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nanoparticlesims/growth_Melting_Silver_ICO_4091/freezeSims/run_30/freeze.log

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main_MD> Reading input file
read_input> Process type: freezing
Read_input> Process caloric with a T-change of 25.000000000000000 [K] and a rate of 9.9999999999999992E+022 [K/ns]
read_input> Input for metadynamics has been read
read_input> Metadynamics has not been chosen.
read_input> Reading initial positions fromtoFreeze_30.xyz
read_input> Finish reading initial positions
read_input> Validating positions
read_input> Initializing random number generator
read_input> Checking program
read_rgl> START READING FILE ../pot.pot
read_rgl>> END READING FILE ../pot.pot
READ_RGL>> atomic speciesAgAg imet1 4 imet2 4
READ_RGL>> atomic radius 1.4450000999999999 1.4450000999999999
read_rgl> PARAMETERS SELECTION
FOR IMET1 :: Ag 4
ECOH :: 2.9500000000000002 A :: 0.10308871000000000 QSI :: 1.1895434899999999
p :: 10.850000000000000 q :: 3.1800000000000002
ATOMIC RADIUS :: 1.4450000999999999
choice_pot> values:
frac = 0.12062503764379931 arete = 4.0870774781009569
choice_pot> mass is== 108.00000000000000 for elem1=
read_input> ntipo1 = 30 ntipo2 = 0
read_input> Finish reading input
main_MD> Allocating global variables
main_MD> Number of outputs that will be created: 1650
main_MD> Size of nv and nvoiz: 30 3000
main_MD> Size of nv and nvoiz: 30 3000
main_MD> Number of time-steps (npas) = 50000
main_MD> Number of CVs (num_cv) = 1
main_MD> Max allowed number of atoms = 2900
main_MD> Max number of atoms = 30
main_MD> Consider changing parameter nsiz in module_parameters.f90 for performance
main_MD> collvar_wanted = F
main_MD> INPUT AND POTENTIAL FILE READING IS DONE
main_MD> THERMALIZATION IS STARTING
init> 7.7621852499344848E-002 -9.1310685594461441E-002 -0.26259998777326105 initial drift of cluster / NP1 for coalescence
init> 0.40781963680426486 0.33542258916020323 0.23339240141304810 scaling for velocity /for coalescence NP1
init.f90 > facguy = 3.6107208663410106E-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) 1.19904 2.58310 0.17182
force_rgl> df(natom) -1.52516 -1.12970 -0.90978
preparo> THERMALIZATION PROCESS AT 1137.0405079601244
preparo> TOTAL ENERGY, KINETIC EN., POT. ENERGY, DELTA
5000 -64.239783256415251 3.0439752384053698 -67.283758494820617 5.6433061510984927E-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 33
FREEZING PROCESS: loop number 1 T-loop= 1106.0000000000000
main_MD> interactions number 1 at Temperature= 1106.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.71838 2.47026 1.54438
force_rgl> df(natom) 1.86133 0.93448 3.24245
5.0000 -67.68064 -63.05903 4.62161 2.55750 -63.80765 1061.60840
10.0000 -68.81115 -63.79481 5.01635 2.60997 -63.30101 1157.14357
15.0000 -67.55241 -63.20487 4.34754 2.59501 -63.44544 1157.03235
20.0000 -66.88391 -62.90863 3.97528 2.65775 -62.83968 1189.15623
25.0000 -66.72998 -62.16287 4.56711 2.69329 -62.49656 1232.87946
30.0000 -67.76465 -63.19098 4.57367 2.58745 -63.51844 1135.67989
35.0000 -68.89931 -65.04169 3.85762 2.47276 -64.62579 1039.75597
40.0000 -69.14141 -65.21171 3.92970 2.51803 -64.18869 1117.45952
45.0000 -68.18946 -64.09690 4.09257 2.47484 -64.60572 1032.18704
50.0000 -69.63785 -65.18132 4.45652 2.47469 -64.60717 1015.63477
55.0000 -67.81837 -63.54972 4.26865 2.46421 -64.70831 979.82136
60.0000 -68.70433 -64.10369 4.60063 2.54148 -63.96228 1088.64966
65.0000 -68.70613 -64.17940 4.52674 2.48960 -64.46313 1121.55700
70.0000 -68.45058 -63.34328 5.10729 2.53357 -64.03862 1076.28121
75.0000 -68.31491 -64.71753 3.59738 2.53683 -64.00720 1085.76021
80.0000 -68.53442 -64.20714 4.32728 2.47909 -64.56461 1009.65005
85.0000 -66.58124 -62.68487 3.89638 2.62695 -63.13705 1149.20573
90.0000 -66.80221 -62.61983 4.18238 2.68157 -62.60974 1178.11862
95.0000 -67.94594 -63.34637 4.59957 2.58674 -63.52527 1145.99200
100.0000 -67.89241 -63.26126 4.63115 2.64307 -62.98146 1246.83735
105.0000 -68.56987 -64.32858 4.24129 2.60312 -63.36711 1182.61506
110.0000 -67.76215 -63.03778 4.72437 2.51178 -64.24903 1067.03139
115.0000 -67.06150 -62.99350 4.06801 2.66594 -62.76065 1213.62659
120.0000 -67.78259 -63.04175 4.74084 2.64579 -62.95514 1202.76679
125.0000 -69.40287 -65.16919 4.23369 2.50033 -64.35963 1033.12585
130.0000 -69.08728 -64.82346 4.26382 2.44488 -64.89497 1032.54257
135.0000 -68.33527 -64.89017 3.44510 2.40805 -65.25051 1020.53218
140.0000 -68.57797 -64.60347 3.97449 2.46343 -64.71580 1038.41952
145.0000 -69.17874 -64.54302 4.63572 2.45877 -64.76082 1007.60353
150.0000 -69.27267 -64.97260 4.30007 2.39454 -65.38094 964.34393
155.0000 -67.74411 -63.93532 3.80879 2.41160 -65.21626 981.51711
160.0000 -68.75322 -64.35672 4.39649 2.57226 -63.66506 1069.94882
165.0000 -68.25052 -63.09723 5.15329 2.59032 -63.49073 1086.83938
170.0000 -68.22884 -63.56723 4.66160 2.64621 -62.95112 1170.64647
175.0000 -68.74839 -64.10632 4.64207 2.54718 -63.90728 1123.03849
180.0000 -68.88410 -64.75991 4.12419 2.54557 -63.92284 1102.33912
185.0000 -68.41150 -64.47819 3.93331 2.51157 -64.25107 1034.69560
190.0000 -69.15503 -64.66989 4.48513 2.56707 -63.71518 1187.61884
195.0000 -68.04668 -64.30665 3.74003 2.45775 -64.77069 1061.88795
200.0000 -67.17876 -63.09484 4.08391 2.58071 -63.58349 1073.32162
205.0000 -68.58178 -64.08466 4.49711 2.60891 -63.31125 1091.55970
210.0000 -68.41984 -63.76419 4.65566 2.52138 -64.15631 1077.74993
215.0000 -67.73597 -64.21454 3.52142 2.58118 -63.57898 1149.83427
220.0000 -68.63422 -63.50972 5.12450 2.57028 -63.68420 1117.00274
225.0000 -67.68293 -63.85193 3.83100 2.59755 -63.42089 1147.40534
230.0000 -66.51634 -62.69465 3.82169 2.67139 -62.70805 1167.96839
235.0000 -67.40405 -63.49556 3.90849 2.61961 -63.20798 1183.52903
240.0000 -67.75105 -63.01183 4.73922 2.66673 -62.75296 1205.97797
245.0000 -67.95793 -63.88872 4.06921 2.51802 -64.18879 1079.78579
250.0000 -67.31091 -62.89889 4.41203 2.58145 -63.57641 1168.46402
FREEZING PROCESS: loop number 2 T-loop= 1081.0000000000000
main_MD> interactions number 2 at Temperature= 1081.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 6.88187 14.81680 5.12269
force_rgl> df(natom) -0.90920 -10.03726 3.40056
255.0000 -68.39720 -64.04037 4.35683 2.65189 -62.89627 1228.24483
260.0000 -67.55975 -63.94206 3.61768 2.58867 -63.50671 1117.70962
265.0000 -68.11245 -64.77127 3.34118 2.53474 -64.02733 1088.32652
270.0000 -68.21795 -64.60082 3.61713 2.49173 -64.44265 1107.41011
275.0000 -68.57251 -64.49934 4.07317 2.47934 -64.56222 1026.97352
280.0000 -67.90596 -64.00631 3.89965 2.47150 -64.63797 1007.15441
285.0000 -68.85785 -65.78351 3.07434 2.43317 -65.00804 1020.10000
290.0000 -69.82782 -66.72611 3.10171 2.32370 -66.06495 916.75408
295.0000 -69.42575 -65.12288 4.30287 2.37206 -65.59805 1010.01154
300.0000 -69.23530 -64.39889 4.83641 2.43288 -65.01077 999.93551
305.0000 -69.72544 -64.76452 4.96092 2.45655 -64.78222 1008.98523
310.0000 -68.06618 -63.58629 4.47988 2.53191 -64.05472 1088.34893
315.0000 -67.80270 -62.91609 4.88661 2.63162 -63.09197 1197.09133
320.0000 -66.75284 -62.66244 4.09039 2.62949 -63.11251 1166.38273
325.0000 -67.21205 -63.47876 3.73328 2.62903 -63.11699 1183.40769
330.0000 -67.74487 -64.11452 3.63035 2.54803 -63.89903 1049.30389
335.0000 -68.51480 -63.97030 4.54450 2.44501 -64.89366 1013.51059
340.0000 -68.11356 -63.28251 4.83104 2.53194 -64.05435 1052.33895
345.0000 -66.66618 -62.91675 3.74943 2.65555 -62.86094 1141.55804
350.0000 -66.95133 -62.22919 4.72213 2.66854 -62.73557 1178.41502
355.0000 -67.96944 -62.49476 5.47469 2.66422 -62.77724 1172.37778
360.0000 -66.32467 -61.22051 5.10416 2.66143 -62.80413 1273.61114
365.0000 -66.86693 -63.10713 3.75980 2.75298 -61.92025 1295.99824
370.0000 -69.66907 -65.12312 4.54596 2.60329 -63.36550 1178.44278
375.0000 -68.03391 -63.40816 4.62574 2.49820 -64.38011 1061.66133
380.0000 -67.41006 -62.62444 4.78562 2.62746 -63.13212 1197.74947
385.0000 -68.11165 -63.72455 4.38710 2.61865 -63.21725 1207.63334
390.0000 -68.60049 -65.38025 3.22024 2.51255 -64.24158 1080.19186
395.0000 -68.23547 -64.92839 3.30709 2.40566 -65.27360 924.14920
400.0000 -67.53369 -63.79341 3.74028 2.51719 -64.19680 1094.50754
405.0000 -67.92196 -64.25661 3.66535 2.50748 -64.29059 1058.63439
410.0000 -68.87812 -64.83640 4.04172 2.46499 -64.70079 1002.78503
415.0000 -68.42022 -64.96728 3.45294 2.41340 -65.19890 958.29112
420.0000 -68.14993 -62.95628 5.19366 2.47936 -64.56205 1072.75285
425.0000 -68.62160 -64.50652 4.11508 2.53780 -63.99778 1112.60667
430.0000 -68.13862 -63.82375 4.31487 2.50075 -64.35552 1078.38630
435.0000 -67.66887 -63.98950 3.67937 2.54696 -63.90938 1176.50957
440.0000 -67.94307 -63.56239 4.38068 2.50851 -64.28062 1026.35143
445.0000 -68.16962 -64.45401 3.71561 2.51879 -64.18137 1052.55302
450.0000 -67.40769 -62.14326 5.26443 2.56094 -63.77442 1098.82908
455.0000 -67.53480 -61.55366 5.98114 2.75930 -61.85929 1300.26548
460.0000 -68.18778 -63.58901 4.59877 2.72847 -62.15687 1263.75159
465.0000 -67.88805 -63.10407 4.78398 2.62003 -63.20391 1158.50800
470.0000 -67.27121 -63.26213 4.00907 2.61614 -63.24143 1174.79114
475.0000 -67.00993 -61.61127 5.39866 2.69637 -62.46683 1244.81886
480.0000 -66.20734 -62.74749 3.45984 2.74055 -62.04029 1231.25658
485.0000 -67.95502 -63.11325 4.84177 2.62499 -63.15597 1146.57183
490.0000 -67.85170 -64.23722 3.61448 2.56316 -63.75298 1126.43129
495.0000 -67.67448 -63.64897 4.02551 2.50768 -64.28865 1069.74686
500.0000 -68.51448 -63.82283 4.69166 2.63031 -63.10462 1191.62326
FREEZING PROCESS: loop number 3 T-loop= 1056.0000000000000
main_MD> interactions number 3 at Temperature= 1056.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -4.33752 -0.14191 2.99454
force_rgl> df(natom) 1.25796 1.11315 -0.39911
505.0000 -68.95483 -64.54761 4.40722 2.55159 -63.86472 1127.77671
510.0000 -68.48608 -63.92820 4.55788 2.52044 -64.16542 1069.81821
515.0000 -68.92825 -65.28086 3.64740 2.49323 -64.42817 1044.80652
520.0000 -67.91026 -64.21660 3.69366 2.40241 -65.30502 944.27738
525.0000 -67.76372 -62.62323 5.14049 2.61240 -63.27755 1140.50205
530.0000 -68.45939 -62.63779 5.82160 2.59679 -63.42826 1160.16695
535.0000 -69.01466 -64.45927 4.55539 2.58674 -63.52534 1212.85182
540.0000 -68.76624 -65.08813 3.67811 2.42682 -65.06935 1004.09349
545.0000 -68.43334 -64.68587 3.74747 2.48107 -64.54554 985.09833
550.0000 -68.49965 -64.74411 3.75554 2.49361 -64.42443 1070.15658
555.0000 -68.76049 -64.57953 4.18096 2.49075 -64.45208 1068.56043
560.0000 -68.82580 -64.47107 4.35473 2.49363 -64.42428 1078.01460
565.0000 -68.21165 -62.87534 5.33631 2.51898 -64.17953 1059.53104
570.0000 -68.26341 -64.03400 4.22941 2.62010 -63.20317 1197.26658
575.0000 -69.86950 -64.82186 5.04765 2.48172 -64.53925 1046.70755
580.0000 -68.51594 -64.83686 3.67908 2.48935 -64.46559 1064.71960
585.0000 -68.31145 -64.80971 3.50175 2.49294 -64.43097 1091.96833
590.0000 -69.88590 -65.52300 4.36290 2.43621 -64.97865 1033.87800
595.0000 -69.37688 -64.90940 4.46749 2.41231 -65.20942 1024.74693
600.0000 -68.82451 -64.40459 4.41992 2.47709 -64.58393 1097.44205
605.0000 -69.77630 -64.97515 4.80115 2.49324 -64.42804 1051.96817
610.0000 -68.56124 -64.77402 3.78722 2.45196 -64.82654 958.16908
615.0000 -68.14857 -64.18496 3.96362 2.43770 -64.96422 976.83866
620.0000 -67.54247 -62.40873 5.13374 2.55316 -63.84950 1006.11506
625.0000 -67.80091 -64.26295 3.53796 2.47862 -64.56921 1003.72000
630.0000 -69.23244 -64.80792 4.42452 2.45499 -64.79736 1045.22375
635.0000 -68.37717 -64.41964 3.95753 2.55510 -63.83079 1100.90941
640.0000 -68.06870 -64.68543 3.38327 2.52064 -64.16346 1082.14984
645.0000 -68.21719 -64.53747 3.67973 2.43465 -64.99367 1000.45944
650.0000 -67.99252 -63.50577 4.48675 2.58648 -63.52778 1152.69905
655.0000 -67.58198 -63.41913 4.16285 2.54227 -63.95465 1059.61548
660.0000 -69.20486 -64.73396 4.47090 2.53749 -64.00078 1076.25679
665.0000 -70.01865 -66.11656 3.90209 2.41019 -65.22988 1003.66226
670.0000 -69.40853 -64.67832 4.73022 2.32975 -66.00647 926.69956
675.0000 -69.67778 -65.47455 4.20323 2.36407 -65.67514 935.52089
680.0000 -68.99423 -63.96031 5.03392 2.40483 -65.28167 989.23786
685.0000 -69.10935 -63.29465 5.81470 2.53350 -64.03932 1163.93534
690.0000 -67.48304 -63.72578 3.75726 2.55981 -63.78533 1127.07555
695.0000 -68.90291 -65.22296 3.67995 2.46831 -64.66870 1011.42952
700.0000 -68.24020 -63.41253 4.82767 2.56217 -63.76250 1093.18739
705.0000 -68.09653 -63.44641 4.65012 2.59301 -63.46472 1116.47574
710.0000 -67.04346 -62.71207 4.33139 2.62063 -63.19814 1184.01440
715.0000 -67.59787 -62.18508 5.41279 2.66827 -62.73818 1231.59067
720.0000 -67.54592 -62.91046 4.63546 2.64928 -62.92150 1184.93720
725.0000 -67.42759 -63.67966 3.74793 2.60492 -63.34982 1130.61257
730.0000 -69.81272 -65.10044 4.71228 2.46738 -64.67775 1024.89474
735.0000 -70.13305 -66.03452 4.09853 2.40157 -65.31306 973.85497
740.0000 -68.86552 -65.09100 3.77452 2.40100 -65.31862 1000.61315
745.0000 -68.43806 -64.08622 4.35184 2.49223 -64.43781 1025.56586
750.0000 -69.23195 -65.18602 4.04593 2.40413 -65.28841 959.48493
FREEZING PROCESS: loop number 4 T-loop= 1031.0000000000000
main_MD> interactions number 4 at Temperature= 1031.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.48514 0.00216 -1.51414
force_rgl> df(natom) -0.21822 1.16385 -1.01652
755.0000 -69.99042 -65.84522 4.14521 2.35457 -65.76691 907.44800
760.0000 -69.78117 -65.43188 4.34929 2.38614 -65.46207 984.69086
765.0000 -69.43467 -65.92173 3.51294 2.32618 -66.04097 918.06514
770.0000 -68.98344 -64.50072 4.48272 2.39836 -65.34409 999.62125
775.0000 -68.32153 -62.95725 5.36428 2.55813 -63.80149 1118.77842
780.0000 -68.09044 -64.63597 3.45447 2.58385 -63.55319 1133.20680
785.0000 -69.41476 -65.55415 3.86061 2.35566 -65.75632 898.36362
790.0000 -69.56158 -65.48180 4.07978 2.37275 -65.59134 972.54552
795.0000 -71.30016 -66.69724 4.60291 2.33407 -65.96483 939.18155
800.0000 -68.34996 -64.43187 3.91808 2.44751 -64.86957 1044.10186
805.0000 -68.42058 -64.80765 3.61294 2.47460 -64.60805 1081.48493
810.0000 -68.48711 -65.10753 3.37958 2.42534 -65.08361 969.50732
815.0000 -69.09239 -63.89463 5.19775 2.48435 -64.51390 1081.73050
820.0000 -67.95191 -63.25436 4.69755 2.60138 -63.38400 1172.90262
825.0000 -67.47385 -63.68541 3.78844 2.60893 -63.31110 1114.13967
830.0000 -67.57609 -63.42077 4.15531 2.60105 -63.38714 1194.64359
835.0000 -68.08881 -65.01793 3.07088 2.52412 -64.12992 1033.71832
840.0000 -68.05238 -62.91183 5.14055 2.59624 -63.43355 1125.18859
845.0000 -68.05708 -64.29110 3.76598 2.52402 -64.13084 1108.06777
850.0000 -69.85658 -66.25218 3.60439 2.33679 -65.93855 888.43156
855.0000 -68.30824 -64.79604 3.51219 2.37711 -65.54923 909.45188
860.0000 -67.22145 -63.25491 3.96654 2.52332 -64.13761 1085.26440
865.0000 -68.20564 -63.16708 5.03856 2.58831 -63.51019 1067.37770
870.0000 -68.41082 -63.57928 4.83154 2.56163 -63.76770 1095.71967
875.0000 -68.95141 -65.29814 3.65327 2.50569 -64.30780 1066.40980
880.0000 -67.99642 -64.34401 3.65241 2.42795 -65.05840 989.80221
885.0000 -69.32941 -65.21593 4.11348 2.44499 -64.89388 1052.61105
890.0000 -70.09983 -66.43281 3.66701 2.33861 -65.92094 886.51190
895.0000 -68.72518 -65.22188 3.50330 2.35495 -65.76316 928.92280
900.0000 -68.37775 -63.61294 4.76481 2.47654 -64.58929 1056.68912
905.0000 -69.10862 -64.76262 4.34600 2.55144 -63.86613 1077.30693
910.0000 -68.67825 -64.92861 3.74964 2.44173 -64.92532 968.34010
915.0000 -67.67604 -63.73878 3.93726 2.52145 -64.15569 1048.26492
920.0000 -68.38422 -64.31853 4.06569 2.53156 -64.05807 1050.71731
925.0000 -68.67209 -64.18602 4.48607 2.53102 -64.06330 1044.44112
930.0000 -67.11153 -61.96569 5.14584 2.57005 -63.68645 1131.13129
935.0000 -67.75329 -63.76973 3.98356 2.62169 -63.18788 1168.99221
940.0000 -68.57090 -64.96052 3.61038 2.52204 -64.14994 1089.05203
945.0000 -67.80273 -63.53747 4.26527 2.51774 -64.19147 1059.56383
950.0000 -69.27419 -64.22008 5.05411 2.60811 -63.31895 1082.05721
955.0000 -66.96602 -62.72820 4.23782 2.63808 -63.02965 1246.81544
960.0000 -67.40522 -62.95465 4.45057 2.67651 -62.65855 1241.18757
965.0000 -68.67832 -63.91951 4.75881 2.56563 -63.72913 1168.43883
970.0000 -69.19845 -65.49522 3.70323 2.44271 -64.91593 1040.13334
975.0000 -67.74530 -64.16673 3.57857 2.41973 -65.13772 967.33973
980.0000 -67.45946 -63.64451 3.81495 2.51989 -64.17068 1116.53155
985.0000 -67.40414 -63.66866 3.73549 2.56473 -63.73778 1140.92213
990.0000 -68.62598 -65.08134 3.54464 2.57022 -63.68481 1145.51487
995.0000 -69.07784 -65.13596 3.94188 2.39661 -65.36101 963.03556
1000.0000 -69.10567 -66.74635 2.35932 2.33222 -65.98267 912.52304
FREEZING PROCESS: loop number 5 T-loop= 1006.0000000000000
main_MD> interactions number 5 at Temperature= 1006.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -2.18437 -1.46569 3.48364
force_rgl> df(natom) -3.57274 -1.85879 -9.95942
1005.0000 -68.91327 -65.93307 2.98020 2.25370 -66.74076 804.78334
1010.0000 -68.82233 -65.17372 3.64861 2.35363 -65.77598 921.27686
1015.0000 -68.14110 -64.36564 3.77546 2.44169 -64.92578 1046.25693
1020.0000 -68.42663 -63.90936 4.51727 2.44944 -64.85095 1039.49960
1025.0000 -68.18208 -63.68234 4.49974 2.52852 -64.08745 1040.92762
1030.0000 -68.13418 -63.10276 5.03142 2.63832 -63.02733 1147.98974
1035.0000 -67.68208 -63.98016 3.70192 2.66887 -62.73236 1187.55359
1040.0000 -68.72824 -64.63462 4.09361 2.49594 -64.40199 1051.83399
1045.0000 -68.47820 -64.54932 3.92888 2.44024 -64.93975 999.59500
1050.0000 -68.15462 -64.99050 3.16412 2.44331 -64.91008 1030.07070
1055.0000 -70.70920 -66.98515 3.72405 2.27952 -66.49148 886.33927
1060.0000 -68.88047 -65.44341 3.43706 2.27828 -66.50345 897.68439
1065.0000 -69.38849 -65.17642 4.21207 2.37637 -65.55637 1007.70802
1070.0000 -69.06331 -65.76232 3.30100 2.34439 -65.86517 913.03244
1075.0000 -69.55963 -66.12205 3.43758 2.34456 -65.86353 927.13066
1080.0000 -68.68321 -65.44383 3.23938 2.39428 -65.38347 971.63524
1085.0000 -67.83237 -64.58421 3.24817 2.43859 -64.95567 962.84813
1090.0000 -69.32711 -65.60890 3.71821 2.36586 -65.65783 876.36202
1095.0000 -69.18218 -66.05255 3.12963 2.44572 -64.88679 1030.82636
1100.0000 -68.57460 -65.34442 3.23017 2.36008 -65.71370 936.27888
1105.0000 -67.82787 -64.04835 3.77952 2.47611 -64.59338 1086.29161
1110.0000 -67.61225 -64.66983 2.94242 2.49766 -64.38537 1026.74913
1115.0000 -69.22604 -65.12214 4.10390 2.49014 -64.45795 1019.42719
1120.0000 -67.62475 -63.42042 4.20433 2.46649 -64.68625 1066.08348
1125.0000 -68.47966 -64.87062 3.60904 2.54767 -63.90249 1065.58728
1130.0000 -68.50147 -64.51736 3.98411 2.50973 -64.26884 1077.75183
1135.0000 -68.54837 -65.10124 3.44713 2.40999 -65.23185 1002.82320
1140.0000 -67.66343 -63.93823 3.72521 2.50816 -64.28396 1094.95834
1145.0000 -68.24411 -64.37528 3.86883 2.55554 -63.82657 1112.02686
1150.0000 -69.68159 -65.63575 4.04584 2.40255 -65.30363 960.24698
1155.0000 -69.23586 -65.49194 3.74393 2.41674 -65.16663 1063.09362
1160.0000 -70.02288 -66.68980 3.33309 2.29386 -66.35305 898.43712
1165.0000 -70.12526 -66.36214 3.76312 2.30340 -66.26096 909.27517
1170.0000 -69.27275 -65.84950 3.42325 2.34806 -65.82973 920.67429
1175.0000 -68.97995 -65.83443 3.14553 2.36374 -65.67829 924.93448
1180.0000 -69.25739 -65.75340 3.50399 2.30849 -66.21176 886.99854
1185.0000 -69.46122 -65.10170 4.35952 2.35985 -65.71592 950.02816
1190.0000 -68.50418 -63.63563 4.86855 2.51603 -64.20801 1073.03843
1195.0000 -65.86326 -62.56418 3.29908 2.65535 -62.86289 1194.52621
1200.0000 -69.58522 -65.45541 4.12981 2.45395 -64.80737 1004.51205
1205.0000 -68.32814 -63.28217 5.04597 2.50990 -64.26719 1039.65057
1210.0000 -68.68685 -64.83341 3.85344 2.56198 -63.76440 1108.88235
1215.0000 -68.48037 -64.86314 3.61723 2.49068 -64.45271 1065.29222
1220.0000 -69.92252 -66.05643 3.86609 2.35609 -65.75221 898.59451
1225.0000 -68.58422 -65.15433 3.42989 2.38094 -65.51226 923.46449
1230.0000 -67.79602 -63.96864 3.82738 2.43798 -64.96159 979.23316
1235.0000 -69.29529 -65.29402 4.00126 2.46554 -64.69550 1044.46565
1240.0000 -69.47608 -65.66785 3.80823 2.37345 -65.58457 919.47917
1245.0000 -69.35919 -65.74525 3.61394 2.36177 -65.69741 931.71323
1250.0000 -69.15369 -65.76809 3.38560 2.36090 -65.70574 964.83278
FREEZING PROCESS: loop number 6 T-loop= 981.00000000000000
main_MD> interactions number 6 at Temperature= 981.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 3.57474 0.38651 -0.97230
force_rgl> df(natom) 3.16672 -0.06142 -2.23411
1255.0000 -69.56055 -64.64959 4.91096 2.44099 -64.93246 1032.96000
1260.0000 -68.03244 -64.45225 3.58020 2.49492 -64.41182 1007.06038
1265.0000 -68.78781 -65.29633 3.49148 2.47880 -64.56747 1042.05885
1270.0000 -68.62801 -65.43640 3.19161 2.36719 -65.64499 935.64317
1275.0000 -68.29991 -64.35428 3.94562 2.45791 -64.76911 988.05688
1280.0000 -67.82707 -64.25483 3.57224 2.55878 -63.79523 1101.77129
1285.0000 -68.86778 -64.42040 4.44739 2.50446 -64.31972 1024.30818
1290.0000 -68.71650 -64.76290 3.95360 2.50568 -64.30793 1023.90025
1295.0000 -69.74889 -64.72869 5.02020 2.49284 -64.43193 1071.98834
1300.0000 -68.92264 -64.48902 4.43362 2.47155 -64.63749 1082.29595
1305.0000 -69.18471 -64.72784 4.45687 2.42709 -65.06673 972.59321
1310.0000 -69.79909 -66.78631 3.01278 2.37600 -65.55996 932.27530
1315.0000 -69.04463 -65.50849 3.53614 2.30744 -66.22194 898.71556
1320.0000 -69.50404 -65.85282 3.65122 2.31546 -66.14444 904.07285
1325.0000 -70.01515 -66.15465 3.86050 2.33455 -65.96014 972.46175
1330.0000 -68.89829 -65.33157 3.56671 2.30784 -66.21804 950.87341
1335.0000 -68.97326 -65.57280 3.40047 2.36440 -65.67195 972.27508
1340.0000 -70.54376 -66.84279 3.70097 2.31064 -66.19099 883.71225
1345.0000 -70.32496 -66.56991 3.75505 2.26294 -66.65153 850.57094
1350.0000 -69.08864 -65.42130 3.66734 2.33734 -65.93325 927.48851
1355.0000 -70.67034 -65.48156 5.18878 2.37928 -65.52829 987.00732
1360.0000 -67.94353 -63.52883 4.41470 2.46907 -64.66135 1067.04484
1365.0000 -68.50260 -63.50623 4.99636 2.52242 -64.14633 1078.79192
1370.0000 -68.68641 -64.98780 3.69861 2.52707 -64.10136 1107.83973
1375.0000 -68.21452 -63.76487 4.44965 2.54842 -63.89528 1123.56822
1380.0000 -68.56673 -64.60876 3.95797 2.49910 -64.37141 1050.24349
1385.0000 -68.22353 -65.42878 2.79475 2.45414 -64.80550 1000.42137
1390.0000 -69.36169 -65.13351 4.22818 2.44480 -64.89567 1086.22304
1395.0000 -68.26155 -64.33105 3.93051 2.44051 -64.93713 985.04765
1400.0000 -69.13597 -65.45504 3.68093 2.52324 -64.13835 1052.57207
1405.0000 -68.79110 -64.36129 4.42981 2.39611 -65.36581 958.19728
1410.0000 -69.39726 -64.67116 4.72610 2.50480 -64.31646 1094.15050
1415.0000 -68.33074 -63.80217 4.52856 2.52250 -64.14557 1140.13288
1420.0000 -68.00111 -64.40469 3.59642 2.48904 -64.46862 1057.52951
1425.0000 -68.64287 -65.81405 2.82882 2.45812 -64.76707 1011.09124
1430.0000 -69.49397 -66.48461 3.00936 2.34962 -65.81469 907.31794
1435.0000 -70.44791 -66.84965 3.59826 2.28375 -66.45062 898.95508
1440.0000 -70.20164 -66.47355 3.72809 2.28054 -66.48166 911.31456
1445.0000 -70.42408 -66.93532 3.48876 2.25677 -66.71109 868.17815
1450.0000 -69.69514 -66.18405 3.51109 2.25398 -66.73807 844.25280
1455.0000 -69.34748 -66.18976 3.15772 2.34920 -65.81869 911.35712
1460.0000 -68.59562 -64.57366 4.02196 2.34414 -65.86756 933.72267
1465.0000 -67.68775 -64.42286 3.26489 2.47674 -64.58731 1036.07837
1470.0000 -68.82333 -65.08929 3.73403 2.50199 -64.34353 1058.79032
1475.0000 -69.31181 -66.08214 3.22968 2.43409 -64.99914 1005.13415
1480.0000 -69.49008 -66.01521 3.47486 2.32455 -66.05668 893.94376
1485.0000 -69.35078 -66.26946 3.08131 2.30333 -66.26161 864.67222
1490.0000 -69.45209 -66.05555 3.39654 2.32112 -66.08979 889.16207
1495.0000 -68.40903 -65.87101 2.53802 2.32133 -66.08781 872.27809
1500.0000 -69.31525 -67.33953 1.97572 2.24895 -66.78666 845.45148
FREEZING PROCESS: loop number 7 T-loop= 956.00000000000000
main_MD> interactions number 7 at Temperature= 956.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 3.41363 0.15412 -0.64295
force_rgl> df(natom) -1.49219 -1.12148 0.98531
1505.0000 -69.33196 -66.95442 2.37753 2.19687 -67.28949 827.31224
1510.0000 -69.92340 -66.76024 3.16317 2.25829 -66.69644 831.33939
1515.0000 -68.48456 -65.16812 3.31644 2.30688 -66.22736 858.99067
1520.0000 -69.44301 -66.21050 3.23250 2.35458 -65.76680 906.88657
1525.0000 -70.23037 -66.81913 3.41124 2.26137 -66.66668 863.41586
1530.0000 -69.68503 -66.85994 2.82509 2.28251 -66.46258 866.63528
1535.0000 -70.09175 -66.11322 3.97853 2.30955 -66.20158 909.68588
1540.0000 -69.10429 -65.92654 3.17775 2.35946 -65.71965 938.24665
1545.0000 -70.44360 -66.78020 3.66340 2.32299 -66.07179 867.23855
1550.0000 -70.56086 -67.29007 3.27079 2.26355 -66.64570 829.07204
1555.0000 -68.93139 -65.28109 3.65031 2.33383 -65.96708 906.98005
1560.0000 -67.59035 -64.31699 3.27336 2.44929 -64.85234 1008.38634
1565.0000 -68.83436 -64.40710 4.42725 2.49404 -64.42027 1052.38198
1570.0000 -70.10326 -66.29739 3.80587 2.44025 -64.93966 968.51450
1575.0000 -70.30665 -66.19676 4.10989 2.28560 -66.43278 881.60475
1580.0000 -69.63918 -66.25241 3.38678 2.36375 -65.67820 940.00944
1585.0000 -68.80208 -65.61423 3.18785 2.32256 -66.07589 889.90906
1590.0000 -69.01472 -64.94850 4.06622 2.40627 -65.26769 908.39679
1595.0000 -68.81528 -64.34758 4.46770 2.41592 -65.17455 980.82785
1600.0000 -68.66031 -64.81620 3.84412 2.43055 -65.03328 1022.14722
1605.0000 -70.17031 -66.92043 3.24989 2.37102 -65.60804 959.40020
1610.0000 -68.88459 -65.69245 3.19214 2.33942 -65.91314 929.18444
1615.0000 -69.27055 -65.32995 3.94060 2.42272 -65.10892 987.20772
1620.0000 -70.32545 -66.34492 3.98052 2.29257 -66.36553 892.73322
1625.0000 -69.48933 -66.79460 2.69474 2.26443 -66.63720 864.77509
1630.0000 -69.93068 -66.50952 3.42116 2.26254 -66.65540 805.28174
1635.0000 -68.61150 -64.92317 3.68832 2.33367 -65.96863 899.39081
1640.0000 -68.17755 -64.73199 3.44556 2.43387 -65.00129 1026.73817
1645.0000 -69.60615 -65.81782 3.78833 2.35743 -65.73923 915.13698
1650.0000 -70.11898 -66.65353 3.46545 2.33752 -65.93147 940.10775
1655.0000 -70.36061 -67.39347 2.96714 2.23070 -66.96282 886.46751
1660.0000 -69.90211 -66.52904 3.37307 2.22576 -67.01056 855.18256
1665.0000 -68.80610 -65.76308 3.04302 2.30652 -66.23083 896.13159
1670.0000 -68.75221 -64.91787 3.83434 2.33382 -65.96723 946.61395
1675.0000 -69.10978 -65.68945 3.42032 2.41242 -65.20836 1049.49988
1680.0000 -68.28596 -64.92936 3.35660 2.40160 -65.31279 950.68758
1685.0000 -68.54265 -64.07925 4.46340 2.47731 -64.58181 1018.19928
1690.0000 -67.58769 -64.37274 3.21496 2.52810 -64.09143 1080.15452
1695.0000 -69.04687 -64.48448 4.56239 2.51055 -64.26088 1028.11897
1700.0000 -68.84166 -64.66311 4.17855 2.46564 -64.69453 1043.56583
1705.0000 -68.54367 -65.26999 3.27368 2.41915 -65.14337 1014.13418
1710.0000 -69.77791 -65.58771 4.19021 2.39564 -65.37038 979.39553
1715.0000 -69.21783 -65.47562 3.74220 2.38681 -65.45558 923.31092
1720.0000 -68.44925 -65.06164 3.38761 2.43834 -64.95807 975.28615
1725.0000 -69.25865 -64.11125 5.14740 2.47640 -64.59065 1058.13974
1730.0000 -70.40248 -66.77749 3.62498 2.41215 -65.21094 1017.60649
1735.0000 -69.40543 -65.59134 3.81410 2.29698 -66.32287 848.67148
1740.0000 -69.70464 -65.77322 3.93142 2.35341 -65.77811 907.19798
1745.0000 -69.56279 -66.06889 3.49390 2.36950 -65.62277 985.38745
1750.0000 -69.16219 -65.86983 3.29236 2.28614 -66.42760 879.79688
FREEZING PROCESS: loop number 8 T-loop= 931.00000000000000
main_MD> interactions number 8 at Temperature= 931.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.61488 -0.53859 5.21192
force_rgl> df(natom) -2.72837 -0.34079 2.31702
1755.0000 -69.28764 -64.98806 4.29958 2.39828 -65.34485 953.17956
1760.0000 -70.06238 -66.10452 3.95786 2.36479 -65.66819 976.87770
1765.0000 -68.84805 -64.96704 3.88102 2.33792 -65.92761 896.17452
1770.0000 -68.61881 -64.53814 4.08067 2.46515 -64.69928 1049.53313
1775.0000 -68.40496 -64.97125 3.43371 2.47007 -64.65175 1028.16833
1780.0000 -68.40443 -65.94927 2.45515 2.41663 -65.16773 956.91628
1785.0000 -69.66958 -66.37495 3.29463 2.32604 -66.04229 899.91834
1790.0000 -69.42135 -65.58377 3.83758 2.31137 -66.18400 851.07479
1795.0000 -69.08996 -66.20498 2.88498 2.36402 -65.67563 886.90207
1800.0000 -69.13561 -65.18850 3.94710 2.31765 -66.12335 842.34697
1805.0000 -68.81541 -64.27250 4.54292 2.49987 -64.36406 1069.93729
1810.0000 -70.21903 -67.50082 2.71821 2.31448 -66.15398 852.27727
1815.0000 -69.84654 -66.75237 3.09416 2.23285 -66.94209 807.55122
1820.0000 -69.21958 -64.99349 4.22608 2.37581 -65.56184 923.39920
1825.0000 -69.02076 -65.39395 3.62680 2.38314 -65.49104 944.37202
1830.0000 -68.68599 -64.70362 3.98237 2.41597 -65.17410 970.47937
1835.0000 -69.15604 -65.76849 3.38755 2.40042 -65.32423 916.90539
1840.0000 -69.67522 -65.80542 3.86980 2.38111 -65.51067 964.67199
1845.0000 -68.85630 -66.13937 2.71692 2.37549 -65.56491 971.38637
1850.0000 -69.41540 -65.93724 3.47816 2.29515 -66.34060 873.92367
1855.0000 -68.43811 -65.25175 3.18635 2.35427 -65.76975 926.98658
1860.0000 -68.43158 -64.77229 3.65929 2.38988 -65.42592 935.26535
1865.0000 -69.53461 -65.87127 3.66334 2.42262 -65.10990 931.54243
1870.0000 -69.66473 -66.12725 3.53748 2.34694 -65.84051 933.77268
1875.0000 -69.51610 -66.18033 3.33577 2.34952 -65.81566 944.87875
1880.0000 -68.94926 -63.62420 5.32506 2.41526 -65.18088 1002.89412
1885.0000 -69.09973 -65.98757 3.11217 2.42760 -65.06180 1006.49946
1890.0000 -70.35756 -66.86811 3.48946 2.25279 -66.74957 839.00808
1895.0000 -69.91024 -65.56330 4.34693 2.31942 -66.10623 906.43200
1900.0000 -69.27441 -65.37199 3.90242 2.38018 -65.51963 903.72537
1905.0000 -68.89095 -65.23853 3.65241 2.38121 -65.50970 941.23110
1910.0000 -69.35966 -65.44490 3.91476 2.37929 -65.52825 923.01941
1915.0000 -69.49823 -65.64902 3.84920 2.38359 -65.48669 957.31625
1920.0000 -69.07939 -66.30917 2.77021 2.33418 -65.96376 947.35112
1925.0000 -68.99533 -65.38038 3.61495 2.35141 -65.79734 866.31231
1930.0000 -69.84948 -66.10571 3.74378 2.36809 -65.63638 918.35256
1935.0000 -68.87057 -66.12260 2.74797 2.33372 -65.96822 866.63506
1940.0000 -68.98427 -65.56425 3.42001 2.35088 -65.80252 931.95777
1945.0000 -68.23548 -64.81778 3.41771 2.46610 -64.69003 1027.56653
1950.0000 -68.56694 -64.65085 3.91610 2.48992 -64.46010 1042.61778
1955.0000 -69.45940 -65.63633 3.82307 2.43201 -65.01918 929.35558
1960.0000 -70.06127 -67.11410 2.94717 2.34413 -65.86767 922.73027
1965.0000 -71.15420 -66.49705 4.65715 2.21953 -67.07069 814.31102
1970.0000 -69.09514 -65.43390 3.66123 2.33026 -66.00159 919.56971
1975.0000 -67.68428 -63.78525 3.89903 2.53882 -63.98795 1104.58583
1980.0000 -69.21339 -65.03902 4.17436 2.47434 -64.61051 1049.10354
1985.0000 -70.50387 -67.14647 3.35741 2.34671 -65.84281 857.00774
1990.0000 -70.55819 -67.30377 3.25442 2.22458 -67.02194 807.33636
1995.0000 -70.60554 -67.15932 3.44623 2.21624 -67.10247 847.16032
2000.0000 -69.84910 -65.65937 4.18973 2.28602 -66.42872 873.31644
FREEZING PROCESS: loop number 9 T-loop= 906.00000000000000
main_MD> interactions number 9 at Temperature= 906.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.66906 -0.48275 0.22714
force_rgl> df(natom) -3.28537 5.32404 -1.08604
2005.0000 -70.15656 -66.50280 3.65376 2.30975 -66.19958 890.88235
2010.0000 -69.34999 -65.69625 3.65374 2.30038 -66.29008 865.05902
2015.0000 -69.61144 -64.87967 4.73177 2.37157 -65.60278 916.67963
2020.0000 -69.49751 -65.95552 3.54199 2.37951 -65.52604 939.20625
2025.0000 -68.81032 -64.15385 4.65647 2.44770 -64.86767 1057.55676
2030.0000 -69.11117 -66.31287 2.79831 2.37147 -65.60370 986.29969
2035.0000 -69.96778 -66.46336 3.50442 2.27084 -66.57526 841.34752
2040.0000 -69.03420 -65.79161 3.24259 2.34595 -65.85013 976.98240
2045.0000 -69.59014 -67.20141 2.38873 2.28228 -66.46481 875.44929
2050.0000 -69.43395 -65.55304 3.88090 2.28615 -66.42749 904.50525
2055.0000 -69.38496 -65.66477 3.72019 2.33963 -65.91117 892.28837
2060.0000 -69.60219 -66.50895 3.09324 2.32952 -66.00871 884.83208
2065.0000 -69.22019 -65.82054 3.39964 2.40148 -65.31393 995.05349
2070.0000 -69.26040 -65.52802 3.73238 2.36561 -65.66025 906.18874
2075.0000 -69.76572 -65.41075 4.35496 2.37185 -65.60005 934.86319
2080.0000 -69.06060 -65.72699 3.33361 2.38071 -65.51449 972.32827
2085.0000 -69.90838 -66.54213 3.36624 2.31629 -66.13650 881.68974
2090.0000 -69.13422 -66.08716 3.04706 2.29427 -66.34906 905.22959
2095.0000 -68.60788 -66.14206 2.46582 2.30408 -66.25438 852.79583
2100.0000 -69.19784 -66.09333 3.10450 2.27882 -66.49827 790.42704
2105.0000 -69.87640 -65.63791 4.23849 2.32300 -66.07164 920.19362
2110.0000 -69.06127 -65.30948 3.75179 2.43527 -64.98769 999.95283
2115.0000 -69.68433 -65.05728 4.62705 2.38112 -65.51050 976.18475
2120.0000 -70.07470 -66.79895 3.27575 2.37047 -65.61335 973.39289
2125.0000 -69.39987 -66.25050 3.14937 2.30336 -66.26132 882.51142
2130.0000 -68.15283 -63.72242 4.43042 2.46162 -64.73332 1045.13603
2135.0000 -69.29581 -65.99296 3.30285 2.43980 -64.94400 975.70569
2140.0000 -68.61074 -65.58072 3.03002 2.33600 -65.94619 925.61761
2145.0000 -70.24979 -67.69778 2.55201 2.29519 -66.34015 869.67472
2150.0000 -69.88798 -66.16775 3.72023 2.26949 -66.58834 836.24041
2155.0000 -69.57747 -65.75789 3.81958 2.38388 -65.48385 883.68000
2160.0000 -69.25504 -65.70460 3.55044 2.36633 -65.65331 892.12708
2165.0000 -68.58500 -65.46349 3.12151 2.39748 -65.35256 937.09969
2170.0000 -69.31414 -66.05339 3.26075 2.31362 -66.16227 884.45260
2175.0000 -68.02639 -64.17590 3.85050 2.40149 -65.31389 965.84196
2180.0000 -68.88525 -65.31167 3.57358 2.44562 -64.88776 1012.80193
2185.0000 -69.22978 -66.55408 2.67570 2.35547 -65.75822 937.55198
2190.0000 -69.02196 -64.78561 4.23635 2.32484 -66.05389 884.57899
2195.0000 -69.67971 -66.23519 3.44452 2.41735 -65.16074 995.89356
2200.0000 -69.46620 -65.41919 4.04701 2.34444 -65.86466 880.82873
2205.0000 -70.34182 -66.30924 4.03258 2.31127 -66.18491 899.03903
2210.0000 -69.67673 -65.73851 3.93821 2.33687 -65.93781 957.41450
2215.0000 -69.41852 -65.51238 3.90614 2.37186 -65.59995 990.11712
2220.0000 -68.91652 -65.34957 3.56695 2.40385 -65.29107 984.05544
2225.0000 -68.98840 -65.58429 3.40411 2.37476 -65.57192 934.12681
2230.0000 -70.13894 -66.53980 3.59914 2.34640 -65.84578 890.57779
2235.0000 -70.30966 -66.97404 3.33562 2.25333 -66.74434 814.52168
2240.0000 -69.31606 -66.16023 3.15583 2.28339 -66.45407 853.31330
2245.0000 -69.58881 -66.13882 3.44999 2.30800 -66.21652 885.58754
2250.0000 -69.45476 -66.08622 3.36854 2.28697 -66.41957 837.12308
FREEZING PROCESS: loop number 10 T-loop= 881.00000000000000
main_MD> interactions number 10 at Temperature= 881.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.62141 2.51695 -1.69024
force_rgl> df(natom) -3.35767 1.56885 -1.32954
2255.0000 -69.60909 -66.58447 3.02462 2.29524 -66.33975 907.73286
2260.0000 -69.33534 -66.28120 3.05414 2.28627 -66.42635 891.66076
2265.0000 -69.80496 -66.50473 3.30022 2.30035 -66.29041 921.52592
2270.0000 -68.79184 -65.73943 3.05241 2.31296 -66.16862 882.91169
2275.0000 -68.50171 -64.88204 3.61967 2.40378 -65.29174 972.22496
2280.0000 -68.01394 -64.32363 3.69031 2.51445 -64.22330 997.01530
2285.0000 -69.76671 -64.66593 5.10078 2.53490 -64.02577 1137.28670
2290.0000 -68.35051 -64.72485 3.62566 2.42705 -65.06711 987.77747
2295.0000 -69.60006 -66.21407 3.38599 2.36737 -65.64329 921.19410
2300.0000 -69.70045 -66.63219 3.06826 2.30424 -66.25284 866.40017
2305.0000 -69.84510 -66.31100 3.53410 2.24641 -66.81115 838.02601
2310.0000 -67.69111 -64.33911 3.35199 2.36720 -65.64491 928.57113
2315.0000 -68.72491 -65.52478 3.20013 2.44340 -64.90927 973.64076
2320.0000 -70.13421 -66.54051 3.59370 2.31670 -66.13251 904.46164
2325.0000 -69.78783 -66.32301 3.46482 2.26276 -66.65332 857.39948
2330.0000 -70.66427 -66.63221 4.03205 2.27954 -66.49125 860.39654
2335.0000 -69.43641 -66.13262 3.30379 2.33690 -65.93745 877.87874
2340.0000 -68.35498 -65.40521 2.94977 2.39723 -65.35502 953.05410
2345.0000 -68.82225 -65.12707 3.69518 2.40291 -65.30019 977.48838
2350.0000 -68.94192 -65.18041 3.76151 2.41194 -65.21301 992.26565
2355.0000 -68.71018 -66.43915 2.27103 2.39010 -65.42382 942.91286
2360.0000 -70.34223 -66.65058 3.69165 2.26062 -66.67399 810.32835
2365.0000 -69.74507 -66.95275 2.79232 2.31447 -66.15406 924.65585
2370.0000 -69.99379 -66.85701 3.13679 2.28083 -66.47883 867.61805
2375.0000 -69.63632 -66.43106 3.20526 2.29184 -66.37251 910.22549
2380.0000 -69.01854 -65.45170 3.56684 2.31780 -66.12188 895.65099
2385.0000 -68.60546 -65.78778 2.81768 2.35573 -65.75565 940.92510
2390.0000 -68.15261 -65.08641 3.06620 2.37521 -65.56761 935.98767
2395.0000 -67.75299 -63.82641 3.92658 2.51040 -64.26232 1060.66170
2400.0000 -67.58693 -63.73381 3.85312 2.55862 -63.79683 1155.39869
2405.0000 -68.88366 -64.70647 4.17719 2.50102 -64.35289 992.54368
2410.0000 -68.03185 -65.16150 2.87036 2.47571 -64.59729 1036.75697
2415.0000 -68.77597 -65.51503 3.26094 2.42387 -65.09781 966.41266
2420.0000 -69.56874 -65.60101 3.96773 2.33820 -65.92490 932.03221
2425.0000 -70.13307 -67.24771 2.88536 2.33577 -65.94840 914.60908
2430.0000 -69.79507 -66.22122 3.57385 2.23081 -66.96175 827.97911
2435.0000 -68.59286 -65.55393 3.03892 2.32643 -66.03856 879.37076
2440.0000 -69.30090 -65.51380 3.78710 2.36337 -65.68193 930.50979
2445.0000 -69.33504 -66.12129 3.21375 2.30459 -66.24946 883.38215
2450.0000 -69.84281 -65.42927 4.41354 2.30387 -66.25634 881.80597
2455.0000 -70.19329 -67.54617 2.64712 2.27076 -66.57604 847.96587
2460.0000 -69.86136 -66.28468 3.57669 2.21759 -67.08938 795.90215
2465.0000 -69.67538 -65.76879 3.90658 2.39805 -65.34709 1024.42692
2470.0000 -70.21164 -66.87878 3.33286 2.28512 -66.43737 887.94532
2475.0000 -69.44465 -65.57614 3.86851 2.34296 -65.87902 907.92149
2480.0000 -69.10412 -66.56000 2.54412 2.29540 -66.33814 869.03579
2485.0000 -69.59194 -66.29254 3.29939 2.26909 -66.59222 855.20571
2490.0000 -69.77944 -65.82527 3.95417 2.35771 -65.73658 923.11501
2495.0000 -68.67908 -65.77243 2.90665 2.30651 -66.23085 846.42288
2500.0000 -69.16629 -66.33444 2.83185 2.27921 -66.49451 855.49085
FREEZING PROCESS: loop number 11 T-loop= 856.00000000000000
main_MD> interactions number 11 at Temperature= 856.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -2.80895 -3.15522 1.11314
force_rgl> df(natom) 1.64128 -3.26498 0.75815
2505.0000 -70.43390 -67.22639 3.20751 2.24045 -66.86869 831.33663
2510.0000 -70.78291 -67.49890 3.28401 2.22750 -66.99370 821.84616
2515.0000 -69.73209 -66.35495 3.37714 2.22612 -67.00702 829.76481
2520.0000 -70.25508 -67.35328 2.90180 2.19398 -67.31740 793.43884
2525.0000 -68.90357 -66.11540 2.78817 2.30687 -66.22744 928.71125
2530.0000 -69.02312 -65.84368 3.17943 2.34417 -65.86732 907.95483
2535.0000 -68.03601 -64.34975 3.68626 2.41487 -65.18466 988.74223
2540.0000 -70.08639 -66.05179 4.03460 2.41329 -65.19995 966.56690
2545.0000 -70.72837 -66.69812 4.03025 2.32518 -66.05061 889.78525
2550.0000 -69.57837 -67.04445 2.53392 2.24060 -66.86720 819.26993
2555.0000 -69.25796 -65.91198 3.34598 2.28819 -66.40773 880.40960
2560.0000 -70.33494 -66.63184 3.70310 2.26020 -66.67797 831.73431
2565.0000 -70.13379 -66.54787 3.58592 2.28249 -66.46282 833.74739
2570.0000 -69.08835 -65.54942 3.53893 2.25488 -66.72933 845.66651
2575.0000 -68.67702 -65.07716 3.59987 2.32929 -66.01096 894.01443
2580.0000 -70.23447 -66.32472 3.90975 2.36146 -65.70036 930.15531
2585.0000 -70.64947 -66.75099 3.89848 2.32851 -66.01844 891.45247
2590.0000 -69.32963 -66.02263 3.30700 2.30011 -66.29269 919.33948
2595.0000 -70.22903 -67.08468 3.14435 2.24653 -66.81001 851.31042
2600.0000 -70.35240 -66.13701 4.21539 2.16415 -67.60537 832.10636
2605.0000 -69.39576 -64.67921 4.71655 2.43297 -65.00998 1000.66562
2610.0000 -69.23817 -66.45725 2.78092 2.36133 -65.70158 901.21922
2615.0000 -68.59240 -65.30101 3.29140 2.31910 -66.10933 883.29359
2620.0000 -68.49761 -66.00508 2.49254 2.41078 -65.22413 926.22317
2625.0000 -70.12691 -66.49339 3.63352 2.29918 -66.30167 912.76905
2630.0000 -70.48376 -67.50226 2.98150 2.24764 -66.79927 820.67241
2635.0000 -70.21187 -65.56549 4.64638 2.28087 -66.47840 889.71565
2640.0000 -69.40290 -67.11611 2.28680 2.27949 -66.49181 856.12588
2645.0000 -69.74764 -66.04858 3.69906 2.26601 -66.62188 819.19166
2650.0000 -70.64694 -68.00385 2.64309 2.24928 -66.78340 824.02283
2655.0000 -70.29624 -68.43479 1.86145 2.12216 -68.01077 749.57433
2660.0000 -70.42208 -67.10260 3.31948 2.20411 -67.21950 819.02448
2665.0000 -69.66067 -66.69134 2.96933 2.27510 -66.53411 868.36805
2670.0000 -70.56107 -66.69232 3.86874 2.25058 -66.77092 843.67258
2675.0000 -69.66153 -66.43483 3.22671 2.24436 -66.83095 818.46255
2680.0000 -69.89855 -66.35684 3.54172 2.28969 -66.39329 866.66464
2685.0000 -70.05820 -67.23055 2.82765 2.22045 -67.06181 765.49797
2690.0000 -70.49856 -67.41550 3.08306 2.18142 -67.43857 785.49709
2695.0000 -70.32238 -67.66114 2.66124 2.14451 -67.79501 765.26481
2700.0000 -70.51664 -66.76356 3.75308 2.26029 -66.67711 871.77827
2705.0000 -70.14983 -66.46139 3.68845 2.25723 -66.70673 855.01654
2710.0000 -70.70374 -67.01485 3.68890 2.27996 -66.48724 887.15424
2715.0000 -70.49413 -66.88410 3.61003 2.28961 -66.39405 885.45769
2720.0000 -69.95753 -66.65532 3.30220 2.20015 -67.25775 799.88257
2725.0000 -69.32190 -65.47557 3.84633 2.31970 -66.10358 912.92105
2730.0000 -69.83032 -66.45148 3.37883 2.33285 -65.97661 900.83573
2735.0000 -70.45595 -67.28746 3.16849 2.22642 -67.00417 787.53469
2740.0000 -70.32549 -67.23466 3.09083 2.23377 -66.93317 829.18219
2745.0000 -69.32672 -66.53848 2.78824 2.25573 -66.72116 830.51248
2750.0000 -69.56559 -65.50895 4.05665 2.31907 -66.10958 873.67908
FREEZING PROCESS: loop number 12 T-loop= 831.00000000000000
main_MD> interactions number 12 at Temperature= 831.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.23112 3.44096 -4.80877
force_rgl> df(natom) -0.80338 2.55821 0.31647
2755.0000 -69.26798 -64.45558 4.81240 2.42934 -65.04494 967.97294
2760.0000 -70.11828 -66.42002 3.69826 2.38199 -65.50217 915.98763
2765.0000 -70.56892 -67.23624 3.33268 2.24553 -66.81966 864.09219
2770.0000 -69.91806 -66.52682 3.39124 2.22791 -66.98972 814.96968
2775.0000 -70.58290 -68.02747 2.55542 2.17341 -67.51596 751.66623
2780.0000 -71.08755 -67.77207 3.31548 2.16648 -67.58291 765.40934
2785.0000 -69.82452 -67.22834 2.59619 2.16322 -67.61433 761.09405
2790.0000 -70.73756 -66.47510 4.26246 2.26399 -66.64139 857.01555
2795.0000 -69.23489 -65.82018 3.41471 2.28555 -66.43323 953.94138
2800.0000 -70.68594 -66.79613 3.88982 2.31960 -66.10449 931.74926
2805.0000 -71.25747 -68.21015 3.04732 2.14711 -67.76985 738.79345
2810.0000 -70.69260 -68.04774 2.64487 2.08315 -68.38738 679.63627
2815.0000 -72.07198 -68.87943 3.19255 2.04000 -68.80398 671.66798
2820.0000 -71.11007 -68.70011 2.40995 2.05575 -68.65191 710.17589
2825.0000 -71.43916 -68.08507 3.35409 2.13990 -67.83951 773.57509
2830.0000 -71.10141 -67.71656 3.38485 2.16468 -67.60027 798.64774
2835.0000 -70.65220 -67.36578 3.28642 2.12270 -68.00560 730.19856
2840.0000 -70.33372 -67.88246 2.45125 2.10786 -68.14879 704.43430
2845.0000 -70.38826 -67.13574 3.25251 2.18177 -67.43527 830.11421
2850.0000 -70.21150 -66.82034 3.39116 2.21038 -67.15898 850.25229
2855.0000 -70.21183 -67.48295 2.72888 2.22529 -67.01510 827.92259
2860.0000 -70.92026 -66.89475 4.02551 2.18388 -67.41484 794.89797
2865.0000 -70.69817 -67.31715 3.38102 2.22837 -66.98534 867.79934
2870.0000 -70.09410 -66.58913 3.50497 2.26756 -66.60695 841.07380
2875.0000 -69.78708 -66.75014 3.03694 2.26129 -66.66752 825.87006
2880.0000 -69.69917 -66.33405 3.36513 2.28822 -66.40751 842.44405
2885.0000 -69.97827 -67.42752 2.55075 2.23380 -66.93287 838.64393
2890.0000 -69.26584 -66.28038 2.98547 2.21481 -67.11622 837.78865
2895.0000 -70.35912 -66.08577 4.27335 2.35708 -65.74262 951.97159
2900.0000 -69.21887 -66.36851 2.85036 2.30592 -66.23659 905.61705
2905.0000 -69.77458 -66.19415 3.58043 2.30043 -66.28962 879.85362
2910.0000 -70.18515 -66.73887 3.44628 2.30550 -66.24069 897.54211
2915.0000 -70.63587 -66.87136 3.76451 2.23599 -66.91174 824.09944
2920.0000 -69.48592 -65.84738 3.63854 2.31977 -66.10287 908.46228
2925.0000 -68.70089 -65.28707 3.41382 2.34058 -65.90196 909.38762
2930.0000 -69.28606 -65.50032 3.78574 2.33563 -65.94973 917.01643
2935.0000 -70.22230 -67.03153 3.19077 2.31924 -66.10798 893.78625
2940.0000 -69.99406 -66.78678 3.20728 2.28273 -66.46048 908.34847
2945.0000 -70.02989 -67.23655 2.79333 2.19902 -67.26870 837.91682
2950.0000 -69.69870 -66.64147 3.05723 2.20138 -67.24588 804.44369
2955.0000 -69.86367 -66.39363 3.47004 2.24038 -66.86942 828.77914
2960.0000 -70.85624 -68.11834 2.73790 2.13748 -67.86285 735.28714
2965.0000 -69.85486 -66.85829 2.99657 2.19330 -67.32393 783.76258
2970.0000 -69.67046 -66.44061 3.22984 2.22395 -67.02804 777.38622
2975.0000 -70.11958 -67.37460 2.74497 2.24002 -66.87281 780.78550
2980.0000 -71.37026 -67.44933 3.92092 2.15944 -67.65088 718.34765
2985.0000 -69.99486 -67.28121 2.71366 2.19479 -67.30955 776.23644
2990.0000 -69.67461 -66.81171 2.86290 2.20612 -67.20015 791.27430
2995.0000 -70.58980 -66.83079 3.75902 2.20606 -67.20074 811.73651
3000.0000 -70.07467 -67.37515 2.69952 2.22798 -66.98909 839.15287
FREEZING PROCESS: loop number 13 T-loop= 806.00000000000000
main_MD> interactions number 13 at Temperature= 806.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.21114 -2.44444 1.57330
force_rgl> df(natom) -2.04145 -0.83656 0.12069
3005.0000 -69.35418 -66.19021 3.16397 2.31640 -66.13543 936.87817
3010.0000 -70.08033 -66.99583 3.08449 2.26524 -66.62939 819.62883
3015.0000 -70.68975 -66.84095 3.84880 2.27743 -66.51169 881.53900
3020.0000 -70.87144 -68.21342 2.65803 2.18298 -67.42360 799.59157
3025.0000 -70.17027 -67.38810 2.78217 2.15947 -67.65050 767.72414
3030.0000 -70.63421 -68.26421 2.37000 2.08307 -68.38822 705.33106
3035.0000 -70.27074 -66.63303 3.63771 2.13008 -67.93431 736.31401
3040.0000 -70.16743 -67.39965 2.76778 2.22022 -67.06402 781.79216
3045.0000 -70.42419 -67.35578 3.06840 2.18350 -67.41851 739.54945
3050.0000 -70.09398 -67.51214 2.58184 2.17482 -67.50235 746.48983
3055.0000 -70.56557 -66.74964 3.81594 2.22716 -66.99697 817.64816
3060.0000 -68.93193 -66.67406 2.25787 2.19844 -67.27426 785.98357
3065.0000 -70.37119 -67.00466 3.36652 2.23028 -66.96691 804.25499
3070.0000 -70.50195 -67.66458 2.83737 2.20589 -67.20237 781.56091
3075.0000 -71.33930 -68.70830 2.63100 2.14892 -67.75240 789.65149
3080.0000 -70.01174 -66.49462 3.51712 2.17518 -67.49884 794.70900
3085.0000 -69.65781 -66.67434 2.98347 2.28030 -66.48398 848.91208
3090.0000 -70.50512 -67.27688 3.22823 2.22420 -67.02562 807.13778
3095.0000 -70.39702 -66.76340 3.63362 2.23722 -66.89985 843.24297
3100.0000 -70.34996 -67.01971 3.33025 2.22827 -66.98625 837.50446
3105.0000 -71.67857 -68.82372 2.85484 2.08916 -68.32942 729.12200
3110.0000 -70.99529 -68.11664 2.87865 2.08686 -68.35157 697.11891
3115.0000 -69.85223 -66.47645 3.37578 2.18355 -67.41807 764.25005
3120.0000 -71.03046 -68.72664 2.30382 2.15653 -67.67889 775.63391
3125.0000 -70.32757 -67.17773 3.14984 2.16726 -67.57538 770.66086
3130.0000 -71.63948 -68.19990 3.43958 2.10524 -68.17415 741.04180
3135.0000 -70.72354 -67.70870 3.01484 2.15451 -67.69847 823.32093
3140.0000 -70.74802 -66.54279 4.20523 2.21374 -67.12653 815.13676
3145.0000 -69.25685 -65.84736 3.40949 2.30183 -66.27605 857.50784
3150.0000 -70.43897 -66.42501 4.01396 2.31372 -66.16125 923.58023
3155.0000 -70.33559 -67.75690 2.57869 2.20883 -67.17396 782.05750
3160.0000 -70.38383 -67.03915 3.34468 2.17213 -67.52830 737.89565
3165.0000 -70.01246 -66.50119 3.51126 2.27605 -66.52501 869.38161
3170.0000 -69.75033 -67.23819 2.51215 2.19394 -67.31775 779.09587
3175.0000 -69.37669 -66.38346 2.99323 2.26723 -66.61013 832.58157
3180.0000 -70.14841 -66.76810 3.38032 2.27060 -66.57760 824.53601
3185.0000 -69.97990 -67.08147 2.89843 2.28027 -66.48428 840.90650
3190.0000 -68.77864 -66.17507 2.60357 2.26256 -66.65521 824.45221
3195.0000 -70.46843 -67.32041 3.14802 2.22944 -66.97502 772.95435
3200.0000 -71.07907 -68.16127 2.91780 2.13942 -67.84416 717.88659
3205.0000 -70.02835 -67.27687 2.75148 2.14806 -67.76071 759.76236
3210.0000 -70.73099 -67.72015 3.01084 2.23887 -66.88392 830.20079
3215.0000 -71.10415 -68.53844 2.56571 2.14934 -67.74831 743.21032
3220.0000 -71.63637 -68.09998 3.53639 2.09863 -68.23793 700.97647
3225.0000 -71.23026 -68.47106 2.75920 2.07428 -68.47305 694.73547
3230.0000 -71.32220 -68.35880 2.96340 2.12920 -67.94276 768.97475
3235.0000 -70.55842 -67.40673 3.15169 2.11702 -68.06039 716.16460
3240.0000 -69.11433 -66.64036 2.47398 2.29021 -66.38826 858.72798
3245.0000 -70.38584 -67.14662 3.23921 2.25324 -66.74520 841.54043
3250.0000 -70.88726 -67.53438 3.35288 2.22632 -67.00516 861.76632
FREEZING PROCESS: loop number 14 T-loop= 781.00000000000000
main_MD> interactions number 14 at Temperature= 781.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 4.34805 0.70300 2.97761
force_rgl> df(natom) 2.94093 -2.75916 -0.96146
3255.0000 -69.69675 -66.47182 3.22493 2.28566 -66.43220 864.46987
3260.0000 -70.39844 -67.45305 2.94539 2.29694 -66.32328 873.34516
3265.0000 -70.95937 -67.77164 3.18773 2.17582 -67.49265 814.36490
3270.0000 -71.02200 -68.46534 2.55666 2.11489 -68.08097 672.39056
3275.0000 -70.65025 -67.51780 3.13245 2.14455 -67.79456 755.59377
3280.0000 -69.94461 -67.40097 2.54364 2.21539 -67.11069 787.53084
3285.0000 -70.07721 -66.54099 3.53622 2.23109 -66.95903 742.99733
3290.0000 -70.06228 -67.31321 2.74907 2.19175 -67.33891 802.97580
3295.0000 -70.55694 -68.03656 2.52038 2.15729 -67.67163 698.16846
3300.0000 -70.61765 -68.49233 2.12532 2.11474 -68.08244 664.06454
3305.0000 -70.25726 -67.46647 2.79079 2.18145 -67.43830 735.24620
3310.0000 -70.03043 -67.25762 2.77281 2.13852 -67.85285 713.42958
3315.0000 -70.95124 -68.20284 2.74840 2.14555 -67.78491 735.53776
3320.0000 -70.17662 -67.45294 2.72368 2.20238 -67.23626 816.33607
3325.0000 -70.93530 -68.70552 2.22978 2.15919 -67.65328 725.45140
3330.0000 -70.80441 -67.86145 2.94296 2.10776 -68.14980 704.84121
3335.0000 -70.56395 -67.96692 2.59703 2.13718 -67.86576 748.87323
3340.0000 -69.81342 -67.39119 2.42223 2.15034 -67.73868 706.67081
3345.0000 -70.07783 -67.20242 2.87541 2.20102 -67.24943 793.56780
3350.0000 -70.33602 -67.09915 3.23687 2.19796 -67.27889 795.35622
3355.0000 -69.65088 -66.63409 3.01679 2.31010 -66.19622 900.40503
3360.0000 -69.86137 -66.93197 2.92940 2.25024 -66.77417 837.28760
3365.0000 -70.88276 -68.28809 2.59468 2.13477 -67.88898 746.90232
3370.0000 -70.12190 -67.46892 2.65298 2.17237 -67.52604 762.06062
3375.0000 -70.12049 -66.65126 3.46923 2.14868 -67.75473 776.70069
3380.0000 -69.49680 -66.69013 2.80667 2.26470 -66.63459 840.72417
3385.0000 -70.90185 -67.58376 3.31808 2.22405 -67.02699 815.98373
3390.0000 -71.10574 -68.41105 2.69469 2.11360 -68.09345 703.37250
3395.0000 -69.83488 -67.07320 2.76168 2.16488 -67.59834 763.36391
3400.0000 -70.83477 -67.87793 2.95685 2.16944 -67.55425 784.11115
3405.0000 -71.70732 -68.55971 3.14761 2.14375 -67.80233 757.00725
3410.0000 -70.73674 -67.13436 3.60238 2.13078 -67.92751 752.85237
3415.0000 -71.22789 -68.46976 2.75812 2.14472 -67.79296 771.21884
3420.0000 -71.34458 -68.67165 2.67292 2.07306 -68.48479 694.34627
3425.0000 -70.27745 -67.21184 3.06561 2.14333 -67.80639 757.17333
3430.0000 -70.63188 -67.62884 3.00304 2.12817 -67.95272 757.93361
3435.0000 -70.12779 -66.87604 3.25175 2.17164 -67.53306 759.15899
3440.0000 -69.94132 -66.64301 3.29831 2.21581 -67.10659 846.32275
3445.0000 -69.50023 -65.48901 4.01122 2.27017 -66.58171 894.26269
3450.0000 -69.08888 -65.07167 4.01721 2.38403 -65.48245 931.31903
3455.0000 -70.27125 -67.29312 2.97813 2.24751 -66.80057 803.88280
3460.0000 -71.32579 -67.71354 3.61225 2.15386 -67.70474 779.48156
3465.0000 -71.31202 -69.35455 1.95747 2.05842 -68.62613 683.55253
3470.0000 -71.75757 -69.43463 2.32295 1.98810 -69.30512 620.54437
3475.0000 -70.77564 -68.34567 2.42996 2.05306 -68.67796 681.05237
3480.0000 -70.23369 -67.63642 2.59727 2.14483 -67.79187 763.89275
3485.0000 -69.93461 -66.67919 3.25542 2.19475 -67.30996 799.22849
3490.0000 -70.66487 -67.40624 3.25863 2.24152 -66.85839 813.67989
3495.0000 -70.54896 -67.37907 3.16990 2.14919 -67.74983 742.62971
3500.0000 -71.06477 -68.57356 2.49121 2.11221 -68.10681 711.89797
FREEZING PROCESS: loop number 15 T-loop= 756.00000000000000
main_MD> interactions number 15 at Temperature= 756.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.62844 -0.31887 0.70139
force_rgl> df(natom) -5.58790 -2.90376 -0.85941
3505.0000 -70.83497 -67.71845 3.11652 2.11696 -68.06093 722.09709
3510.0000 -70.56427 -68.01871 2.54556 2.09202 -68.30173 689.65972
3515.0000 -70.25498 -68.14767 2.10732 2.13114 -67.92405 741.97835
3520.0000 -70.73309 -67.43421 3.29888 2.13544 -67.88255 707.71101
3525.0000 -70.29131 -66.64001 3.65130 2.23500 -66.92134 859.61156
3530.0000 -70.51620 -66.77096 3.74524 2.22737 -66.99498 835.45452
3535.0000 -70.32910 -67.06552 3.26358 2.23477 -66.92353 845.09922
3540.0000 -71.17463 -68.46448 2.71015 2.12343 -67.99853 729.06766
3545.0000 -71.22106 -67.88513 3.33593 2.11230 -68.10601 710.34637
3550.0000 -69.26127 -66.73450 2.52677 2.14993 -67.74267 729.07827
3555.0000 -70.04481 -67.16169 2.88311 2.23992 -66.87378 840.98302
3560.0000 -70.82800 -68.39283 2.43517 2.12653 -67.96859 712.19327
3565.0000 -70.96732 -67.66739 3.29993 2.20509 -67.21011 811.56505
3570.0000 -70.26996 -67.47604 2.79393 2.12485 -67.98479 732.12593
3575.0000 -69.83744 -66.84124 2.99620 2.27245 -66.55971 854.31845
3580.0000 -69.49314 -66.31475 3.17839 2.27653 -66.52032 857.12897
3585.0000 -70.88511 -67.14768 3.73743 2.20628 -67.19857 826.00664
3590.0000 -70.83429 -68.40470 2.42959 2.18472 -67.40675 788.56479
3595.0000 -71.05454 -68.51842 2.53612 2.06278 -68.58409 688.95538
3600.0000 -70.94301 -68.47889 2.46412 2.03633 -68.83940 668.24006
3605.0000 -70.77453 -67.60630 3.16823 2.15239 -67.71892 795.34607
3610.0000 -70.27891 -66.96716 3.31175 2.17060 -67.54310 787.18366
3615.0000 -70.29588 -67.59254 2.70334 2.25879 -66.69164 829.20701
3620.0000 -70.44340 -68.03961 2.40378 2.12198 -68.01247 692.16931
3625.0000 -69.95753 -67.24728 2.71025 2.18205 -67.43257 776.08142
3630.0000 -70.94777 -68.52240 2.42537 2.10170 -68.20835 675.47525
3635.0000 -71.21384 -68.56638 2.64746 2.03835 -68.81992 619.88824
3640.0000 -70.44675 -68.08350 2.36325 2.07769 -68.44009 671.86328
3645.0000 -70.57296 -67.30810 3.26486 2.10277 -68.19796 729.49438
3650.0000 -69.83976 -67.20048 2.63929 2.22220 -67.04487 785.76439
3655.0000 -70.05360 -66.73022 3.32338 2.23945 -66.87833 812.00012
3660.0000 -71.30012 -67.84446 3.45566 2.20087 -67.25084 790.86735
3665.0000 -71.84829 -68.72923 3.11906 2.11515 -68.07847 727.67452
3670.0000 -70.21125 -67.94900 2.26225 2.13068 -67.92848 709.62109
3675.0000 -70.73086 -68.13944 2.59142 2.12719 -67.96223 682.45742
3680.0000 -70.61609 -68.31171 2.30438 2.11451 -68.08462 728.79920
3685.0000 -71.48517 -68.36432 3.12085 2.09728 -68.25102 720.94785
3690.0000 -70.66002 -68.19907 2.46095 2.12228 -68.00959 749.13821
3695.0000 -70.25563 -67.78160 2.47403 2.14487 -67.79147 780.64811
3700.0000 -70.92549 -68.69210 2.23340 2.11076 -68.12081 709.39954
3705.0000 -70.58294 -68.54747 2.03547 2.07492 -68.46685 640.52485
3710.0000 -70.55359 -67.60425 2.94933 2.13561 -67.88094 736.58725
3715.0000 -69.76302 -66.76867 2.99435 2.16957 -67.55300 788.40877
3720.0000 -70.06474 -65.96883 4.09591 2.25505 -66.72777 825.21917
3725.0000 -70.63960 -67.46080 3.17881 2.24456 -66.82901 816.17516
3730.0000 -70.94272 -67.96177 2.98095 2.16143 -67.63160 760.89712
3735.0000 -70.54797 -67.92701 2.62095 2.10250 -68.20059 695.39896
3740.0000 -70.58940 -66.99110 3.59829 2.21204 -67.14294 818.69848
3745.0000 -70.27752 -67.16069 3.11682 2.20698 -67.19186 774.39058
3750.0000 -71.12937 -68.07461 3.05476 2.19945 -67.26455 806.61542
FREEZING PROCESS: loop number 16 T-loop= 731.00000000000000
main_MD> interactions number 16 at Temperature= 731.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.07392 -1.18808 -0.68540
force_rgl> df(natom) -6.68128 -0.02474 2.39744
3755.0000 -70.32590 -66.89397 3.43193 2.14572 -67.78330 732.45143
3760.0000 -70.51117 -67.58397 2.92720 2.19086 -67.34748 776.47509
3765.0000 -69.85186 -67.26046 2.59140 2.18924 -67.36311 782.43018
3770.0000 -70.17065 -66.86516 3.30550 2.20537 -67.20736 808.56632
3775.0000 -70.49690 -66.63630 3.86061 2.21882 -67.07755 794.70306
3780.0000 -70.55177 -67.25431 3.29747 2.22233 -67.04363 821.97295
3785.0000 -70.42394 -67.33967 3.08427 2.25937 -66.68605 856.66881
3790.0000 -70.86137 -67.21160 3.64976 2.22054 -67.06088 789.64365
3795.0000 -69.85792 -66.93735 2.92057 2.22603 -67.00795 849.23953
3800.0000 -71.43177 -68.12916 3.30260 2.13703 -67.86719 740.27286
3805.0000 -71.27397 -67.85067 3.42329 2.10212 -68.20426 704.96089
3810.0000 -69.63174 -66.99144 2.64030 2.18831 -67.37208 763.86547
3815.0000 -69.71533 -66.00119 3.71414 2.24364 -66.83792 821.63465
3820.0000 -69.51189 -66.44696 3.06493 2.23211 -66.94924 862.51570
3825.0000 -71.26752 -68.59466 2.67286 2.10408 -68.18538 719.16066
3830.0000 -71.51683 -68.34041 3.17642 2.05064 -68.70131 669.93848
3835.0000 -70.31027 -67.26876 3.04151 2.17668 -67.48441 756.49385
3840.0000 -70.08750 -66.40436 3.68314 2.27184 -66.56564 840.74760
3845.0000 -70.60394 -67.89287 2.71107 2.22663 -67.00210 784.78365
3850.0000 -70.28793 -67.34440 2.94354 2.17493 -67.50126 766.91952
3855.0000 -70.64629 -66.85266 3.79363 2.21955 -67.07046 801.47597
3860.0000 -69.80486 -66.89701 2.90786 2.25170 -66.76005 880.68626
3865.0000 -70.47463 -67.81924 2.65539 2.16034 -67.64216 731.86873
3870.0000 -70.67664 -67.95495 2.72169 2.11861 -68.04504 724.23244
3875.0000 -71.15304 -68.01937 3.13367 2.16099 -67.63590 782.64087
3880.0000 -70.87239 -68.40517 2.46722 2.14377 -67.80208 749.91927
3885.0000 -71.20764 -68.35246 2.85519 2.08410 -68.37825 637.33796
3890.0000 -71.66165 -69.15355 2.50810 2.01792 -69.01716 629.11147
3895.0000 -71.95920 -69.57225 2.38695 2.01634 -69.03248 652.29434
3900.0000 -71.68992 -69.50577 2.18415 1.99786 -69.21090 634.47231
3905.0000 -71.32462 -69.29652 2.02810 1.99805 -69.20905 620.46043
3910.0000 -71.86510 -67.63660 4.22849 2.04630 -68.74318 678.07613
3915.0000 -70.95853 -67.83132 3.12722 2.15543 -67.68959 775.41291
3920.0000 -70.10106 -68.00728 2.09379 2.13499 -67.88686 736.90200
3925.0000 -70.75305 -67.92742 2.82562 2.17404 -67.50990 787.65424
3930.0000 -70.77072 -67.73137 3.03935 2.15456 -67.69797 779.89341
3935.0000 -71.43862 -68.88967 2.54895 2.09443 -68.27854 682.53635
3940.0000 -70.70833 -68.26708 2.44125 2.08258 -68.39288 675.42287
3945.0000 -70.75969 -67.72829 3.03140 2.10169 -68.20845 706.21935
3950.0000 -70.19796 -67.98625 2.21171 2.11118 -68.11682 691.62226
3955.0000 -70.93782 -68.38957 2.54824 2.14876 -67.75399 778.84696
3960.0000 -69.93714 -67.46884 2.46831 2.09844 -68.23981 727.41140
3965.0000 -71.47615 -68.12069 3.35546 2.06243 -68.58744 657.41298
3970.0000 -70.81151 -67.38112 3.43039 2.11912 -68.04010 728.31529
3975.0000 -68.94688 -66.29910 2.64778 2.21261 -67.13753 774.72174
3980.0000 -70.06610 -67.11222 2.95388 2.22425 -67.02509 789.80827
3985.0000 -70.24256 -67.41375 2.82881 2.19783 -67.28018 814.56256
3990.0000 -71.09668 -67.65196 3.44472 2.17848 -67.46697 786.15433
3995.0000 -70.66238 -67.11996 3.54242 2.15176 -67.72498 798.75036
4000.0000 -70.04563 -67.87899 2.16664 2.17210 -67.52856 738.06095
FREEZING PROCESS: loop number 17 T-loop= 706.00000000000000
main_MD> interactions number 17 at Temperature= 706.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.61048 6.09877 -0.29973
force_rgl> df(natom) -0.56640 1.54275 -1.04179
4005.0000 -70.42879 -67.81063 2.61816 2.16347 -67.61193 748.87235
4010.0000 -70.56808 -67.19990 3.36817 2.15550 -67.68892 720.17423
4015.0000 -70.22832 -67.57711 2.65120 2.18225 -67.43059 767.50888
4020.0000 -71.46790 -68.44959 3.01832 2.11602 -68.07008 716.17501
4025.0000 -70.85544 -68.34685 2.50860 2.12039 -68.02790 703.45186
4030.0000 -70.93856 -68.12100 2.81756 2.07614 -68.45511 693.67857
4035.0000 -71.17684 -68.45780 2.71904 2.15685 -67.67583 753.61655
4040.0000 -70.91804 -67.85651 3.06153 2.15213 -67.72138 735.89866
4045.0000 -70.70746 -68.27558 2.43188 2.11390 -68.09049 727.02517
4050.0000 -70.25710 -68.05938 2.19772 2.09178 -68.30405 696.38932
4055.0000 -70.26949 -67.60908 2.66041 2.14434 -67.79663 734.34687
4060.0000 -70.72848 -68.46328 2.26520 2.09365 -68.28601 696.72461
4065.0000 -70.61478 -67.77970 2.83508 2.09257 -68.29649 722.97276
4070.0000 -71.25351 -68.41694 2.83657 2.12668 -67.96713 760.12731
4075.0000 -71.84387 -69.16600 2.67787 2.01499 -69.04553 663.00343
4080.0000 -70.33249 -68.57532 1.75717 2.00686 -69.12397 668.69533
4085.0000 -71.06551 -68.07533 2.99018 2.07792 -68.43794 712.25950
4090.0000 -71.52064 -68.95482 2.56582 2.05472 -68.66194 679.81279
4095.0000 -71.34168 -68.64553 2.69615 2.02414 -68.95716 603.46728
4100.0000 -70.31596 -67.56937 2.74659 2.07603 -68.45615 664.56122
4105.0000 -70.97466 -68.46633 2.50833 2.12685 -67.96545 716.67962
4110.0000 -71.28063 -67.99595 3.28468 2.09289 -68.29341 677.10751
4115.0000 -71.00467 -68.48925 2.51542 2.09825 -68.24159 722.51554
4120.0000 -70.72893 -67.72764 3.00130 2.11762 -68.05456 745.97413
4125.0000 -71.09103 -67.73873 3.35230 2.15361 -67.70709 780.32334
4130.0000 -70.50605 -67.64661 2.85944 2.15323 -67.71077 738.91963
4135.0000 -70.20331 -67.53267 2.67064 2.12803 -67.95407 765.94040
4140.0000 -70.42212 -67.52520 2.89692 2.11825 -68.04848 751.52879
4145.0000 -69.89455 -66.69357 3.20099 2.16818 -67.56644 785.27697
4150.0000 -70.56853 -67.51053 3.05801 2.20460 -67.21480 805.37509
4155.0000 -70.95735 -68.05414 2.90321 2.15165 -67.72604 709.02073
4160.0000 -70.67244 -66.82532 3.84713 2.17222 -67.52742 762.29499
4165.0000 -70.75779 -67.17390 3.58389 2.21632 -67.10164 837.53930
4170.0000 -70.13224 -68.12532 2.00692 2.11477 -68.08214 701.37386
4175.0000 -71.12860 -68.42589 2.70271 2.11550 -68.07511 702.78050
4180.0000 -70.72654 -67.79569 2.93085 2.10116 -68.21348 704.01493
4185.0000 -71.02205 -68.81301 2.20903 2.14435 -67.79655 735.92009
4190.0000 -71.03705 -68.63283 2.40421 2.08764 -68.34401 704.15459
4195.0000 -71.75514 -69.81761 1.93753 2.01949 -69.00206 617.93056
4200.0000 -70.90953 -68.52732 2.38221 2.02671 -68.93232 607.02080
4205.0000 -70.71822 -67.50958 3.20863 2.13412 -67.89528 694.92052
4210.0000 -71.18033 -69.00515 2.17518 2.13777 -67.86003 735.13750
4215.0000 -71.96974 -68.56461 3.40513 2.08466 -68.37282 720.02715
4220.0000 -70.21873 -66.86971 3.34901 2.15929 -67.65230 800.52591
4225.0000 -70.00682 -67.05560 2.95122 2.24829 -66.79304 834.68568
4230.0000 -70.08698 -67.67064 2.41634 2.18001 -67.45222 779.85545
4235.0000 -71.06848 -68.70223 2.36625 2.10935 -68.13445 747.21539
4240.0000 -70.66208 -68.02183 2.64025 2.04671 -68.73922 670.79255
4245.0000 -71.27519 -68.61934 2.65585 2.13625 -67.87474 759.57861
4250.0000 -71.42287 -69.40459 2.01828 1.99495 -69.23897 631.16468
FREEZING PROCESS: loop number 18 T-loop= 681.00000000000000
main_MD> interactions number 18 at Temperature= 681.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.89538 0.21776 0.00147
force_rgl> df(natom) 1.86582 0.13034 -1.97953
4255.0000 -71.91790 -69.31707 2.60083 1.98378 -69.34682 650.17739
4260.0000 -71.12701 -69.06803 2.05898 1.99663 -69.22275 631.91068
4265.0000 -72.37023 -70.16844 2.20179 1.90297 -70.12706 520.13931
4270.0000 -71.56441 -69.07244 2.49198 1.93969 -69.77245 564.23572
4275.0000 -71.94752 -69.00094 2.94658 2.02902 -68.91002 652.45410
4280.0000 -72.06687 -69.08671 2.98017 1.98066 -69.37692 593.43183
4285.0000 -70.96505 -69.19737 1.76769 2.01205 -69.07385 575.63019
4290.0000 -70.68451 -68.43330 2.25122 2.03493 -68.85296 655.04627
4295.0000 -71.26873 -69.37417 1.89456 2.00146 -69.17612 620.21964
4300.0000 -71.56011 -68.46846 3.09165 2.03698 -68.83317 690.00464
4305.0000 -71.44961 -68.00749 3.44212 2.14281 -67.81138 777.94225
4310.0000 -71.33497 -69.00555 2.32942 2.08522 -68.36744 696.03137
4315.0000 -71.62501 -69.28299 2.34202 1.99350 -69.25302 615.07493
4320.0000 -71.65443 -69.13729 2.51714 2.01553 -69.04031 624.30914
4325.0000 -71.77315 -68.75665 3.01650 2.02512 -68.94767 631.00805
4330.0000 -71.18179 -68.42963 2.75216 2.09070 -68.31455 707.75583
4335.0000 -71.02523 -68.70907 2.31615 2.07313 -68.48417 681.31350
4340.0000 -71.34912 -69.14482 2.20430 2.05137 -68.69423 630.36766
4345.0000 -71.80629 -67.98463 3.82166 2.08369 -68.38220 675.95700
4350.0000 -71.57648 -68.86306 2.71342 2.06381 -68.57417 710.56827
4355.0000 -72.39699 -69.53003 2.86696 2.00689 -69.12368 635.51210
4360.0000 -71.77574 -69.12599 2.64975 1.95979 -69.57844 567.21302
4365.0000 -71.63660 -69.54024 2.09636 1.97697 -69.41253 622.33317
4370.0000 -71.88786 -69.83823 2.04963 1.96510 -69.52713 592.38272
4375.0000 -70.92502 -69.26128 1.66374 1.97162 -69.46417 599.01882
4380.0000 -72.07997 -69.31980 2.76016 1.96466 -69.53139 566.07896
4385.0000 -71.61496 -69.15807 2.45689 1.99943 -69.19569 658.71333
4390.0000 -71.59571 -69.24264 2.35307 1.99636 -69.22536 631.22289
4395.0000 -70.87229 -68.10972 2.76257 2.08249 -68.39374 669.32746
4400.0000 -70.91227 -68.83326 2.07902 2.04584 -68.74767 652.56513
4405.0000 -71.67540 -68.54546 3.12994 2.04718 -68.73474 645.40160
4410.0000 -70.95551 -68.53982 2.41568 2.02942 -68.90612 629.56621
4415.0000 -71.56483 -69.02386 2.54097 2.03553 -68.84715 649.90133
4420.0000 -70.57397 -67.98846 2.58551 2.03541 -68.84831 650.53634
4425.0000 -70.95790 -69.16256 1.79533 2.00809 -69.11207 603.64432
4430.0000 -71.35848 -69.04905 2.30943 2.02091 -68.98837 615.07971
4435.0000 -70.77049 -68.25873 2.51177 2.04306 -68.77450 642.61932
4440.0000 -70.45140 -68.16237 2.28903 2.10416 -68.18458 673.10108
4445.0000 -70.91043 -67.93911 2.97132 2.14454 -67.79474 736.63049
4450.0000 -71.20879 -68.30719 2.90160 2.07606 -68.45585 699.65898
4455.0000 -71.47564 -68.25936 3.21628 2.08847 -68.33601 709.16167
4460.0000 -71.01796 -68.44377 2.57419 2.10969 -68.13119 742.60139
4465.0000 -71.34091 -68.87030 2.47061 2.05518 -68.65748 651.22274
4470.0000 -70.41452 -67.57016 2.84436 2.10592 -68.16756 702.71071
4475.0000 -71.04162 -68.64422 2.39740 2.10831 -68.14449 693.02433
4480.0000 -71.81675 -69.98901 1.82773 1.94730 -69.69905 530.14765
4485.0000 -72.13874 -70.13458 2.00417 1.90790 -70.07940 503.47887
4490.0000 -70.78802 -68.53620 2.25182 1.98888 -69.29759 572.87995
4495.0000 -72.07560 -69.11957 2.95603 2.06701 -68.54329 663.60774
4500.0000 -71.35085 -68.97163 2.37922 2.04132 -68.79131 668.81224
FREEZING PROCESS: loop number 19 T-loop= 656.00000000000000
main_MD> interactions number 19 at Temperature= 656.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 4.52060 -2.45714 1.00292
force_rgl> df(natom) -2.01558 1.48726 -0.54404
4505.0000 -70.64237 -68.33506 2.30731 2.03663 -68.83654 647.30898
4510.0000 -71.62334 -69.56312 2.06022 2.01439 -69.05125 609.21308
4515.0000 -70.60983 -68.50724 2.10259 1.97379 -69.44330 559.24735
4520.0000 -70.15106 -67.50424 2.64683 2.09522 -68.27092 695.99396
4525.0000 -70.67123 -67.67503 2.99619 2.16602 -67.58729 751.91268
4530.0000 -70.50426 -67.86887 2.63540 2.18124 -67.44034 731.48426
4535.0000 -70.61612 -68.26100 2.35512 2.10662 -68.16083 704.69945
4540.0000 -71.95789 -69.56601 2.39188 2.03034 -68.89729 649.33847
4545.0000 -71.65382 -68.79875 2.85508 1.97758 -69.40664 573.84509
4550.0000 -71.64188 -69.01068 2.63120 2.03552 -68.84727 621.14782
4555.0000 -70.51423 -68.25815 2.25608 2.10393 -68.18676 712.36269
4560.0000 -70.96641 -68.52775 2.43866 2.06079 -68.60327 649.09197
4565.0000 -71.12452 -68.76117 2.36335 2.05643 -68.64536 655.78893
4570.0000 -71.05968 -68.59281 2.46687 2.04892 -68.71792 640.11707
4575.0000 -71.60386 -68.61395 2.98991 2.01521 -69.04331 635.18794
4580.0000 -71.40130 -68.97531 2.42599 2.01379 -69.05706 570.11996
4585.0000 -71.71806 -68.34132 3.37674 2.06477 -68.56490 726.08942
4590.0000 -71.76497 -69.10002 2.66495 2.05537 -68.65562 694.51493
4595.0000 -71.47802 -69.37828 2.09975 1.96879 -69.49154 604.69804
4600.0000 -71.73196 -69.73015 2.00182 1.97904 -69.39257 642.83056
4605.0000 -71.38808 -69.26066 2.12743 1.96474 -69.53062 620.96874
4610.0000 -71.29227 -68.46517 2.82709 2.03876 -68.81595 674.76398
4615.0000 -70.89756 -68.03156 2.86600 2.09854 -68.23886 686.52545
4620.0000 -71.83854 -69.57303 2.26551 2.05244 -68.68391 673.84409
4625.0000 -71.54540 -69.28077 2.26463 1.95479 -69.62667 602.16863
4630.0000 -70.35281 -67.97029 2.38252 2.03631 -68.83965 650.45003
4635.0000 -70.99534 -68.49587 2.49947 2.09782 -68.24579 697.06445
4640.0000 -70.86165 -67.82815 3.03351 2.09293 -68.29303 698.03045
4645.0000 -71.40635 -69.17690 2.22946 2.10201 -68.20534 697.42634
4650.0000 -71.22668 -68.19213 3.03456 2.06090 -68.60222 643.57508
4655.0000 -70.60991 -68.55507 2.05484 2.08566 -68.36320 668.14764
4660.0000 -70.72098 -68.86186 1.85912 2.05628 -68.64686 693.42619
4665.0000 -71.65163 -68.73130 2.92033 2.04891 -68.71800 683.26386
4670.0000 -70.46333 -68.06928 2.39405 2.05327 -68.67590 664.14412
4675.0000 -70.77728 -67.84960 2.92768 2.10830 -68.14460 713.55691
4680.0000 -70.23374 -67.18473 3.04901 2.20086 -67.25090 818.38751
4685.0000 -69.82697 -67.14149 2.68549 2.20144 -67.24533 780.28301
4690.0000 -71.15355 -68.17497 2.97857 2.17097 -67.53954 734.08773
4695.0000 -71.08277 -68.57581 2.50696 2.07811 -68.43609 706.04318
4700.0000 -70.89809 -68.60539 2.29270 2.08396 -68.37955 654.02535
4705.0000 -71.23938 -68.38835 2.85103 2.08934 -68.32766 675.09941
4710.0000 -71.12642 -68.14679 2.97964 2.11721 -68.05853 677.22985
4715.0000 -70.75922 -68.34369 2.41553 2.10019 -68.22285 682.32817
4720.0000 -71.39504 -69.46156 1.93348 2.02878 -68.91237 648.50688
4725.0000 -71.70245 -69.66682 2.03563 1.99302 -69.25759 623.98592
4730.0000 -70.75560 -68.04259 2.71301 2.04221 -68.78266 683.61918
4735.0000 -71.22598 -68.04843 3.17755 2.09231 -68.29894 704.05275
4740.0000 -71.25504 -68.74638 2.50866 2.10294 -68.19633 727.16013
4745.0000 -70.94251 -69.25526 1.68725 2.00027 -69.18762 591.97614
4750.0000 -71.72276 -69.37058 2.35218 1.99540 -69.23461 609.20656
FREEZING PROCESS: loop number 20 T-loop= 631.00000000000000
main_MD> interactions number 20 at Temperature= 631.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.71966 0.77662 -1.21019
force_rgl> df(natom) 1.76046 -0.76809 1.91153
4755.0000 -69.97023 -67.80646 2.16376 2.09272 -68.29502 701.43435
4760.0000 -71.23204 -68.08657 3.14547 2.12966 -67.93833 722.02941
4765.0000 -70.95098 -68.62182 2.32916 2.07288 -68.48661 651.44672
4770.0000 -71.41706 -69.29272 2.12434 2.05819 -68.62843 677.04633
4775.0000 -71.85600 -69.77854 2.07746 1.99041 -69.28281 598.46999
4780.0000 -71.88238 -69.53784 2.34453 1.97818 -69.40084 563.72314
4785.0000 -71.53387 -69.23168 2.30219 1.95776 -69.59799 542.05368
4790.0000 -71.63170 -69.69738 1.93432 1.96455 -69.53245 576.25951
4795.0000 -71.88513 -68.81316 3.07198 1.97133 -69.46701 582.38562
4800.0000 -71.37210 -68.56652 2.80559 2.05137 -68.69428 659.65635
4805.0000 -71.74896 -69.62049 2.12847 1.98354 -69.34915 619.36261
4810.0000 -71.90178 -68.92003 2.98174 1.99940 -69.19597 630.34586
4815.0000 -72.06307 -69.51885 2.54422 2.00219 -69.16905 625.53426
4820.0000 -70.36547 -67.47831 2.88716 2.05788 -68.63136 663.09664
4825.0000 -71.34479 -69.20089 2.14389 2.08645 -68.35551 690.07757
4830.0000 -71.62717 -69.45839 2.16878 1.96448 -69.53312 578.99063
4835.0000 -71.73302 -68.83322 2.89979 2.00297 -69.16149 633.13570
4840.0000 -70.77555 -68.44455 2.33100 2.06656 -68.54757 666.41141
4845.0000 -71.52131 -68.82637 2.69494 2.02977 -68.90282 608.04746
4850.0000 -70.83098 -68.69237 2.13860 2.09321 -68.29025 675.71754
4855.0000 -72.08564 -69.89559 2.19005 1.96425 -69.53542 572.80678
4860.0000 -71.98273 -69.53854 2.44419 1.95188 -69.65479 589.98580
4865.0000 -71.38738 -68.91224 2.47514 1.99955 -69.19459 601.78225
4870.0000 -71.66207 -68.40898 3.25309 2.05795 -68.63074 699.92531
4875.0000 -70.96897 -68.88566 2.08331 2.05685 -68.64132 692.71226
4880.0000 -71.26314 -68.83024 2.43290 2.02155 -68.98213 648.81325
4885.0000 -70.12407 -68.20787 1.91620 2.02660 -68.93341 618.76352
4890.0000 -71.29600 -68.74096 2.55504 2.12214 -68.01099 683.01217
4895.0000 -71.94001 -69.31369 2.62632 2.02269 -68.97113 620.38181
4900.0000 -71.12270 -68.80143 2.32127 2.02513 -68.94756 642.95503
4905.0000 -71.70884 -69.69000 2.01884 2.02157 -68.98200 596.01112
4910.0000 -72.04562 -70.21425 1.83137 1.94964 -69.67646 533.71951
4915.0000 -72.19646 -69.96135 2.23511 1.91046 -70.05475 541.46951
4920.0000 -71.53937 -69.05857 2.48080 1.92753 -69.88991 528.43347
4925.0000 -71.00581 -68.19515 2.81067 2.07009 -68.51354 697.04801
4930.0000 -71.32879 -68.41648 2.91230 2.09558 -68.26739 705.76116
4935.0000 -70.85368 -68.52832 2.32536 2.05145 -68.69349 645.71380
4940.0000 -71.44205 -69.11246 2.32959 2.03863 -68.81729 660.70694
4945.0000 -72.06650 -69.48424 2.58226 1.96277 -69.54965 587.60471
4950.0000 -71.57513 -69.51360 2.06152 1.95657 -69.60949 582.17071
4955.0000 -71.61438 -68.70091 2.91347 1.96361 -69.54154 585.73421
4960.0000 -71.72751 -69.56758 2.15993 1.99314 -69.25640 622.07332
4965.0000 -71.49801 -68.77395 2.72406 2.02097 -68.98773 653.18663
4970.0000 -71.61725 -69.43162 2.18563 2.00459 -69.14588 655.29950
4975.0000 -71.58172 -69.25740 2.32432 1.99121 -69.27503 611.45601
4980.0000 -71.35341 -68.80832 2.54509 2.03062 -68.89459 659.54175
4985.0000 -71.78619 -69.89375 1.89244 1.97687 -69.41356 578.33988
4990.0000 -70.58891 -68.45614 2.13277 1.95312 -69.64280 568.80539
4995.0000 -70.28355 -68.08952 2.19403 2.08050 -68.41303 638.67398
5000.0000 -70.14592 -67.30461 2.84131 2.20430 -67.21771 765.37534
FREEZING PROCESS: loop number 21 T-loop= 606.00000000000000
main_MD> interactions number 21 at Temperature= 606.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.81813 -0.13742 -0.95785
force_rgl> df(natom) 2.71816 6.70912 1.13024
5005.0000 -69.85129 -67.48630 2.36499 2.14598 -67.78076 661.84550
5010.0000 -70.89183 -68.22985 2.66197 2.15946 -67.65066 761.20084
5015.0000 -71.58615 -69.24724 2.33891 2.00939 -69.09955 599.98485
5020.0000 -71.66831 -69.32246 2.34585 1.97906 -69.39240 554.26028
5025.0000 -70.99108 -68.65699 2.33408 2.00540 -69.13808 599.27637
5030.0000 -72.04222 -69.98151 2.06071 1.99112 -69.27592 577.90291
5035.0000 -72.35672 -69.87706 2.47966 1.94419 -69.72906 537.08041
5040.0000 -72.42339 -70.09430 2.32908 1.91923 -69.97000 526.04057
5045.0000 -71.84246 -70.26302 1.57944 1.88772 -70.27423 506.93817
5050.0000 -72.03132 -69.59946 2.43186 1.92006 -69.96198 566.58175
5055.0000 -72.30207 -70.17568 2.12638 1.92453 -69.91885 560.98380
5060.0000 -72.29954 -69.79013 2.50942 1.92141 -69.94896 551.55243
5065.0000 -71.56996 -68.89371 2.67624 2.00834 -69.10966 632.38457
5070.0000 -71.48560 -68.63844 2.84716 2.07924 -68.42520 707.93614
5075.0000 -71.80208 -69.04971 2.75236 2.07357 -68.47994 740.79939
5080.0000 -71.55800 -68.60390 2.95410 1.97734 -69.40901 576.19276
5085.0000 -71.12209 -68.71443 2.40766 2.07829 -68.43429 664.49047
5090.0000 -71.12955 -68.56121 2.56834 2.02795 -68.92032 628.52637
5095.0000 -71.53601 -69.39205 2.14395 2.02872 -68.91288 648.42670
5100.0000 -71.43278 -69.48395 1.94882 1.98303 -69.35402 593.21417
5105.0000 -71.82127 -69.35090 2.47037 1.99035 -69.28339 630.80681
5110.0000 -71.48119 -69.20974 2.27145 2.03508 -68.85152 666.21316
5115.0000 -72.11805 -69.56024 2.55781 2.00063 -69.18415 604.35740
5120.0000 -71.56554 -69.54261 2.02293 2.00122 -69.17842 633.61009
5125.0000 -72.18474 -69.54254 2.64220 1.98322 -69.35218 648.50947
5130.0000 -71.92472 -69.70790 2.21682 1.95728 -69.60268 608.68186
5135.0000 -72.29328 -70.50939 1.78388 1.90449 -70.11237 536.00137
5140.0000 -72.45013 -70.87820 1.57194 1.85261 -70.61324 485.11181
5145.0000 -71.79431 -69.60593 2.18838 1.93506 -69.81722 557.67358
5150.0000 -71.99355 -70.52174 1.47181 1.91187 -70.04110 557.21822
5155.0000 -71.90056 -69.94787 1.95269 1.90421 -70.11503 525.20707
5160.0000 -72.91957 -70.39417 2.52541 1.89610 -70.19334 526.14228
5165.0000 -72.30458 -69.82351 2.48107 1.90618 -70.09600 548.05484
5170.0000 -72.00358 -70.07522 1.92836 1.93081 -69.85819 572.88779
5175.0000 -72.06710 -69.71514 2.35196 1.91116 -70.04798 547.60234
5180.0000 -71.63440 -69.31258 2.32182 1.91831 -69.97894 544.45729
5185.0000 -72.10591 -70.01627 2.08965 1.93071 -69.85920 563.35494
5190.0000 -71.88310 -69.69703 2.18607 1.93872 -69.78182 561.30323
5195.0000 -71.54484 -69.32006 2.22478 2.01386 -69.05641 657.23282
5200.0000 -72.26188 -70.45741 1.80447 1.92401 -69.92393 557.22758
5205.0000 -72.32199 -70.63329 1.68870 1.84434 -70.69311 473.03511
5210.0000 -71.33796 -69.60898 1.72898 1.92325 -69.93125 542.61215
5215.0000 -71.70399 -69.05085 2.65313 1.99427 -69.24549 640.59599
5220.0000 -71.84505 -69.15210 2.69295 2.01796 -69.01677 649.93566
5225.0000 -72.02046 -69.97988 2.04058 1.97838 -69.39898 602.60167
5230.0000 -71.75892 -68.68389 3.07503 1.98991 -69.28768 603.43857
5235.0000 -71.48070 -69.54605 1.93465 1.97890 -69.39396 556.25029
5240.0000 -71.87914 -70.05595 1.82319 1.92949 -69.87097 524.36099
5245.0000 -71.79257 -69.40098 2.39159 1.94267 -69.74371 554.94964
5250.0000 -71.17203 -68.93068 2.24135 1.99879 -69.20188 596.08812
FREEZING PROCESS: loop number 22 T-loop= 581.00000000000000
main_MD> interactions number 22 at Temperature= 581.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -3.79520 -3.89175 1.04252
force_rgl> df(natom) 0.00423 -1.05169 1.06066
5255.0000 -71.45085 -69.16646 2.28439 1.99209 -69.26660 573.90398
5260.0000 -71.25462 -69.14399 2.11062 1.98572 -69.32804 579.00909
5265.0000 -71.50410 -69.48006 2.02405 1.99338 -69.25416 618.23711
5270.0000 -71.99417 -69.39179 2.60238 1.99645 -69.22452 633.13624
5275.0000 -71.33780 -69.21521 2.12259 1.99149 -69.27234 624.28581
5280.0000 -72.56682 -70.33524 2.23158 1.94076 -69.76215 556.29355
5285.0000 -71.85434 -69.70191 2.15244 1.93527 -69.81517 548.91006
5290.0000 -71.20900 -69.19564 2.01336 1.99403 -69.24786 613.06902
5295.0000 -72.06857 -70.18549 1.88308 1.96882 -69.49130 616.88924
5300.0000 -72.10864 -70.48192 1.62672 1.86584 -70.48549 492.55914
5305.0000 -72.26311 -70.53478 1.72834 1.88552 -70.29547 529.55457
5310.0000 -71.62159 -69.49716 2.12443 1.90993 -70.05979 554.82783
5315.0000 -72.28348 -70.07160 2.21187 1.97136 -69.46672 607.97397
5320.0000 -72.20172 -70.20761 1.99410 1.88492 -70.30131 518.20951
5325.0000 -72.41287 -70.30083 2.11204 1.87801 -70.36803 477.79047
5330.0000 -72.32541 -70.08321 2.24220 1.88983 -70.25387 496.71138
5335.0000 -71.58957 -69.38369 2.20589 1.95981 -69.57825 582.66093
5340.0000 -71.52481 -69.17865 2.34616 1.97543 -69.42744 595.52732
5345.0000 -71.43647 -69.10813 2.32833 2.02433 -68.95531 669.36588
5350.0000 -71.28954 -69.01238 2.27717 2.00764 -69.11649 623.48869
5355.0000 -71.24704 -68.41551 2.83153 2.00478 -69.14407 608.58241
5360.0000 -71.21845 -69.29841 1.92004 2.02427 -68.95593 602.66133
5365.0000 -71.73968 -69.53266 2.20702 1.99224 -69.26515 561.65396
5370.0000 -71.68311 -69.57468 2.10843 1.97338 -69.44721 586.36779
5375.0000 -71.75695 -69.57843 2.17852 1.94607 -69.71089 517.98670
5380.0000 -71.75651 -69.09324 2.66328 1.99178 -69.26958 618.55250
5385.0000 -71.47360 -68.94848 2.52512 1.97386 -69.44264 578.83732
5390.0000 -71.36519 -69.27095 2.09424 2.01735 -69.02274 603.67387
5395.0000 -71.99167 -69.76013 2.23154 1.97040 -69.47604 578.02508
5400.0000 -71.92667 -69.14830 2.77837 2.01437 -69.05152 610.95235
5405.0000 -71.23726 -69.20665 2.03061 1.99443 -69.24402 601.31278
5410.0000 -71.68183 -68.85349 2.82834 1.94875 -69.68506 595.68307
5415.0000 -71.77524 -69.70482 2.07042 1.97217 -69.45895 618.09312
5420.0000 -72.07982 -69.92976 2.15006 1.91132 -70.04639 504.24650
5425.0000 -71.63849 -69.44639 2.19210 1.91055 -70.05385 534.74012
5430.0000 -72.12459 -70.00004 2.12456 1.96586 -69.51979 566.07725
5435.0000 -71.88289 -69.72722 2.15568 1.98128 -69.37099 599.90873
5440.0000 -72.41139 -70.24839 2.16300 1.91658 -69.99566 520.21900
5445.0000 -72.16107 -69.82673 2.33434 1.92374 -69.92654 554.57194
5450.0000 -72.08241 -69.81722 2.26519 1.94563 -69.71512 564.42892
5455.0000 -71.12298 -68.52135 2.60163 1.98425 -69.34225 575.26796
5460.0000 -71.26360 -68.83988 2.42372 2.02789 -68.92090 632.01542
5465.0000 -71.83402 -69.61724 2.21678 2.03900 -68.81364 675.11824
5470.0000 -73.11694 -71.07821 2.03873 1.87312 -70.41524 486.69175
5475.0000 -71.42584 -68.65183 2.77400 1.90506 -70.10682 521.75881
5480.0000 -72.06393 -70.03504 2.02889 1.97177 -69.46278 615.11090
5485.0000 -71.82571 -69.48996 2.33575 1.92370 -69.92687 546.46212
5490.0000 -72.13175 -70.02516 2.10659 1.92135 -69.94958 564.90151
5495.0000 -71.76949 -69.01104 2.75845 1.94233 -69.74704 575.92103
5500.0000 -70.39709 -68.05335 2.34374 2.05775 -68.63262 652.86267
FREEZING PROCESS: loop number 23 T-loop= 556.00000000000000
main_MD> interactions number 23 at Temperature= 556.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -2.16726 1.79362 0.47475
force_rgl> df(natom) -0.17147 -0.44190 -1.13167
5505.0000 -71.44446 -68.79494 2.64952 2.04272 -68.77773 656.13589
5510.0000 -71.79873 -69.73715 2.06158 1.97756 -69.40683 601.90932
5515.0000 -72.32212 -70.34280 1.97932 1.91325 -70.02780 528.48218
5520.0000 -71.93708 -70.13231 1.80477 1.87439 -70.40295 505.77122
5525.0000 -72.38671 -70.56231 1.82441 1.87876 -70.36077 484.45830
5530.0000 -72.86050 -71.07257 1.78793 1.85521 -70.58813 486.83464
5535.0000 -72.37312 -70.18251 2.19060 1.83836 -70.75081 493.24062
5540.0000 -72.56527 -70.33244 2.23283 1.89257 -70.22746 539.59503
5545.0000 -73.10096 -70.99362 2.10734 1.84195 -70.71615 484.62116
5550.0000 -72.52869 -70.45947 2.06922 1.86322 -70.51085 499.20243
5555.0000 -72.27109 -70.26671 2.00439 1.89805 -70.17450 518.20520
5560.0000 -71.92559 -70.17795 1.74764 1.89258 -70.22735 521.98713
5565.0000 -71.92245 -69.86253 2.05992 1.92159 -69.94728 566.50864
5570.0000 -72.50469 -70.32423 2.18046 1.90697 -70.08836 543.74902
5575.0000 -71.81458 -69.22380 2.59078 1.91942 -69.96823 554.26641
5580.0000 -72.04595 -69.57105 2.47491 1.98233 -69.36079 620.19827
5585.0000 -72.15377 -70.44371 1.71006 1.91255 -70.03453 558.26724
5590.0000 -72.70665 -70.91060 1.79605 1.90657 -70.09229 536.07502
5595.0000 -72.19436 -70.20033 1.99403 1.88663 -70.28474 497.55947
5600.0000 -72.01882 -70.08946 1.92936 1.90520 -70.10546 539.14727
5605.0000 -72.01318 -69.44918 2.56400 1.95623 -69.61281 596.61286
5610.0000 -72.32800 -69.59208 2.73592 2.01403 -69.05479 630.84874
5615.0000 -71.98112 -69.66981 2.31132 1.92164 -69.94677 525.88880
5620.0000 -72.25008 -69.78088 2.46920 1.95504 -69.62431 567.72869
5625.0000 -71.45921 -69.40523 2.05398 1.94167 -69.75337 546.10399
5630.0000 -71.70574 -69.54303 2.16271 1.96143 -69.56261 580.87449
5635.0000 -72.24892 -70.14732 2.10160 1.93415 -69.82595 569.20061
5640.0000 -71.57964 -69.59231 1.98733 1.92014 -69.96130 546.29063
5645.0000 -71.15836 -69.36000 1.79835 1.96400 -69.53779 563.74613
5650.0000 -71.66728 -69.32174 2.34554 1.99558 -69.23291 572.95915
5655.0000 -71.87714 -69.76291 2.11423 1.93852 -69.78382 541.05815
5660.0000 -71.65266 -69.67610 1.97656 1.94040 -69.76565 530.11245
5665.0000 -72.19488 -70.30845 1.88643 1.91640 -69.99737 504.84640
5670.0000 -72.48989 -70.50967 1.98022 1.85137 -70.62525 460.20566
5675.0000 -71.52168 -69.37678 2.14489 1.88257 -70.32400 483.26256
5680.0000 -71.15284 -68.91123 2.24161 1.98179 -69.36603 574.27440
5685.0000 -71.49192 -69.17249 2.31943 2.01712 -69.02496 618.45530
5690.0000 -71.64190 -69.06488 2.57701 2.00392 -69.15232 616.86579
5695.0000 -72.04808 -69.75059 2.29749 1.95118 -69.66154 526.68947
5700.0000 -72.35051 -70.22624 2.12427 1.93359 -69.83139 546.53588
5705.0000 -72.34213 -70.55705 1.78508 1.89488 -70.20510 519.84917
5710.0000 -72.32732 -70.49112 1.83620 1.88481 -70.30240 491.08802
5715.0000 -71.94655 -70.12116 1.82539 1.87802 -70.36788 499.50332
5720.0000 -71.69581 -69.75403 1.94178 1.88433 -70.30702 499.76132
5725.0000 -72.26555 -69.78687 2.47868 1.95678 -69.60748 586.57017
5730.0000 -71.87913 -69.52404 2.35509 1.93835 -69.78540 555.30083
5735.0000 -72.43247 -70.52178 1.91070 1.93417 -69.82582 552.20755
5740.0000 -72.06120 -69.70989 2.35131 1.89888 -70.16651 504.91439
5745.0000 -71.61863 -69.11417 2.50446 1.98082 -69.37540 584.82956
5750.0000 -71.94049 -69.60940 2.33109 1.96583 -69.52013 548.70579
FREEZING PROCESS: loop number 24 T-loop= 531.00000000000000
main_MD> interactions number 24 at Temperature= 531.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.16940 -1.92437 -1.29926
force_rgl> df(natom) -0.78636 -2.51398 -3.18214
5755.0000 -71.45376 -69.60749 1.84627 1.97355 -69.44561 542.89657
5760.0000 -72.18432 -69.86359 2.32073 1.96512 -69.52697 535.18497
5765.0000 -72.22352 -69.66411 2.55941 1.93334 -69.83384 500.73238
5770.0000 -71.50255 -69.33792 2.16463 1.94356 -69.73511 552.31992
5775.0000 -71.27381 -69.20002 2.07378 1.98104 -69.37330 553.78896
5780.0000 -71.70146 -69.26717 2.43429 1.96747 -69.50431 576.40103
5785.0000 -71.63583 -69.42610 2.20973 1.98974 -69.28929 616.74754
5790.0000 -72.30399 -69.38956 2.91443 1.99836 -69.20607 609.85209
5795.0000 -71.99004 -69.78781 2.20222 1.94431 -69.72790 574.20041
5800.0000 -72.17381 -69.42663 2.74719 1.94395 -69.73138 579.12800
5805.0000 -72.43917 -70.69842 1.74075 1.88873 -70.26454 495.85741
5810.0000 -72.04927 -70.00994 2.03933 1.91515 -70.00941 540.71404
5815.0000 -72.37310 -70.12469 2.24841 1.90306 -70.12615 511.31540
5820.0000 -72.32460 -69.91288 2.41172 1.89502 -70.20374 521.66505
5825.0000 -72.42128 -69.87184 2.54944 1.89917 -70.16368 520.08633
5830.0000 -71.67449 -69.32867 2.34582 1.99066 -69.28043 631.71742
5835.0000 -72.34215 -69.89920 2.44295 1.92780 -69.88725 557.76667
5840.0000 -72.00618 -69.41790 2.58827 1.91436 -70.01704 535.32062
5845.0000 -71.15675 -68.91358 2.24317 2.00882 -69.10509 606.20457
5850.0000 -71.26821 -69.34155 1.92667 1.98147 -69.36911 552.70400
5855.0000 -71.25963 -68.96689 2.29274 1.99701 -69.21907 576.93294
5860.0000 -71.56653 -69.47730 2.08923 1.98977 -69.28895 595.86847
5865.0000 -72.29822 -70.00531 2.29291 1.92068 -69.95603 573.97088
5870.0000 -72.23020 -70.42019 1.81002 1.89798 -70.17519 538.93087
5875.0000 -72.37545 -70.02592 2.34953 1.89183 -70.23457 512.36342
5880.0000 -72.27306 -70.19723 2.07583 1.90833 -70.07523 511.03295
5885.0000 -71.86589 -69.33546 2.53042 1.92647 -69.90017 536.71624
5890.0000 -72.08047 -69.92990 2.15057 1.95253 -69.64851 572.34017
5895.0000 -72.31098 -70.45377 1.85721 1.92669 -69.89803 567.34391
5900.0000 -72.59443 -70.67046 1.92397 1.82883 -70.84282 450.45067
5905.0000 -72.30425 -70.28094 2.02331 1.86569 -70.48697 497.18528
5910.0000 -72.12396 -69.55419 2.56977 1.92046 -69.95820 548.35078
5915.0000 -72.03368 -69.82681 2.20687 1.88824 -70.26923 509.08426
5920.0000 -71.54609 -69.58749 1.95859 1.95024 -69.67067 547.45071
5925.0000 -72.24957 -69.91707 2.33250 1.92323 -69.93143 545.85800
5930.0000 -71.82208 -69.50231 2.31977 1.93676 -69.80082 550.54492
5935.0000 -71.12827 -69.28516 1.84311 1.98970 -69.28970 599.40245
5940.0000 -71.42754 -69.43472 1.99282 1.96383 -69.53945 583.93924
5945.0000 -72.28969 -69.66490 2.62479 1.95824 -69.59339 576.46593
5950.0000 -71.73880 -70.00465 1.73415 1.96935 -69.48613 576.73680
5955.0000 -71.84062 -70.29663 1.54399 1.91441 -70.01654 526.45133
5960.0000 -72.27345 -70.54241 1.73104 1.87038 -70.44165 486.56078
5965.0000 -71.91106 -70.18337 1.72770 1.88036 -70.34534 482.28181
5970.0000 -72.46080 -70.49544 1.96536 1.88021 -70.34676 497.85043
5975.0000 -72.29052 -70.33963 1.95089 1.88693 -70.28190 493.30343
5980.0000 -71.66550 -69.42822 2.23728 1.91253 -70.03471 533.65608
5985.0000 -72.16298 -70.04622 2.11676 1.94210 -69.74919 526.12908
5990.0000 -72.46411 -70.05890 2.40520 1.92115 -69.95148 552.83777
5995.0000 -72.48826 -70.01544 2.47282 1.89057 -70.24679 531.86174
6000.0000 -71.98507 -69.97664 2.00843 1.90963 -70.06273 532.09914
FREEZING PROCESS: loop number 25 T-loop= 506.00000000000000
main_MD> interactions number 25 at Temperature= 506.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.52065 1.45853 -0.51102
force_rgl> df(natom) -5.02772 -1.54818 0.09690
6005.0000 -72.60683 -70.56383 2.04299 1.89814 -70.17369 517.89351
6010.0000 -71.92027 -69.84130 2.07897 1.87914 -70.35708 499.47154
6015.0000 -71.53885 -69.88928 1.64957 1.91258 -70.03428 536.42730
6020.0000 -72.24397 -71.01017 1.23380 1.89282 -70.22507 506.00325
6025.0000 -72.42317 -70.40342 2.01975 1.84055 -70.72972 459.74982
6030.0000 -72.68123 -71.01371 1.66752 1.83782 -70.75608 473.99759
6035.0000 -72.29594 -69.91124 2.38470 1.84282 -70.70779 464.47852
6040.0000 -72.08925 -69.87740 2.21186 1.91601 -70.00114 558.63683
6045.0000 -72.06354 -70.17696 1.88658 1.89452 -70.20862 528.89237
6050.0000 -72.22750 -69.53040 2.69710 1.92860 -69.87957 538.87179
6055.0000 -71.26897 -69.45227 1.81671 1.94777 -69.69453 550.94171
6060.0000 -71.74483 -69.32855 2.41628 1.98690 -69.31665 599.56020
6065.0000 -72.15883 -69.80431 2.35452 1.96496 -69.52851 587.81070
6070.0000 -72.37527 -70.71549 1.65979 1.91101 -70.04944 529.18263
6075.0000 -72.16901 -69.94380 2.22520 1.88843 -70.26738 511.35401
6080.0000 -71.88928 -69.95831 1.93097 1.94040 -69.76566 535.15015
6085.0000 -72.64123 -70.26280 2.37843 1.86989 -70.44642 498.75625
6090.0000 -72.43314 -70.77739 1.65575 1.86502 -70.49345 488.30492
6095.0000 -72.54813 -70.73781 1.81032 1.83910 -70.74373 440.55088
6100.0000 -72.48900 -70.49524 1.99376 1.87980 -70.35076 492.02219
6105.0000 -71.72380 -70.11724 1.60656 1.86295 -70.51345 457.88935
6110.0000 -71.88800 -69.74456 2.14344 1.92136 -69.94946 507.82063
6115.0000 -72.28558 -69.92047 2.36511 1.90937 -70.06522 527.83508
6120.0000 -72.72771 -70.95791 1.76980 1.85766 -70.56447 495.45197
6125.0000 -72.29478 -70.52393 1.77085 1.84618 -70.67534 473.81722
6130.0000 -72.42513 -70.66288 1.76224 1.86516 -70.49211 493.79478
6135.0000 -72.63342 -70.42779 2.20563 1.87328 -70.41372 501.54990
6140.0000 -72.65254 -71.37062 1.28192 1.86430 -70.50035 471.61235
6145.0000 -72.02830 -70.58008 1.44821 1.80322 -71.09010 397.47403
6150.0000 -72.23201 -70.44385 1.78816 1.88611 -70.28981 506.74866
6155.0000 -72.26120 -70.32776 1.93345 1.87510 -70.39607 514.21487
6160.0000 -72.29545 -70.19421 2.10124 1.90255 -70.13111 539.58046
6165.0000 -72.37895 -70.57884 1.80011 1.87892 -70.35923 521.62712
6170.0000 -72.13023 -69.59473 2.53550 1.87897 -70.35878 520.69192
6175.0000 -72.13372 -70.55791 1.57581 1.91589 -70.00227 539.99024
6180.0000 -72.97887 -69.94577 3.03310 1.88631 -70.28792 529.31477
6185.0000 -72.72576 -70.28894 2.43683 1.90682 -70.08985 548.69451
6190.0000 -72.09940 -69.74051 2.35889 1.91701 -69.99149 532.21812
6195.0000 -71.81030 -69.76850 2.04180 1.93160 -69.85057 552.49627
6200.0000 -72.53023 -70.49902 2.03121 1.90366 -70.12038 523.11964
6205.0000 -72.20535 -69.90911 2.29624 1.89269 -70.22632 529.06554
6210.0000 -72.38254 -70.63332 1.74923 1.86338 -70.50931 495.84982
6215.0000 -72.50386 -70.72036 1.78351 1.89149 -70.23788 521.90402
6220.0000 -72.76155 -70.61760 2.14395 1.85194 -70.61967 471.16351
6225.0000 -72.97552 -71.09599 1.87954 1.84509 -70.68590 465.40814
6230.0000 -72.40474 -70.41509 1.98964 1.85892 -70.55231 492.83716
6235.0000 -72.51060 -70.97337 1.53723 1.85562 -70.58416 497.72797
6240.0000 -73.01052 -71.24767 1.76285 1.78890 -71.22835 432.21029
6245.0000 -72.55161 -70.72398 1.82763 1.78753 -71.24157 405.32752
6250.0000 -72.17323 -70.72889 1.44434 1.85239 -70.61536 480.50101
FREEZING PROCESS: loop number 26 T-loop= 481.00000000000000
main_MD> interactions number 26 at Temperature= 481.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.95202 1.99123 1.89123
force_rgl> df(natom) -2.19877 -1.50105 -1.04466
6255.0000 -72.21885 -70.68537 1.53348 1.82748 -70.85587 435.22410
6260.0000 -71.72576 -69.86098 1.86478 1.87662 -70.38145 487.66264
6265.0000 -72.06929 -70.17117 1.89811 1.90484 -70.10897 513.46698
6270.0000 -71.93357 -69.52466 2.40890 1.93022 -69.86393 534.58301
6275.0000 -72.22253 -70.04298 2.17955 1.93371 -69.83024 551.13474
6280.0000 -72.03631 -70.43515 1.60116 1.88787 -70.27279 518.25114
6285.0000 -72.30594 -70.33529 1.97065 1.87729 -70.37496 508.95613
6290.0000 -72.31210 -70.14692 2.16518 1.88611 -70.28982 514.91311
6295.0000 -72.09227 -70.40747 1.68480 1.89170 -70.23588 516.45150
6300.0000 -72.34948 -70.74838 1.60110 1.85791 -70.56208 485.73483
6305.0000 -72.69620 -70.24827 2.44793 1.85719 -70.56907 471.41512
6310.0000 -72.50498 -70.52756 1.97742 1.87554 -70.39181 502.37821
6315.0000 -72.03796 -70.66610 1.37186 1.85439 -70.59610 489.23437
6320.0000 -72.83699 -71.13373 1.70326 1.83406 -70.79234 462.10436
6325.0000 -72.65820 -70.84818 1.81003 1.80846 -71.03952 449.38085
6330.0000 -72.59888 -70.99561 1.60327 1.82139 -70.91472 434.67712
6335.0000 -72.20069 -70.28625 1.91445 1.83061 -70.82566 464.56183
6340.0000 -72.19298 -69.91061 2.28237 1.89507 -70.20333 519.28887
6345.0000 -72.31805 -70.37362 1.94443 1.87123 -70.43347 519.67344
6350.0000 -72.70500 -70.45548 2.24952 1.86960 -70.44923 505.47255
6355.0000 -71.93389 -69.85758 2.07630 1.90546 -70.10298 539.99416
6360.0000 -72.19978 -70.40637 1.79341 1.90105 -70.14556 492.59841
6365.0000 -72.76067 -70.35336 2.40731 1.89765 -70.17838 519.57059
6370.0000 -72.51669 -70.69716 1.81953 1.87271 -70.41915 494.92684
6375.0000 -72.59143 -70.74142 1.85001 1.84728 -70.66469 462.71732
6380.0000 -71.93457 -70.17664 1.75793 1.87989 -70.34988 487.41311
6385.0000 -71.79886 -69.79639 2.00247 1.92301 -69.93351 548.98261
6390.0000 -72.77289 -71.25453 1.51835 1.84293 -70.70668 465.53996
6395.0000 -72.59775 -71.25249 1.34527 1.79686 -71.15147 418.14287
6400.0000 -73.19513 -71.11589 2.07924 1.79842 -71.13642 428.15802
6405.0000 -72.75503 -70.98587 1.76915 1.83012 -70.83036 452.00914
6410.0000 -72.52555 -70.60492 1.92062 1.82867 -70.84443 456.40818
6415.0000 -72.65802 -70.93922 1.71880 1.81733 -70.95387 457.05796
6420.0000 -72.30972 -70.58512 1.72460 1.84928 -70.64539 477.10840
6425.0000 -72.42319 -71.04285 1.38034 1.82825 -70.84840 462.85749
6430.0000 -72.80199 -71.04090 1.76109 1.78621 -71.25433 413.65775
6435.0000 -72.47994 -70.68803 1.79191 1.85654 -70.57530 477.58847
6440.0000 -72.75088 -71.05129 1.69959 1.81972 -70.93081 434.66487
6445.0000 -72.92279 -71.06015 1.86264 1.82580 -70.87211 456.00822
6450.0000 -72.75999 -70.49911 2.26088 1.85918 -70.54982 490.33248
6455.0000 -72.55866 -70.73378 1.82488 1.86504 -70.49327 495.52833
6460.0000 -72.54031 -70.32132 2.21899 1.88059 -70.34315 506.10791
6465.0000 -72.58323 -70.34839 2.23483 1.90144 -70.14177 544.28577
6470.0000 -72.32859 -70.47287 1.85572 1.84257 -70.71016 469.17680
6475.0000 -71.96815 -69.87668 2.09147 1.89106 -70.24198 488.82820
6480.0000 -72.38618 -70.50483 1.88135 1.89568 -70.19745 507.23161
6485.0000 -71.71308 -69.98418 1.72890 1.89414 -70.21230 472.98495
6490.0000 -71.65121 -69.89505 1.75616 1.91799 -69.98201 525.40842
6495.0000 -72.56055 -70.40396 2.15659 1.86378 -70.50539 482.05617
6500.0000 -72.16113 -70.04982 2.11130 1.89337 -70.21967 486.91447
FREEZING PROCESS: loop number 27 T-loop= 456.00000000000000
main_MD> interactions number 27 at Temperature= 456.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.85255 0.86403 1.58916
force_rgl> df(natom) 1.77785 -4.08540 0.55685
6505.0000 -72.37088 -70.68239 1.68849 1.87403 -70.40644 493.27625
6510.0000 -72.63653 -71.06247 1.57406 1.82583 -70.87177 440.74552
6515.0000 -72.74255 -70.89823 1.84432 1.80738 -71.04995 415.36226
6520.0000 -72.06674 -70.64884 1.41791 1.84660 -70.67125 445.18782
6525.0000 -72.36241 -71.04859 1.31382 1.81875 -70.94020 406.69156
6530.0000 -72.71205 -71.09925 1.61280 1.79286 -71.19010 394.30890
6535.0000 -71.98831 -70.51513 1.47319 1.83161 -70.81601 425.52415
6540.0000 -72.38591 -70.59515 1.79076 1.85479 -70.59217 433.95270
6545.0000 -72.24571 -70.21014 2.03557 1.86161 -70.52639 479.26756
6550.0000 -72.57508 -70.47069 2.10439 1.86320 -70.51098 461.93738
6555.0000 -72.28649 -70.61840 1.66810 1.89798 -70.17523 506.84809
6560.0000 -72.48660 -71.08841 1.39819 1.82852 -70.84584 424.13367
6565.0000 -72.82847 -70.80978 2.01869 1.79839 -71.13676 402.40059
6570.0000 -72.59466 -70.80530 1.78936 1.85338 -70.60585 443.93561
6575.0000 -72.19666 -70.58600 1.61067 1.81756 -70.95162 421.86827
6580.0000 -72.79375 -70.94098 1.85277 1.83001 -70.83148 431.57873
6585.0000 -72.50284 -70.77087 1.73197 1.83459 -70.78725 455.04080
6590.0000 -71.47252 -69.35197 2.12055 1.91106 -70.04889 509.99400
6595.0000 -71.79595 -69.83105 1.96491 1.96930 -69.48662 584.41778
6600.0000 -72.44584 -70.77329 1.67254 1.89747 -70.18011 511.29678
6605.0000 -72.85836 -71.45401 1.40434 1.84300 -70.70605 452.21600
6610.0000 -72.30249 -71.08563 1.21686 1.78196 -71.29540 392.26698
6615.0000 -72.54091 -70.44571 2.09521 1.83995 -70.73545 467.60662
6620.0000 -72.19844 -70.21331 1.98513 1.87887 -70.35975 504.21612
6625.0000 -72.26251 -69.84437 2.41814 1.90962 -70.06282 538.18669
6630.0000 -72.27223 -70.25587 2.01636 1.90190 -70.13735 523.63779
6635.0000 -72.38324 -70.86756 1.51568 1.84894 -70.64864 460.50541
6640.0000 -72.12359 -70.36782 1.75577 1.85256 -70.61369 483.60368
6645.0000 -72.56821 -70.89862 1.66959 1.85161 -70.62295 465.93089
6650.0000 -72.79357 -70.87650 1.91707 1.81652 -70.96169 452.69008
6655.0000 -72.40159 -70.45773 1.94386 1.83515 -70.78179 469.32547
6660.0000 -72.13572 -70.48424 1.65148 1.86010 -70.54095 484.26098
6665.0000 -73.00793 -71.20044 1.80750 1.82959 -70.83552 468.84993
6670.0000 -72.68528 -71.02664 1.65864 1.79095 -71.20852 426.24746
6675.0000 -72.50598 -70.66126 1.84472 1.82570 -70.87304 442.70038
6680.0000 -72.54523 -70.84701 1.69823 1.83360 -70.79680 463.86355
6685.0000 -72.60243 -70.86719 1.73523 1.83181 -70.81408 458.16572
6690.0000 -72.58923 -70.49162 2.09761 1.84893 -70.64875 494.20998
6695.0000 -72.14857 -70.44929 1.69928 1.88100 -70.33919 514.60918
6700.0000 -72.58547 -70.53174 2.05373 1.85963 -70.54547 487.67691
6705.0000 -72.62376 -70.81804 1.80572 1.86690 -70.47529 482.37460
6710.0000 -72.22469 -70.59972 1.62497 1.83263 -70.80614 437.50757
6715.0000 -72.42448 -70.99149 1.43299 1.85368 -70.60290 470.64454
6720.0000 -72.03208 -70.25282 1.77926 1.89963 -70.15930 534.25861
6725.0000 -72.94469 -70.41637 2.52832 1.86125 -70.52985 502.12597
6730.0000 -72.35759 -70.13899 2.21860 1.90443 -70.11297 540.86081
6735.0000 -72.79915 -70.85047 1.94868 1.89274 -70.22581 535.92346
6740.0000 -72.46509 -70.71595 1.74914 1.83787 -70.75557 469.22995
6745.0000 -72.00241 -70.48536 1.51705 1.82301 -70.89906 445.93505
6750.0000 -72.18401 -70.52389 1.66013 1.87065 -70.43905 491.93207
FREEZING PROCESS: loop number 28 T-loop= 431.00000000000000
main_MD> interactions number 28 at Temperature= 431.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.59054 3.43463 -1.56528
force_rgl> df(natom) -1.63089 1.64805 -2.30299
6755.0000 -72.88596 -71.06371 1.82225 1.81394 -70.98662 450.26668
6760.0000 -72.87755 -71.42247 1.45508 1.77801 -71.33352 405.92024
6765.0000 -72.24671 -70.82455 1.42216 1.81333 -70.99253 443.58428
6770.0000 -72.63681 -70.69678 1.94003 1.83390 -70.79391 441.29779
6775.0000 -72.94150 -71.68967 1.25183 1.79046 -71.21328 393.59685
6780.0000 -73.00752 -71.62681 1.38070 1.74249 -71.67645 356.73668
6785.0000 -72.93208 -71.16545 1.76663 1.77236 -71.38801 384.83986
6790.0000 -72.64747 -70.82754 1.81993 1.81617 -70.96504 436.30512
6795.0000 -73.00554 -71.19726 1.80828 1.78221 -71.29294 408.87738
6800.0000 -72.83560 -71.18742 1.64818 1.79759 -71.14441 421.89239
6805.0000 -72.58321 -71.17728 1.40592 1.78124 -71.30228 394.30859
6810.0000 -72.59323 -70.97395 1.61928 1.81438 -70.98237 424.96428
6815.0000 -72.58048 -70.79175 1.78874 1.85064 -70.63226 475.16275
6820.0000 -71.53751 -69.93894 1.59857 1.86985 -70.44679 492.08695
6825.0000 -72.13696 -70.29402 1.84294 1.88108 -70.33834 488.22434
6830.0000 -72.79621 -71.39103 1.40519 1.83091 -70.82278 431.84201
6835.0000 -72.16475 -70.51504 1.64971 1.80503 -71.07267 412.99944
6840.0000 -72.77167 -70.97191 1.79977 1.84386 -70.69771 459.49055
6845.0000 -72.94311 -71.35839 1.58471 1.79484 -71.17096 413.99866
6850.0000 -72.96460 -71.35072 1.61388 1.77631 -71.34994 404.15651
6855.0000 -73.10653 -71.19580 1.91072 1.81672 -70.95979 439.73833
6860.0000 -72.39432 -70.98138 1.41294 1.80779 -71.04599 437.49756
6865.0000 -72.96032 -71.72177 1.23855 1.74568 -71.64565 370.29892
6870.0000 -73.31088 -71.82805 1.48283 1.71850 -71.90807 342.07813
6875.0000 -72.20451 -70.44663 1.75788 1.77682 -71.34499 411.78657
6880.0000 -72.75972 -71.07201 1.68771 1.81888 -70.93887 435.95314
6885.0000 -72.73718 -71.05051 1.68667 1.79276 -71.19113 421.97181
6890.0000 -72.69302 -71.53329 1.15974 1.79242 -71.19436 430.91785
6895.0000 -73.13778 -71.27076 1.86701 1.76856 -71.42477 380.28234
6900.0000 -72.86402 -71.11369 1.75033 1.78757 -71.24118 405.60984
6905.0000 -72.72090 -71.17534 1.54556 1.82408 -70.88867 455.83727
6910.0000 -72.48984 -70.16981 2.32004 1.84845 -70.65345 478.07734
6915.0000 -72.64690 -71.14392 1.50298 1.83132 -70.81885 447.96029
6920.0000 -72.92831 -71.14061 1.78770 1.79821 -71.13850 407.45502
6925.0000 -72.94004 -71.03444 1.90560 1.81684 -70.95862 442.70957
6930.0000 -73.04786 -71.28413 1.76373 1.82827 -70.84827 442.05585
6935.0000 -72.94106 -71.26273 1.67833 1.79685 -71.15157 420.13668
6940.0000 -72.56247 -70.68214 1.88033 1.80683 -71.05522 421.33031
6945.0000 -72.28257 -70.79706 1.48551 1.82828 -70.84813 441.71441
6950.0000 -72.50917 -70.72058 1.78859 1.83240 -70.80833 445.31704
6955.0000 -72.18045 -70.58599 1.59446 1.87634 -70.38418 497.12077
6960.0000 -72.49247 -71.11215 1.38032 1.83116 -70.82039 427.03845
6965.0000 -72.86233 -70.96562 1.89672 1.79248 -71.19376 402.88809
6970.0000 -72.65295 -71.25741 1.39555 1.80681 -71.05542 403.77208
6975.0000 -72.69505 -70.83550 1.85955 1.79732 -71.14706 403.67170
6980.0000 -72.61293 -70.96584 1.64709 1.82351 -70.89425 428.43540
6985.0000 -72.55911 -71.02242 1.53669 1.78863 -71.23099 401.47393
6990.0000 -72.67507 -71.18794 1.48713 1.81789 -70.94851 421.13641
6995.0000 -72.84944 -70.79327 2.05617 1.81882 -70.93948 423.09354
7000.0000 -72.65118 -70.77778 1.87340 1.82523 -70.87763 440.51571
FREEZING PROCESS: loop number 29 T-loop= 406.00000000000000
main_MD> interactions number 29 at Temperature= 406.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.19057 -2.68949 -0.72384
force_rgl> df(natom) -0.38551 1.46161 0.38578
7005.0000 -72.76255 -70.80766 1.95489 1.81528 -70.97370 429.80037
7010.0000 -72.34035 -70.70448 1.63587 1.83230 -70.80936 450.23870
7015.0000 -72.59763 -70.70443 1.89321 1.86185 -70.52404 458.08562
7020.0000 -72.48034 -71.07067 1.40968 1.82075 -70.92085 419.31937
7025.0000 -73.17564 -71.61783 1.55782 1.76705 -71.43929 363.26192
7030.0000 -72.75261 -71.41456 1.33805 1.77269 -71.38485 373.79368
7035.0000 -72.63179 -70.87320 1.75859 1.80299 -71.09234 404.83292
7040.0000 -72.71532 -71.37191 1.34341 1.81228 -71.00259 419.70030
7045.0000 -72.95939 -71.45503 1.50436 1.76319 -71.47663 370.30720
7050.0000 -73.19654 -71.57735 1.61920 1.77277 -71.38406 385.42093
7055.0000 -72.52134 -71.15452 1.36682 1.76382 -71.47050 363.84414
7060.0000 -71.93901 -70.65723 1.28178 1.82366 -70.89280 386.26439
7065.0000 -72.37181 -70.55946 1.81235 1.84570 -70.67992 419.17434
7070.0000 -72.98005 -71.35885 1.62120 1.81318 -70.99397 425.99229
7075.0000 -73.11773 -71.82549 1.29225 1.76200 -71.48812 359.25681
7080.0000 -72.73505 -71.14607 1.58898 1.80190 -71.10280 421.77478
7085.0000 -72.58321 -71.04571 1.53750 1.83763 -70.75789 459.01646
7090.0000 -72.85801 -70.88375 1.97425 1.83190 -70.81320 451.82944
7095.0000 -72.96051 -71.24922 1.71129 1.80231 -71.09888 405.95527
7100.0000 -72.69828 -71.40367 1.29461 1.74380 -71.66384 351.81261
7105.0000 -72.85198 -70.99970 1.85228 1.80602 -71.06310 423.78180
7110.0000 -72.29903 -70.40887 1.89016 1.82036 -70.92463 424.94178
7115.0000 -72.62875 -70.56246 2.06628 1.83316 -70.80104 440.37063
7120.0000 -72.94397 -71.08461 1.85937 1.83945 -70.74027 459.04092
7125.0000 -73.29342 -71.80706 1.48635 1.77456 -71.36678 397.12593
7130.0000 -72.89690 -71.65925 1.23765 1.73466 -71.75208 352.29605
7135.0000 -72.99811 -71.73984 1.25826 1.74640 -71.63874 357.03752
7140.0000 -73.20699 -71.73557 1.47142 1.73837 -71.71624 349.13753
7145.0000 -72.88491 -71.43045 1.45446 1.75965 -71.51077 391.02672
7150.0000 -72.63497 -70.98835 1.64662 1.77853 -71.32849 420.91584
7155.0000 -72.75149 -70.78876 1.96273 1.82998 -70.83177 480.09713
7160.0000 -72.67543 -70.62348 2.05195 1.86229 -70.51978 492.70823
7165.0000 -72.43505 -70.60696 1.82809 1.82514 -70.87846 452.11639
7170.0000 -73.11382 -71.27718 1.83664 1.81278 -70.99778 449.34971
7175.0000 -72.87339 -71.06754 1.80585 1.77393 -71.37286 391.45634
7180.0000 -72.61511 -71.14195 1.47316 1.78137 -71.30102 403.01032
7185.0000 -73.19760 -71.73338 1.46422 1.75187 -71.58591 377.34260
7190.0000 -72.65332 -71.18197 1.47136 1.78360 -71.27951 410.11557
7195.0000 -73.02136 -71.54321 1.47815 1.77216 -71.38994 397.72943
7200.0000 -73.02163 -71.91923 1.10241 1.76340 -71.47455 391.54372
7205.0000 -73.04739 -71.55962 1.48777 1.76291 -71.47931 384.05435
7210.0000 -73.12608 -71.27639 1.84969 1.78372 -71.27841 409.79344
7215.0000 -72.92391 -71.40138 1.52253 1.73226 -71.77521 349.71143
7220.0000 -73.15404 -71.43308 1.72096 1.76433 -71.46554 369.55194
7225.0000 -73.43901 -72.19345 1.24556 1.71846 -71.90845 341.46801
7230.0000 -73.02399 -71.52770 1.49629 1.74719 -71.63111 378.40909
7235.0000 -72.31496 -70.99557 1.31939 1.83055 -70.82620 460.52460
7240.0000 -72.24419 -70.82832 1.41588 1.82830 -70.84798 436.72518
7245.0000 -72.68730 -71.30599 1.38131 1.80853 -71.03885 412.05356
7250.0000 -72.83639 -71.22127 1.61512 1.79236 -71.19498 396.74841
FREEZING PROCESS: loop number 30 T-loop= 381.00000000000000
main_MD> interactions number 30 at Temperature= 381.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.43756 -2.58750 -0.87717
force_rgl> df(natom) 0.02029 0.37833 0.13376
7255.0000 -73.16144 -71.64708 1.51436 1.74426 -71.65934 328.51558
7260.0000 -73.04038 -71.67361 1.36677 1.72963 -71.80060 319.73249
7265.0000 -72.86406 -71.47043 1.39362 1.76703 -71.43951 357.14139
7270.0000 -72.09959 -70.59118 1.50840 1.80827 -71.04134 391.09608
7275.0000 -72.70401 -71.35346 1.35055 1.81511 -70.97535 417.76831
7280.0000 -73.03142 -71.48883 1.54259 1.77191 -71.39236 369.88477
7285.0000 -73.47208 -71.69367 1.77841 1.76555 -71.45378 378.12418
7290.0000 -72.76050 -71.53927 1.22123 1.74644 -71.63830 357.28630
7295.0000 -72.98257 -71.57209 1.41049 1.76652 -71.44441 371.82249
7300.0000 -72.50099 -71.54030 0.96068 1.77949 -71.31922 375.54604
7305.0000 -72.94436 -71.59770 1.34666 1.77182 -71.39328 355.70744
7310.0000 -72.89156 -71.38818 1.50338 1.77432 -71.36908 369.88957
7315.0000 -72.60709 -70.84314 1.76394 1.80780 -71.04593 415.16381
7320.0000 -72.53425 -70.89014 1.64411 1.84203 -70.71537 446.03043
7325.0000 -72.48257 -70.95942 1.52315 1.80640 -71.05937 417.40681
7330.0000 -73.01774 -71.56531 1.45243 1.81158 -71.00939 451.14137
7335.0000 -73.17143 -71.51746 1.65396 1.77471 -71.36540 385.19670
7340.0000 -72.95192 -71.77964 1.17228 1.73865 -71.71353 347.23227
7345.0000 -73.26593 -71.71126 1.55466 1.74569 -71.64553 369.53146
7350.0000 -73.25765 -71.62313 1.63452 1.72130 -71.88101 336.14918
7355.0000 -73.17071 -71.73331 1.43740 1.75225 -71.58225 347.35877
7360.0000 -73.02325 -71.49241 1.53084 1.74454 -71.65667 367.03683
7365.0000 -72.99114 -71.51581 1.47533 1.76301 -71.47830 383.75362
7370.0000 -73.02281 -71.83074 1.19207 1.74326 -71.66901 369.17484
7375.0000 -72.58353 -70.93478 1.64875 1.77791 -71.33448 385.15477
7380.0000 -72.96869 -71.41057 1.55812 1.77987 -71.31552 402.44359
7385.0000 -72.94476 -71.34763 1.59713 1.76276 -71.48073 392.08803
7390.0000 -73.02806 -71.93836 1.08969 1.74313 -71.67022 358.47833
7395.0000 -72.80883 -71.42166 1.38717 1.75399 -71.56538 388.13379
7400.0000 -72.93152 -71.47536 1.45616 1.76366 -71.47209 378.53554
7405.0000 -73.28286 -71.88869 1.39417 1.74608 -71.64179 379.87509
7410.0000 -73.40032 -71.98581 1.41451 1.72323 -71.86238 344.75590
7415.0000 -73.33057 -71.83086 1.49972 1.70475 -72.04079 323.99433
7420.0000 -73.36296 -72.20644 1.15653 1.72548 -71.84072 350.27457
7425.0000 -73.20378 -71.69820 1.50558 1.69904 -72.09595 316.38366
7430.0000 -73.16084 -72.02753 1.13331 1.72122 -71.88182 332.58091
7435.0000 -73.09752 -71.49165 1.60587 1.71465 -71.94525 313.63885
7440.0000 -73.11686 -71.37910 1.73776 1.75886 -71.51841 373.43002
7445.0000 -73.34272 -71.96492 1.37780 1.73706 -71.72885 347.20818
7450.0000 -72.97586 -71.79750 1.17836 1.74135 -71.68750 359.70179
7455.0000 -72.98182 -71.57933 1.40249 1.75712 -71.53522 378.18230
7460.0000 -73.34663 -71.82663 1.52000 1.74010 -71.69947 363.57896
7465.0000 -73.34600 -71.62435 1.72166 1.76608 -71.44870 384.06203
7470.0000 -72.55818 -71.31644 1.24174 1.75888 -71.51823 385.41203
7475.0000 -73.05090 -71.73448 1.31642 1.77784 -71.33518 412.14817
7480.0000 -72.98437 -71.50421 1.48016 1.73837 -71.71624 350.19206
7485.0000 -73.18889 -71.78797 1.40092 1.74183 -71.68286 349.50910
7490.0000 -73.19752 -72.04987 1.14765 1.73130 -71.78447 349.26940
7495.0000 -72.69028 -71.20850 1.48178 1.75494 -71.55625 373.67349
7500.0000 -73.24994 -71.85231 1.39764 1.76740 -71.43591 386.47671
FREEZING PROCESS: loop number 31 T-loop= 356.00000000000000
main_MD> interactions number 31 at Temperature= 356.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.85235 2.92607 0.88213
force_rgl> df(natom) 0.31081 -1.45496 -0.40208
7505.0000 -73.15649 -71.80816 1.34833 1.71995 -71.89402 331.64319
7510.0000 -73.19738 -71.16269 2.03469 1.75390 -71.56626 373.16537
7515.0000 -72.77177 -71.61929 1.15248 1.72283 -71.86626 338.74844
7520.0000 -73.23401 -71.78678 1.44723 1.72439 -71.85124 336.60241
7525.0000 -73.09901 -71.86003 1.23898 1.72490 -71.84625 320.71391
7530.0000 -73.22667 -71.89132 1.33534 1.73105 -71.78689 337.93518
7535.0000 -72.71476 -71.68321 1.03155 1.71688 -71.92375 343.97691
7540.0000 -72.87614 -71.74206 1.13408 1.73118 -71.78564 346.64433
7545.0000 -72.95124 -71.60752 1.34372 1.74634 -71.63926 358.19124
7550.0000 -72.96299 -71.68090 1.28209 1.76061 -71.50151 383.94851
7555.0000 -73.05005 -71.71720 1.33284 1.72971 -71.79988 346.96769
7560.0000 -72.63112 -71.42965 1.20146 1.73693 -71.73010 349.05332
7565.0000 -72.94277 -71.64919 1.29357 1.74914 -71.61225 358.60243
7570.0000 -72.81253 -71.10876 1.70378 1.77373 -71.37487 388.71353
7575.0000 -73.27491 -71.90265 1.37225 1.77076 -71.40350 388.01983
7580.0000 -73.10948 -71.78014 1.32935 1.73875 -71.71252 357.65442
7585.0000 -73.09070 -71.72262 1.36808 1.73425 -71.75598 358.03647
7590.0000 -73.11707 -71.75342 1.36365 1.74808 -71.62249 368.42719
7595.0000 -73.47517 -71.97741 1.49776 1.70542 -72.03440 322.71429
7600.0000 -73.15344 -72.02142 1.13202 1.69459 -72.13891 309.80352
7605.0000 -73.22642 -72.38091 0.84551 1.70005 -72.08617 317.59399
7610.0000 -73.57700 -72.66213 0.91487 1.67375 -72.34011 285.22596
7615.0000 -73.31946 -71.98429 1.33517 1.68499 -72.23162 300.61057
7620.0000 -73.15657 -71.80709 1.34948 1.73044 -71.79278 355.02720
7625.0000 -73.03579 -71.66234 1.37344 1.76011 -71.50630 381.98061
7630.0000 -73.01407 -71.23169 1.78238 1.77675 -71.34567 406.05498
7635.0000 -73.41620 -72.27127 1.14493 1.74022 -71.69840 351.36943
7640.0000 -73.35516 -72.37416 0.98100 1.68642 -72.21777 303.01311
7645.0000 -73.06549 -71.90913 1.15636 1.68474 -72.23401 300.19102
7650.0000 -72.55139 -71.26487 1.28652 1.75280 -71.57691 377.86768
7655.0000 -72.65247 -71.60373 1.04874 1.75483 -71.55726 379.98450
7660.0000 -72.85647 -71.51321 1.34325 1.75881 -71.51892 385.43555
7665.0000 -72.98787 -71.69120 1.29667 1.73821 -71.71777 358.11373
7670.0000 -73.18168 -71.67980 1.50188 1.73893 -71.71080 363.85169
7675.0000 -73.16575 -71.82334 1.34241 1.75287 -71.57620 384.82878
7680.0000 -72.95914 -71.67511 1.28404 1.71186 -71.97218 309.50684
7685.0000 -73.13546 -71.59935 1.53611 1.75968 -71.51048 363.31909
7690.0000 -73.09176 -71.94873 1.14302 1.74590 -71.64351 358.59100
7695.0000 -73.37682 -72.05559 1.32123 1.72262 -71.86830 348.06233
7700.0000 -73.19747 -71.98847 1.20900 1.70572 -72.03144 317.96630
7705.0000 -73.39177 -72.14202 1.24975 1.70925 -71.99733 330.70750
7710.0000 -72.93668 -71.84710 1.08958 1.73254 -71.77255 351.59180
7715.0000 -73.11443 -71.60425 1.51018 1.74478 -71.65436 358.73389
7720.0000 -73.29603 -71.49421 1.80182 1.73305 -71.76761 357.93674
7725.0000 -73.29415 -71.85601 1.43815 1.74528 -71.64951 368.68907
7730.0000 -73.62681 -72.29046 1.33635 1.69730 -72.11276 310.35922
7735.0000 -73.09961 -71.84475 1.25486 1.69799 -72.10605 304.17017
7740.0000 -73.03351 -71.95613 1.07739 1.74100 -71.69078 369.06066
7745.0000 -73.40840 -72.20216 1.20625 1.69038 -72.17953 298.63487
7750.0000 -73.25531 -71.91084 1.34447 1.69747 -72.11111 304.74887
FREEZING PROCESS: loop number 32 T-loop= 331.00000000000000
main_MD> interactions number 32 at Temperature= 331.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.13949 -1.75130 -0.14122
force_rgl> df(natom) 2.37098 0.98254 0.02010
7755.0000 -73.08881 -71.57515 1.51366 1.74044 -71.69621 359.07551
7760.0000 -73.10258 -71.73313 1.36945 1.72842 -71.81233 341.95524
7765.0000 -73.32668 -72.09894 1.22774 1.72404 -71.85459 345.21048
7770.0000 -73.54403 -72.13800 1.40603 1.68861 -72.19664 310.65376
7775.0000 -73.23443 -72.20977 1.02466 1.71712 -71.92143 343.71255
7780.0000 -73.51890 -72.19073 1.32817 1.68798 -72.20273 296.07138
7785.0000 -73.01708 -71.68982 1.32725 1.70521 -72.03635 331.92967
7790.0000 -72.90896 -71.49954 1.40942 1.73953 -71.70507 360.50505
7795.0000 -73.31402 -72.34371 0.97031 1.72611 -71.83456 339.72554
7800.0000 -73.27859 -72.06485 1.21374 1.69463 -72.13854 300.30050
7805.0000 -73.47589 -72.31487 1.16102 1.69207 -72.16322 296.74803
7810.0000 -73.17164 -71.96835 1.20329 1.70477 -72.04067 309.52682
7815.0000 -73.18562 -72.01187 1.17375 1.70484 -72.04000 317.12033
7820.0000 -73.38806 -72.24512 1.14294 1.69241 -72.16001 301.45037
7825.0000 -73.37645 -72.12046 1.25598 1.69717 -72.11404 311.81947
7830.0000 -73.44169 -72.26660 1.17510 1.68492 -72.23227 306.49292
7835.0000 -73.50425 -72.08175 1.42250 1.71410 -71.95056 331.11969
7840.0000 -73.44795 -72.37541 1.07254 1.70659 -72.02307 328.62169
7845.0000 -73.13966 -71.98109 1.15857 1.71107 -71.97981 323.91324
7850.0000 -73.29578 -72.09256 1.20322 1.72491 -71.84621 342.85809
7855.0000 -73.42990 -72.17445 1.25545 1.68647 -72.21734 303.54034
7860.0000 -73.06303 -71.86540 1.19762 1.69934 -72.09305 312.05317
7865.0000 -73.59421 -71.83699 1.75722 1.69689 -72.11675 321.81819
7870.0000 -73.24444 -72.03259 1.21185 1.72179 -71.87630 348.45260
7875.0000 -73.26840 -72.14631 1.12209 1.69560 -72.12915 306.14140
7880.0000 -73.19526 -72.19817 0.99709 1.68900 -72.19292 284.75837
7885.0000 -73.57343 -72.39585 1.17758 1.69009 -72.18236 297.25472
7890.0000 -73.41664 -72.26757 1.14907 1.68211 -72.25938 300.69579
7895.0000 -73.00264 -71.82610 1.17653 1.71503 -71.94152 330.72386
7900.0000 -73.62539 -72.12851 1.49687 1.71888 -71.90436 341.83419
7905.0000 -73.25381 -72.03645 1.21736 1.71458 -71.94587 333.83726
7910.0000 -73.24813 -71.89197 1.35616 1.72220 -71.87234 350.08174
7915.0000 -73.34438 -72.18061 1.16378 1.69169 -72.16690 312.18476
7920.0000 -73.25342 -72.07960 1.17382 1.70137 -72.07345 307.90304
7925.0000 -73.30644 -72.08234 1.22410 1.69938 -72.09269 308.68649
7930.0000 -73.21966 -71.92351 1.29615 1.70844 -72.00524 321.83465
7935.0000 -73.29049 -72.23592 1.05457 1.71116 -71.97892 336.34434
7940.0000 -73.41484 -71.97197 1.44286 1.69970 -72.08958 316.00265
7945.0000 -73.40506 -72.42799 0.97707 1.68304 -72.25040 296.05565
7950.0000 -73.19804 -72.21238 0.98566 1.68930 -72.19000 298.96511
7955.0000 -73.16065 -72.15840 1.00224 1.69490 -72.13588 314.11704
7960.0000 -73.26871 -71.89913 1.36958 1.71187 -71.97212 338.96592
7965.0000 -73.16871 -71.59427 1.57443 1.75615 -71.54452 374.99183
7970.0000 -73.00866 -71.45254 1.55612 1.73869 -71.71311 356.68773
7975.0000 -73.30915 -72.07153 1.23763 1.70176 -72.06971 320.11133
7980.0000 -73.18988 -72.16979 1.02008 1.69788 -72.10710 318.25255
7985.0000 -73.21140 -71.88587 1.32554 1.70765 -72.01280 317.98961
7990.0000 -73.27022 -71.93507 1.33515 1.70834 -72.00619 328.74424
7995.0000 -73.05303 -71.68375 1.36928 1.73970 -71.70338 352.80605
8000.0000 -73.31462 -72.15283 1.16179 1.73837 -71.71621 355.14752
FREEZING PROCESS: loop number 33 T-loop= 306.00000000000000
main_MD> interactions number 33 at Temperature= 306.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.29637 0.84934 -0.93545
force_rgl> df(natom) 0.17534 0.73049 1.64556
8005.0000 -73.38427 -72.20276 1.18151 1.70422 -72.04594 322.79670
8010.0000 -73.59203 -72.27756 1.31447 1.69234 -72.16064 307.18741
8015.0000 -73.09959 -72.20954 0.89005 1.69423 -72.14240 300.27009
8020.0000 -73.34925 -72.06114 1.28811 1.69449 -72.13984 307.82798
8025.0000 -73.49405 -72.12709 1.36695 1.69035 -72.17984 310.37646
8030.0000 -73.25381 -72.03885 1.21496 1.69531 -72.13198 313.40502
8035.0000 -73.32434 -72.15737 1.16697 1.69170 -72.16685 310.67953
8040.0000 -73.04128 -71.69561 1.34567 1.72849 -71.81159 349.72707
8045.0000 -72.85365 -71.76296 1.09069 1.72640 -71.83184 345.76544
8050.0000 -73.25857 -72.07334 1.18523 1.70057 -72.08117 319.85792
8055.0000 -73.49406 -72.28937 1.20469 1.69174 -72.16646 293.58529
8060.0000 -73.54225 -72.18094 1.36131 1.68121 -72.26805 300.10690
8065.0000 -73.34447 -72.11616 1.22831 1.68981 -72.18508 306.00676
8070.0000 -73.20669 -72.03447 1.17222 1.70159 -72.07134 308.68231
8075.0000 -73.18443 -72.03182 1.15261 1.69764 -72.10942 295.78674
8080.0000 -73.40343 -72.01335 1.39009 1.72579 -71.83766 319.65118
8085.0000 -73.48665 -72.26826 1.21839 1.71131 -71.97748 318.87354
8090.0000 -73.34927 -72.12682 1.22245 1.70402 -72.04786 313.67294
8095.0000 -73.50621 -72.17768 1.32853 1.69549 -72.13021 316.63109
8100.0000 -73.23937 -72.14002 1.09935 1.70008 -72.08592 323.61904
8105.0000 -73.32061 -72.05807 1.26254 1.70841 -72.00544 318.95017
8110.0000 -73.24712 -72.22808 1.01904 1.67949 -72.28467 286.15341
8115.0000 -73.12811 -71.82473 1.30338 1.69593 -72.12602 293.56489
8120.0000 -73.08412 -72.15385 0.93027 1.71959 -71.89757 313.06127
8125.0000 -73.20069 -71.61075 1.58994 1.71489 -71.94294 334.66849
8130.0000 -73.30400 -71.98951 1.31449 1.71483 -71.94353 326.57892
8135.0000 -73.43043 -71.97128 1.45915 1.69232 -72.16082 306.02708
8140.0000 -73.55936 -72.50304 1.05632 1.67369 -72.34068 284.77568
8145.0000 -73.54757 -72.34499 1.20258 1.65403 -72.53052 266.28015
8150.0000 -73.09103 -71.82733 1.26370 1.68741 -72.20821 308.78207
8155.0000 -72.98781 -71.82300 1.16481 1.72735 -71.82260 353.31256
8160.0000 -73.47155 -72.14694 1.32461 1.72270 -71.86751 346.60954
8165.0000 -73.53607 -72.53721 0.99886 1.65151 -72.55487 250.17898
8170.0000 -73.60261 -72.46915 1.13346 1.64401 -72.62724 252.01047
8175.0000 -73.21118 -72.24939 0.96180 1.66946 -72.38154 291.94512
8180.0000 -73.33999 -72.40638 0.93361 1.68645 -72.21746 296.10890
8185.0000 -73.34726 -72.04678 1.30048 1.68991 -72.18405 304.69085
8190.0000 -73.67085 -72.68977 0.98109 1.67801 -72.29904 288.37561
8195.0000 -73.52454 -72.46211 1.06243 1.65308 -72.53973 261.37082
8200.0000 -73.28458 -71.91293 1.37165 1.67173 -72.35962 284.89296
8205.0000 -73.37194 -72.35970 1.01224 1.69185 -72.16536 304.65000
8210.0000 -73.03776 -71.68226 1.35550 1.70383 -72.04969 305.72748
8215.0000 -73.37931 -71.99486 1.38445 1.73881 -71.71193 363.36221
8220.0000 -73.63070 -72.54081 1.08989 1.69138 -72.16991 301.79261
8225.0000 -73.22956 -72.24350 0.98606 1.66385 -72.43572 275.03180
8230.0000 -73.23375 -72.13547 1.09828 1.68698 -72.21236 302.82612
8235.0000 -73.77915 -72.54012 1.23902 1.66974 -72.37883 281.63312
8240.0000 -73.69810 -72.24160 1.45651 1.65656 -72.50606 262.41969
8245.0000 -73.27261 -71.89652 1.37610 1.70182 -72.06913 326.30262
8250.0000 -73.27975 -72.11940 1.16035 1.69076 -72.17589 297.47061
main_MD> EXECUTION TIME: 0 [day], 0 [hour], 4 [min], 53.5476883 [s].
main_MD> Deallocating global variables
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