.79481 -168.04247 339.22441
8805.0000 -170.59564 -168.51983 2.07580 1.75183 -168.75151 293.13476
8810.0000 -171.22536 -168.59390 2.63146 1.75676 -168.67026 297.65504
8815.0000 -171.11313 -168.29526 2.81787 1.76065 -168.60596 306.78528
8820.0000 -171.29714 -168.51187 2.78527 1.77299 -168.40237 326.27903
8825.0000 -171.13017 -168.82484 2.30533 1.74346 -168.88953 300.43486
8830.0000 -171.03284 -168.23615 2.79669 1.76732 -168.49596 321.83861
8835.0000 -171.01529 -168.05655 2.95874 1.79091 -168.10679 341.76139
8840.0000 -171.40604 -167.94473 3.46131 1.80147 -167.93267 349.60122
8845.0000 -171.33269 -168.76996 2.56273 1.77018 -168.44877 326.45029
8850.0000 -171.60923 -168.93501 2.67422 1.73699 -168.99629 299.11447
8855.0000 -171.78150 -169.37742 2.40408 1.74093 -168.93126 300.44021
8860.0000 -171.67915 -169.15011 2.52904 1.73053 -169.10286 287.60594
8865.0000 -171.34143 -168.37440 2.96703 1.74938 -168.79185 309.44304
8870.0000 -171.73036 -169.05416 2.67620 1.74574 -168.85195 304.27288
8875.0000 -171.12230 -167.93719 3.18511 1.79585 -168.02541 346.22118
8880.0000 -171.84700 -168.99914 2.84786 1.76736 -168.49534 326.60950
8885.0000 -171.25906 -169.09896 2.16010 1.74070 -168.93507 297.51187
8890.0000 -171.15181 -168.69777 2.45404 1.74445 -168.87322 302.24272
8895.0000 -171.96806 -168.84815 3.11991 1.74928 -168.79357 310.91140
8900.0000 -171.30385 -168.65193 2.65192 1.74117 -168.92732 301.28349
8905.0000 -171.53822 -168.69598 2.84224 1.75642 -168.67571 311.92638
8910.0000 -171.22231 -168.57946 2.64286 1.76827 -168.48027 323.35787
8915.0000 -171.08913 -168.18121 2.90793 1.77220 -168.41542 327.98644
8920.0000 -171.40553 -168.60817 2.79737 1.77195 -168.41959 331.35237
8925.0000 -171.21725 -168.71373 2.50352 1.76355 -168.55817 319.36963
8930.0000 -171.36851 -169.06090 2.30761 1.74067 -168.93567 296.51081
8935.0000 -170.94881 -168.25652 2.69228 1.74411 -168.87891 307.18144
8940.0000 -170.98294 -168.17945 2.80349 1.77187 -168.42094 325.14356
8945.0000 -171.39838 -168.64015 2.75823 1.78049 -168.27867 326.77827
8950.0000 -171.69418 -169.15669 2.53749 1.74130 -168.92524 295.58438
8955.0000 -171.97446 -169.63541 2.33905 1.71723 -169.32221 278.40599
8960.0000 -171.95942 -169.37889 2.58054 1.71438 -169.36927 273.86293
8965.0000 -171.73475 -168.85210 2.88265 1.72404 -169.21000 285.72901
8970.0000 -171.31778 -168.40111 2.91667 1.74852 -168.80609 305.71951
8975.0000 -171.42638 -168.96238 2.46400 1.74321 -168.89364 301.98673
8980.0000 -171.62524 -168.91157 2.71367 1.72554 -169.18521 286.51596
8985.0000 -171.97981 -169.38834 2.59147 1.73398 -169.04589 293.60956
8990.0000 -171.36615 -169.16983 2.19632 1.72545 -169.18666 288.25210
8995.0000 -171.31577 -168.54960 2.76617 1.75451 -168.70723 311.19562
9000.0000 -171.46653 -168.64524 2.82129 1.75130 -168.76024 308.72413
main_MD> EXECUTION TIME: 0 [day], 0 [hour], 14 [min], 15.2861217 [s].
main_MD> Deallocating global variables
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