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nanoparticlesims/growth_Melting_Silver_ICO_4091/freezeSims/run_75/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_75.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 = 75 ntipo2 = 0
read_input> Finish reading input
main_MD> Allocating global variables
main_MD> Number of outputs that will be created: 1750
main_MD> Size of nv and nvoiz: 75 7500
main_MD> Size of nv and nvoiz: 75 7500
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 = 75
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> 0.15976669671647234 2.6242794646962865E-002 -7.1412221696259146E-002 initial drift of cluster / NP1 for coalescence
init> 0.31214292053807841 0.34312340410359865 0.27530732097905025 scaling for velocity /for coalescence NP1
init.f90 > facguy = 3.6834166315828781E-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) -1.80823 2.64517 2.82708
force_rgl> df(natom) 1.33883 -0.69991 -0.90652
preparo> THERMALIZATION PROCESS AT 1178.8643685217007
preparo> TOTAL ENERGY, KINETIC EN., POT. ENERGY, DELTA
5000 -169.73442116087784 7.5709270603987600 -177.30534822127660 6.1887557611097160E-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 35
FREEZING PROCESS: loop number 1 T-loop= 1152.0000000000000
main_MD> interactions number 1 at Temperature= 1152.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -2.94353 -0.75030 -1.75234
force_rgl> df(natom) -1.03280 1.15698 -1.68788
5.0000 -176.12296 -165.63286 10.49011 3.03428 -167.28688 1115.03779
10.0000 -176.39309 -165.75513 10.63795 3.13446 -165.50527 1157.05020
15.0000 -177.16961 -166.92604 10.24357 3.15503 -165.13953 1161.74941
20.0000 -178.19703 -166.20313 11.99390 3.07778 -166.51332 1137.70162
25.0000 -177.21649 -164.86710 12.34939 3.06815 -166.68464 1139.15634
30.0000 -177.35728 -165.61449 11.74280 3.19561 -164.41786 1236.42159
35.0000 -177.47908 -165.97504 11.50404 3.17418 -164.79883 1240.91687
40.0000 -178.72603 -168.88371 9.84233 3.06547 -166.73223 1092.48565
45.0000 -179.42426 -169.27771 10.14655 2.93684 -169.01991 1034.16778
50.0000 -176.36044 -165.65656 10.70388 3.04302 -167.13159 1113.09374
55.0000 -174.69333 -164.33120 10.36213 3.13010 -165.58282 1187.20628
60.0000 -176.09253 -165.77857 10.31396 3.14671 -165.28752 1181.86621
65.0000 -174.77049 -164.03870 10.73178 3.19660 -164.40025 1242.97854
70.0000 -173.77929 -162.66524 11.11406 3.22112 -163.96408 1206.40490
75.0000 -175.92526 -163.18502 12.74024 3.21939 -163.99495 1229.78989
80.0000 -175.38694 -164.58656 10.80039 3.25541 -163.35428 1254.86844
85.0000 -177.81684 -166.65442 11.16242 3.12408 -165.68996 1162.36870
90.0000 -178.00290 -167.71435 10.28855 3.03096 -167.34592 1083.11391
95.0000 -178.15430 -167.66812 10.48618 3.03355 -167.29995 1097.79843
100.0000 -177.47397 -166.76754 10.70643 3.09455 -166.21503 1131.01296
105.0000 -176.91354 -166.50987 10.40368 3.03887 -167.20528 1103.13948
110.0000 -180.29899 -169.98023 10.31876 3.04232 -167.14391 1113.65794
115.0000 -178.37303 -168.12117 10.25186 2.87659 -170.09144 1027.42985
120.0000 -179.29240 -166.22345 13.06895 3.02390 -167.47158 1106.66871
125.0000 -177.76379 -167.22415 10.53964 3.11419 -165.86586 1182.55108
130.0000 -175.13748 -165.71698 9.42050 3.07900 -166.49163 1169.58113
135.0000 -177.15187 -164.13025 13.02162 3.16990 -164.87506 1193.39477
140.0000 -178.68287 -169.01689 9.66597 3.10126 -166.09578 1170.84379
145.0000 -178.63944 -167.48459 11.15485 2.99704 -167.94918 1107.35137
150.0000 -175.88646 -164.64403 11.24242 3.12926 -165.59780 1189.60050
155.0000 -174.12189 -164.57224 9.54966 3.25585 -163.34639 1256.06517
160.0000 -176.42753 -164.96609 11.46144 3.19407 -164.44517 1214.56492
165.0000 -177.16345 -165.66295 11.50051 3.10741 -165.98641 1175.40524
170.0000 -177.92355 -167.01470 10.90885 3.11428 -165.86411 1155.98747
175.0000 -177.33889 -166.40165 10.93723 3.06874 -166.67403 1167.67457
180.0000 -179.44705 -167.45706 11.98999 3.06271 -166.78135 1163.42875
185.0000 -178.28300 -166.63529 11.64771 2.98687 -168.13004 1105.71493
190.0000 -178.76180 -167.97330 10.78850 3.04154 -167.15787 1102.06446
195.0000 -177.27688 -165.05700 12.21988 3.08732 -166.34372 1103.96312
200.0000 -176.52880 -166.14778 10.38103 3.13856 -165.43234 1187.03162
205.0000 -176.50725 -166.23206 10.27519 3.07903 -166.49116 1145.03921
210.0000 -179.01923 -167.42979 11.58944 3.06212 -166.79177 1188.29032
215.0000 -176.52093 -164.63765 11.88328 3.10051 -166.10902 1131.20112
220.0000 -180.29111 -168.91847 11.37264 3.09260 -166.24969 1147.59365
225.0000 -178.58711 -166.96970 11.61740 2.98042 -168.24476 1117.63546
230.0000 -178.22767 -168.48227 9.74540 3.05682 -166.88611 1131.99177
235.0000 -176.84194 -165.47892 11.36302 3.02629 -167.42910 1107.95269
240.0000 -176.68512 -166.63348 10.05163 3.07452 -166.57123 1171.47040
245.0000 -178.37698 -166.26517 12.11181 3.04561 -167.08552 1124.60795
250.0000 -176.79285 -165.42431 11.36854 3.09911 -166.13405 1136.77019
FREEZING PROCESS: loop number 2 T-loop= 1127.0000000000000
main_MD> interactions number 2 at Temperature= 1127.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.27404 -4.03831 -3.66159
force_rgl> df(natom) -1.62308 -1.99095 -2.45233
255.0000 -178.15424 -166.09704 12.05720 3.09280 -166.24627 1152.32762
260.0000 -178.80597 -168.07080 10.73517 2.99322 -168.01721 1080.77534
265.0000 -179.56723 -170.50884 9.05839 2.91923 -169.33299 1054.06875
270.0000 -179.67268 -167.00727 12.66541 2.98118 -168.23130 1045.72107
275.0000 -180.77364 -169.21553 11.55811 2.98970 -168.07981 1102.09034
280.0000 -181.17118 -169.73671 11.43446 2.90366 -169.60999 1045.00427
285.0000 -177.27322 -165.24941 12.02381 3.01530 -167.62458 1101.96359
290.0000 -177.72296 -166.64695 11.07601 3.11139 -165.91566 1178.28506
295.0000 -177.25962 -164.39806 12.86156 3.10001 -166.11790 1148.00172
300.0000 -178.06252 -167.54059 10.52193 3.13054 -165.57510 1169.04864
305.0000 -179.00340 -167.00933 11.99408 3.03841 -167.21353 1114.73387
310.0000 -178.02822 -166.60042 11.42779 3.09606 -166.18821 1152.90116
315.0000 -177.92976 -166.15630 11.77346 3.04461 -167.10328 1121.45850
320.0000 -177.23884 -166.08033 11.15851 3.09856 -166.14385 1160.13991
325.0000 -177.10023 -167.49326 9.60696 3.07413 -166.57815 1125.09603
330.0000 -177.58398 -165.86061 11.72337 3.02025 -167.53638 1079.98267
335.0000 -179.35175 -166.44558 12.90618 3.14314 -165.35089 1184.96188
340.0000 -178.64927 -167.08129 11.56798 3.12748 -165.62944 1175.43804
345.0000 -179.06559 -168.28297 10.78262 3.04859 -167.03239 1095.48859
350.0000 -178.60839 -167.67813 10.93026 2.98284 -168.20179 1067.27337
355.0000 -176.39463 -166.96472 9.42991 3.01922 -167.55476 1110.61409
360.0000 -179.47063 -167.08605 12.38458 3.02618 -167.43095 1121.91977
365.0000 -177.64885 -166.24877 11.40008 3.10447 -166.03869 1173.56606
370.0000 -178.80689 -167.25827 11.54862 3.13177 -165.55309 1185.05138
375.0000 -177.47020 -166.03931 11.43089 3.08380 -166.40624 1137.18049
380.0000 -178.23128 -167.27037 10.96090 3.01852 -167.56724 1079.99843
385.0000 -177.82109 -166.57520 11.24590 3.04322 -167.12794 1083.11805
390.0000 -177.16272 -165.91530 11.24743 3.08867 -166.31962 1164.44256
395.0000 -178.01378 -167.59050 10.42328 3.13498 -165.49613 1183.80917
400.0000 -178.49349 -167.61067 10.88282 2.93992 -168.96508 1035.02597
405.0000 -177.87086 -167.76728 10.10357 3.00890 -167.73827 1111.44065
410.0000 -179.89067 -167.62934 12.26133 3.04549 -167.08755 1110.65473
415.0000 -178.67717 -168.07586 10.60132 2.96068 -168.59595 1064.04189
420.0000 -178.50149 -167.24035 11.26114 3.02408 -167.46827 1116.11853
425.0000 -177.70862 -165.59574 12.11288 3.09089 -166.28010 1129.51081
430.0000 -178.32027 -166.94722 11.37305 3.11703 -165.81535 1180.70803
435.0000 -179.15827 -167.92152 11.23675 2.99251 -168.02972 1055.45089
440.0000 -178.13923 -166.29958 11.83965 3.08011 -166.47195 1144.01094
445.0000 -176.92361 -166.43869 10.48493 3.12077 -165.74869 1182.66037
450.0000 -177.07601 -165.85469 11.22133 3.10146 -166.09222 1150.89795
455.0000 -179.34304 -166.64976 12.69328 3.05824 -166.86089 1083.65094
460.0000 -177.73741 -166.30294 11.43448 3.06795 -166.68820 1149.91326
465.0000 -177.93658 -167.29933 10.63725 3.03351 -167.30057 1127.72999
470.0000 -178.92869 -166.08297 12.84572 3.07287 -166.60061 1136.20609
475.0000 -176.98954 -166.21703 10.77250 3.13625 -165.47342 1202.25239
480.0000 -180.34164 -168.36373 11.97791 3.04959 -167.01470 1099.96173
485.0000 -179.45745 -166.91339 12.54406 3.06976 -166.65597 1138.90958
490.0000 -177.00503 -166.57280 10.43223 3.07323 -166.59432 1126.35356
495.0000 -178.21866 -167.95559 10.26307 3.09295 -166.24358 1150.56507
500.0000 -178.90596 -170.14191 8.76406 2.93026 -169.13696 1055.16466
FREEZING PROCESS: loop number 3 T-loop= 1102.0000000000000
main_MD> interactions number 3 at Temperature= 1102.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.09678 -1.12434 3.40930
force_rgl> df(natom) 2.88015 -0.64085 -2.22527
505.0000 -178.35718 -169.06337 9.29382 2.90892 -169.51641 1029.63710
510.0000 -178.66022 -167.78556 10.87465 2.90541 -169.57889 1027.18793
515.0000 -178.31735 -167.80074 10.51662 3.02138 -167.51630 1103.64854
520.0000 -180.48527 -170.38310 10.10217 2.89008 -169.85155 1031.00566
525.0000 -180.08603 -170.40669 9.67934 2.85450 -170.48429 1012.76011
530.0000 -178.48899 -167.97349 10.51550 2.93194 -169.10704 1037.03760
535.0000 -177.94960 -168.08116 9.86844 3.02134 -167.51705 1119.03400
540.0000 -176.93682 -165.63644 11.30038 3.01701 -167.59415 1118.12560
545.0000 -176.19530 -164.55685 11.63845 3.16013 -165.04873 1176.72089
550.0000 -175.73928 -164.03929 11.69999 3.18223 -164.65580 1229.98620
555.0000 -176.58650 -164.76991 11.81660 3.21942 -163.99436 1212.03963
560.0000 -178.45670 -167.48192 10.97479 3.09755 -166.16175 1176.72148
565.0000 -179.60302 -168.62667 10.97634 3.04486 -167.09877 1111.33043
570.0000 -177.33723 -166.59978 10.73744 3.00758 -167.76187 1127.29565
575.0000 -178.01284 -167.40716 10.60568 3.07203 -166.61554 1128.78051
580.0000 -177.08131 -165.98680 11.09451 3.04911 -167.02328 1110.26000
585.0000 -180.05404 -168.70198 11.35206 3.04493 -167.09748 1129.49432
590.0000 -179.29946 -168.96041 10.33905 3.00863 -167.74318 1122.55932
595.0000 -176.93101 -167.68448 9.24654 2.96041 -168.60069 1073.85391
600.0000 -176.79393 -165.49488 11.29905 3.06568 -166.72844 1145.48074
605.0000 -176.92866 -165.66734 11.26132 3.12928 -165.59741 1196.15275
610.0000 -175.84153 -164.61557 11.22596 3.18658 -164.57843 1230.05361
615.0000 -176.92473 -166.13141 10.79332 3.13990 -165.40861 1169.70695
620.0000 -178.85611 -166.37393 12.48218 3.05144 -166.98169 1140.38834
625.0000 -178.30109 -167.32885 10.97224 3.04018 -167.18210 1090.45615
630.0000 -176.62316 -166.48648 10.13667 3.05813 -166.86281 1132.43406
635.0000 -177.75462 -166.42318 11.33144 3.08410 -166.40100 1158.70549
640.0000 -176.65264 -164.68625 11.96639 3.11723 -165.81168 1189.91845
645.0000 -177.23353 -165.17106 12.06246 3.10282 -166.06796 1143.49363
650.0000 -179.33757 -167.76425 11.57332 3.12522 -165.66969 1169.52739
655.0000 -176.32954 -165.28430 11.04524 3.01401 -167.64741 1091.30744
660.0000 -176.76852 -166.81078 9.95774 3.12093 -165.74597 1180.34098
665.0000 -178.69979 -168.56264 10.13715 3.03269 -167.31514 1139.98791
670.0000 -178.62828 -167.91071 10.71757 3.00914 -167.73408 1095.72493
675.0000 -179.05497 -169.01132 10.04365 2.97079 -168.41601 1077.75412
680.0000 -180.41550 -169.90942 10.50608 2.95437 -168.70805 1069.69169
685.0000 -179.08255 -170.00018 9.08237 2.86871 -170.23153 1035.77189
690.0000 -177.99072 -168.73440 9.25632 2.87837 -170.05981 1013.86373
695.0000 -177.46782 -167.17107 10.29675 3.01923 -167.55458 1082.09575
700.0000 -179.10694 -169.78708 9.31986 2.97500 -168.34114 1074.95785
705.0000 -177.80085 -167.92987 9.87099 2.90080 -169.66091 1016.29189
710.0000 -180.46592 -168.70222 11.76370 2.96210 -168.57060 1101.11578
715.0000 -177.41344 -166.22528 11.18816 3.02883 -167.38386 1125.49441
720.0000 -176.80577 -164.86823 11.93754 3.15226 -165.18878 1201.02619
725.0000 -178.02592 -166.30447 11.72145 3.10353 -166.05542 1163.26944
730.0000 -177.80388 -166.78635 11.01753 3.03635 -167.25010 1117.62827
735.0000 -176.62076 -164.33075 12.29000 3.17977 -164.69942 1189.83260
740.0000 -175.98652 -165.43375 10.55277 3.16334 -164.99177 1150.96819
745.0000 -178.27833 -167.27161 11.00672 3.07046 -166.64343 1108.30117
750.0000 -179.87442 -167.73961 12.13481 3.02389 -167.47171 1136.89153
FREEZING PROCESS: loop number 4 T-loop= 1077.0000000000000
main_MD> interactions number 4 at Temperature= 1077.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -2.44929 -0.96533 1.00333
force_rgl> df(natom) 3.27132 1.98096 -0.83355
755.0000 -177.63371 -167.79483 9.83887 2.99413 -168.00103 1074.97307
760.0000 -176.96954 -166.59285 10.37669 3.06335 -166.76992 1148.20880
765.0000 -176.86686 -167.29766 9.56920 3.04512 -167.09409 1100.44866
770.0000 -177.75831 -166.13845 11.61986 3.08654 -166.35747 1118.50631
775.0000 -178.53817 -169.45411 9.08406 2.98215 -168.21409 1084.59757
780.0000 -177.52359 -167.46568 10.05791 3.04817 -167.03994 1099.31500
785.0000 -178.29857 -168.80182 9.49674 2.95230 -168.74487 1014.00724
790.0000 -179.34557 -168.29263 11.05294 2.92761 -169.18406 1075.04553
795.0000 -179.17859 -169.56718 9.61141 2.87617 -170.09877 1035.16118
800.0000 -179.73955 -169.50101 10.23853 2.91073 -169.48415 1043.58139
805.0000 -177.47011 -168.91190 8.55821 2.94513 -168.87247 1057.15617
810.0000 -178.39072 -166.28011 12.11061 3.00253 -167.85166 1075.16547
815.0000 -178.64498 -167.75041 10.89457 2.99759 -167.93942 1096.05577
820.0000 -177.78495 -167.55839 10.22656 2.95488 -168.69907 1069.60774
825.0000 -179.35350 -168.68288 10.67062 2.98238 -168.20989 1117.53853
830.0000 -179.73889 -169.70581 10.03308 2.86831 -170.23870 1006.13372
835.0000 -177.55078 -166.30221 11.24857 2.95996 -168.60865 1057.91636
840.0000 -176.65744 -167.25892 9.39853 3.13163 -165.55571 1211.19391
845.0000 -178.26411 -167.37857 10.88554 3.02224 -167.50109 1129.02376
850.0000 -179.35386 -168.36519 10.98867 2.97671 -168.31084 1109.95516
855.0000 -180.40499 -171.03732 9.36767 2.89912 -169.69064 1022.61658
860.0000 -177.65789 -166.10291 11.55498 2.98589 -168.14759 1076.12752
865.0000 -175.88919 -163.44044 12.44875 3.20303 -164.28584 1250.93677
870.0000 -178.56885 -166.72320 11.84565 3.10168 -166.08824 1146.25061
875.0000 -177.06782 -166.27772 10.79010 3.11105 -165.92160 1144.31336
880.0000 -179.27799 -167.96596 11.31204 3.00571 -167.79500 1097.69994
885.0000 -177.08233 -166.85331 10.22902 3.06218 -166.79075 1170.41900
890.0000 -176.42241 -166.50499 9.91741 3.12299 -165.70936 1191.62856
895.0000 -178.80561 -168.45291 10.35270 3.04503 -167.09571 1121.46695
900.0000 -179.61328 -168.71754 10.89574 2.93455 -169.06065 1056.04256
905.0000 -178.01159 -168.48065 9.53094 2.97519 -168.33791 1061.51529
910.0000 -177.51393 -165.33750 12.17642 3.01261 -167.67242 1102.78065
915.0000 -176.76208 -165.32216 11.43992 3.15048 -165.22047 1196.88725
920.0000 -179.23924 -168.43912 10.80012 3.05705 -166.88200 1128.00397
925.0000 -178.05373 -167.91621 10.13752 2.97264 -168.38324 1050.45352
930.0000 -179.16669 -168.60875 10.55794 2.95995 -168.60889 1074.07107
935.0000 -179.08560 -167.78944 11.29616 3.00684 -167.77496 1098.77625
940.0000 -174.42387 -163.97261 10.45126 3.09381 -166.22829 1176.41355
945.0000 -177.97215 -168.46800 9.50415 3.09699 -166.17166 1177.47932
950.0000 -180.72649 -172.05347 8.67302 2.85130 -170.54122 984.90157
955.0000 -180.35474 -169.62015 10.73459 2.80288 -171.40225 967.44194
960.0000 -177.83612 -167.78437 10.05175 2.92757 -169.18466 1013.99315
965.0000 -178.90718 -166.85694 12.05024 3.01086 -167.70344 1105.60702
970.0000 -178.59847 -167.28044 11.31803 3.03220 -167.32385 1126.78005
975.0000 -180.10768 -169.97918 10.12849 3.02838 -167.39195 1128.46124
980.0000 -179.08506 -170.39898 8.68609 2.86282 -170.33634 1038.62102
985.0000 -181.55814 -171.09009 10.46805 2.84691 -170.61927 1000.29751
990.0000 -180.05137 -169.16865 10.88273 2.86132 -170.36287 1027.16379
995.0000 -179.37607 -170.54489 8.83118 2.86640 -170.27266 985.84137
1000.0000 -180.94215 -171.18290 9.75925 2.84920 -170.57857 963.66963
FREEZING PROCESS: loop number 5 T-loop= 1052.0000000000000
main_MD> interactions number 5 at Temperature= 1052.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.01803 1.55146 -2.24448
force_rgl> df(natom) -0.38687 -0.94115 -0.90947
1005.0000 -179.54140 -171.13037 8.41103 2.79494 -171.54343 943.57062
1010.0000 -179.40180 -168.93713 10.46467 2.87938 -170.04179 1014.57399
1015.0000 -177.79025 -167.59158 10.19867 2.89684 -169.73120 1011.25312
1020.0000 -178.04745 -168.68013 9.36731 2.97554 -168.33161 1046.90826
1025.0000 -179.03804 -168.73953 10.29852 2.89290 -169.80123 1046.82103
1030.0000 -179.24454 -168.30546 10.93908 3.01078 -167.70491 1098.39258
1035.0000 -178.76461 -168.79310 9.97150 2.93313 -169.08576 1039.62630
1040.0000 -177.46181 -166.91433 10.54748 2.97002 -168.42970 1067.82969
1045.0000 -180.53662 -169.41765 11.11897 3.00806 -167.75334 1107.26179
1050.0000 -180.02249 -169.33083 10.69165 2.91428 -169.42113 1051.82807
1055.0000 -180.42465 -168.74796 11.67669 2.92689 -169.19683 1030.96773
1060.0000 -179.78501 -168.53518 11.24983 2.96924 -168.44369 1051.32083
1065.0000 -177.34246 -167.64021 9.70225 2.95691 -168.66287 1045.38659
1070.0000 -179.43060 -169.45680 9.97381 2.97453 -168.34964 1064.66211
1075.0000 -178.95673 -169.83383 9.12290 2.87399 -170.13765 1005.00290
1080.0000 -179.53971 -169.21466 10.32505 2.94915 -168.80097 1074.23268
1085.0000 -180.03611 -168.71028 11.32583 2.93414 -169.06788 1037.29156
1090.0000 -178.97802 -166.13622 12.84180 3.05581 -166.90403 1124.90354
1095.0000 -177.90523 -168.87832 9.02691 3.06048 -166.82096 1126.91568
1100.0000 -177.52299 -167.89306 9.62993 2.95441 -168.70736 1056.07804
1105.0000 -180.17415 -168.64708 11.52707 2.96718 -168.48035 1048.37685
1110.0000 -179.59883 -169.66509 9.93374 2.91528 -169.40338 1042.29575
1115.0000 -180.41096 -170.72059 9.69037 2.90937 -169.50836 1016.77752
1120.0000 -181.28897 -172.11549 9.17348 2.76306 -172.11036 927.78834
1125.0000 -179.75580 -169.45905 10.29675 2.84560 -170.64261 968.76627
1130.0000 -177.11120 -167.91089 9.20031 2.93924 -168.97719 1051.77003
1135.0000 -177.52473 -167.07130 10.45343 2.97907 -168.26888 1075.89283
1140.0000 -179.34045 -168.63487 10.70558 3.02497 -167.45259 1099.52850
1145.0000 -180.48968 -170.08178 10.40790 2.90501 -169.58591 1024.59819
1150.0000 -176.90288 -166.30094 10.60194 2.99310 -168.01926 1052.09209
1155.0000 -180.44345 -170.02735 10.41610 2.96379 -168.54061 1043.17862
1160.0000 -178.20444 -168.77504 9.42941 2.90301 -169.62155 1054.59219
1165.0000 -178.85039 -169.55582 9.29457 2.88523 -169.93780 1009.08099
1170.0000 -181.02574 -170.93276 10.09299 2.88811 -169.88649 1036.86125
1175.0000 -178.83258 -170.42989 8.40268 2.87423 -170.13331 993.96383
1180.0000 -178.42156 -167.32865 11.09291 2.93172 -169.11090 1082.37771
1185.0000 -178.55713 -167.83331 10.72382 3.04318 -167.12866 1128.32037
1190.0000 -177.98355 -167.27605 10.70750 2.96063 -168.59683 1074.71068
1195.0000 -179.13268 -168.49306 10.63962 3.00209 -167.85946 1106.68394
1200.0000 -179.53305 -168.72733 10.80571 2.94237 -168.92150 1051.24850
1205.0000 -179.07771 -169.50813 9.56958 2.90662 -169.55726 1008.81086
1210.0000 -178.87048 -168.39624 10.47424 2.98059 -168.24183 1058.26476
1215.0000 -180.65735 -170.61008 10.04727 2.90665 -169.55670 1046.91799
1220.0000 -180.24765 -169.40313 10.84453 2.89885 -169.69557 1007.99774
1225.0000 -180.19747 -170.05022 10.14725 2.87490 -170.12138 1009.37794
1230.0000 -177.68774 -167.03564 10.65210 3.03662 -167.24539 1131.60904
1235.0000 -181.88168 -172.51509 9.36659 2.93259 -169.09544 1048.41546
1240.0000 -179.39152 -170.33133 9.06019 2.82025 -171.09328 940.85060
1245.0000 -179.87938 -170.30623 9.57315 2.90831 -169.52732 1042.40237
1250.0000 -180.54967 -171.15221 9.39746 2.87271 -170.16042 1007.20661
FREEZING PROCESS: loop number 6 T-loop= 1027.0000000000000
main_MD> interactions number 6 at Temperature= 1027.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.03640 -7.02886 -5.03812
force_rgl> df(natom) 1.38682 -0.59099 -1.82366
1255.0000 -182.41500 -173.41854 8.99646 2.76128 -172.14211 922.10565
1260.0000 -181.50731 -172.36188 9.14543 2.74528 -172.42670 908.70270
1265.0000 -179.59849 -169.64865 9.94984 2.82444 -171.01883 973.99511
1270.0000 -180.78900 -170.19936 10.58964 2.92544 -169.22263 1046.30004
1275.0000 -180.29009 -171.74175 8.54834 2.84883 -170.58511 1022.60655
1280.0000 -179.32364 -170.65651 8.66713 2.82793 -170.95675 978.67843
1285.0000 -179.90893 -170.22021 9.68872 2.80878 -171.29733 979.90430
1290.0000 -179.84939 -168.53542 11.31398 2.97527 -168.33634 1089.04404
1295.0000 -180.36543 -170.32996 10.03548 2.89251 -169.80816 1011.23485
1300.0000 -178.99426 -169.05224 9.94202 2.91698 -169.37298 1048.11221
1305.0000 -177.53107 -165.84920 11.68187 3.02621 -167.43050 1121.01048
1310.0000 -178.41783 -168.54779 9.87003 3.02871 -167.38609 1089.57796
1315.0000 -180.27140 -171.63482 8.63659 2.83403 -170.84825 984.89328
1320.0000 -179.03396 -168.36599 10.66797 2.93336 -169.08177 1062.93493
1325.0000 -179.47279 -171.29282 8.17997 2.88833 -169.88259 992.01241
1330.0000 -180.44266 -168.01502 12.42763 2.91206 -169.46061 1014.31278
1335.0000 -177.01271 -167.07020 9.94251 3.00784 -167.75721 1108.91279
1340.0000 -177.12250 -167.33554 9.78696 3.09091 -166.27975 1116.94812
1345.0000 -177.10412 -165.07565 12.02847 3.08813 -166.32925 1082.53265
1350.0000 -175.93592 -166.02252 9.91340 3.11412 -165.86710 1128.25410
1355.0000 -179.21867 -167.08169 12.13698 3.03174 -167.33206 1124.58907
1360.0000 -179.24271 -168.53412 10.70859 2.99102 -168.05634 1084.16756
1365.0000 -181.24160 -169.68789 11.55371 2.90724 -169.54625 1008.90349
1370.0000 -178.54536 -168.38285 10.16252 2.94705 -168.83836 1046.67156
1375.0000 -178.69827 -169.07543 9.62284 2.91832 -169.34917 1054.80369
1380.0000 -180.02913 -170.53984 9.48929 2.85795 -170.42283 975.65136
1385.0000 -180.49352 -170.46587 10.02765 2.87179 -170.17670 1017.12507
1390.0000 -179.53316 -170.49854 9.03462 2.84516 -170.65028 1004.00543
1395.0000 -177.42524 -167.81536 9.60988 2.96922 -168.44398 1045.26883
1400.0000 -178.10151 -168.08027 10.02124 3.02471 -167.45723 1070.57404
1405.0000 -181.03237 -170.97815 10.05422 2.87038 -170.20180 1022.09542
1410.0000 -180.35247 -170.28813 10.06434 2.86689 -170.26398 1026.44103
1415.0000 -177.81051 -168.37980 9.43071 2.94676 -168.84338 1069.36183
1420.0000 -178.75407 -167.03792 11.71615 2.97875 -168.27454 1078.34570
1425.0000 -178.82289 -167.72984 11.09305 3.01840 -167.56934 1089.33341
1430.0000 -179.73908 -170.37542 9.36365 2.93965 -168.96981 1034.61048
1435.0000 -178.30612 -167.85684 10.44927 2.91359 -169.43333 1034.81366
1440.0000 -178.73136 -166.40730 12.32406 3.07369 -166.58606 1172.18488
1445.0000 -178.97037 -169.49039 9.47998 3.03312 -167.30758 1124.06980
1450.0000 -179.30692 -169.84981 9.45711 2.92133 -169.29575 1011.85665
1455.0000 -180.47746 -171.60074 8.87672 2.89374 -169.78638 1028.13458
1460.0000 -179.54855 -168.78740 10.76115 2.87384 -170.14020 1020.45686
1465.0000 -180.28896 -169.76313 10.52583 2.90633 -169.56242 1047.80378
1470.0000 -180.35806 -171.10475 9.25331 2.85553 -170.46600 984.47695
1475.0000 -177.98319 -167.63184 10.35135 2.92653 -169.20329 1057.28110
1480.0000 -178.20296 -169.85382 8.34914 2.96099 -168.59028 1035.66605
1485.0000 -181.11936 -169.94135 11.17801 2.88900 -169.87074 999.46945
1490.0000 -180.30117 -171.52054 8.78062 2.82630 -170.98567 984.85729
1495.0000 -181.49419 -171.77557 9.71862 2.77981 -171.81257 949.50753
1500.0000 -178.87937 -169.40649 9.47287 2.84437 -170.66435 965.70557
FREEZING PROCESS: loop number 7 T-loop= 1002.0000000000000
main_MD> interactions number 7 at Temperature= 1002.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.57720 1.81413 -0.67922
force_rgl> df(natom) 0.33515 -0.00669 -0.23660
1505.0000 -178.50633 -168.81054 9.69578 2.88266 -169.98340 962.19799
1510.0000 -180.57516 -171.70412 8.87104 2.88603 -169.92341 967.47529
1515.0000 -178.35713 -170.48981 7.86732 2.79257 -171.58570 948.55292
1520.0000 -180.30331 -170.76328 9.54004 2.83030 -170.91467 1001.85953
1525.0000 -180.21658 -170.89777 9.31881 2.86925 -170.22199 968.23664
1530.0000 -179.56816 -171.12181 8.44636 2.83809 -170.77605 996.64754
1535.0000 -180.77953 -170.64623 10.13331 2.84839 -170.59294 999.49326
1540.0000 -181.59629 -171.58231 10.01399 2.79801 -171.48880 959.92199
1545.0000 -183.23539 -172.93285 10.30254 2.72163 -172.84719 956.94786
1550.0000 -181.01268 -171.89033 9.12235 2.74957 -172.35034 956.43619
1555.0000 -181.95053 -173.95549 7.99503 2.70594 -173.12627 912.63216
1560.0000 -182.22647 -173.26794 8.95852 2.72777 -172.73809 907.98247
1565.0000 -181.65638 -171.93162 9.72475 2.72400 -172.80520 913.36777
1570.0000 -181.91329 -172.33045 9.58284 2.76187 -172.13156 907.29083
1575.0000 -180.04667 -168.92748 11.11919 2.86306 -170.33201 1004.11201
1580.0000 -180.13745 -168.43508 11.70236 2.93808 -168.99779 1072.03707
1585.0000 -178.28019 -168.06057 10.21963 3.00682 -167.77530 1125.87944
1590.0000 -179.05022 -167.75301 11.29721 2.98405 -168.18027 1077.25767
1595.0000 -180.53127 -170.52254 10.00873 2.92673 -169.19972 1035.80102
1600.0000 -179.53541 -170.77589 8.75952 2.86961 -170.21546 1009.82501
1605.0000 -182.12003 -172.32715 9.79288 2.78748 -171.67614 938.80364
1610.0000 -180.39308 -170.56833 9.82476 2.81820 -171.12988 990.71274
1615.0000 -177.52369 -168.92896 8.59472 2.88853 -169.87899 1041.18135
1620.0000 -180.08523 -170.50158 9.58365 2.89523 -169.75986 991.79170
1625.0000 -181.65834 -171.28356 10.37477 2.86887 -170.22867 1009.70627
1630.0000 -180.60128 -171.38850 9.21278 2.86740 -170.25486 985.51093
1635.0000 -180.84293 -172.58662 8.25631 2.77779 -171.84842 930.10899
1640.0000 -180.61612 -169.73148 10.88464 2.79664 -171.51332 955.31447
1645.0000 -178.05797 -168.93476 9.12321 2.86917 -170.22328 1000.60387
1650.0000 -179.50017 -169.00042 10.49974 2.93393 -169.07162 1048.85425
1655.0000 -179.29506 -169.65653 9.63853 2.89117 -169.83201 1022.89193
1660.0000 -180.41186 -171.40211 9.00974 2.89903 -169.69231 1017.55516
1665.0000 -181.69449 -172.28556 9.40892 2.75613 -172.23367 899.25681
1670.0000 -179.96860 -170.95023 9.01837 2.82081 -171.08345 989.83718
1675.0000 -181.41294 -172.48627 8.92666 2.77214 -171.94894 913.73517
1680.0000 -181.30727 -171.89821 9.40906 2.76061 -172.15399 912.30023
1685.0000 -180.78591 -171.67268 9.11322 2.76848 -172.01412 915.33855
1690.0000 -179.89996 -169.92932 9.97064 2.82394 -171.02777 968.46613
1695.0000 -177.40840 -169.18155 8.22685 2.96245 -168.56446 1088.77455
1700.0000 -178.83236 -169.79516 9.03720 2.83547 -170.82273 978.42959
1705.0000 -180.66998 -171.11036 9.55962 2.83409 -170.84726 1001.51506
1710.0000 -179.92531 -171.27803 8.64728 2.80930 -171.28810 969.54311
1715.0000 -180.05795 -171.45657 8.60138 2.82703 -170.97270 956.55823
1720.0000 -182.07241 -172.64178 9.43063 2.74118 -172.49958 901.03169
1725.0000 -181.53528 -171.65509 9.88019 2.77674 -171.86715 931.06955
1730.0000 -180.27115 -171.17951 9.09164 2.79884 -171.47409 949.10297
1735.0000 -179.61118 -170.21796 9.39321 2.88706 -169.90519 1038.55897
1740.0000 -179.66203 -169.81828 9.84375 2.88296 -169.97814 1008.67981
1745.0000 -179.90297 -171.59967 8.30330 2.80607 -171.34554 940.24925
1750.0000 -180.20239 -171.05348 9.14891 2.78414 -171.73559 924.74138
FREEZING PROCESS: loop number 8 T-loop= 977.00000000000000
main_MD> interactions number 8 at Temperature= 977.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.82278 -1.28276 1.38127
force_rgl> df(natom) 1.93599 -1.00025 -1.27671
1755.0000 -181.32214 -171.46251 9.85962 2.83969 -170.74763 991.17459
1760.0000 -179.66414 -170.90995 8.75420 2.77857 -171.83463 980.14253
1765.0000 -181.92400 -171.31357 10.61043 2.87210 -170.17122 994.70728
1770.0000 -181.23281 -171.52258 9.71023 2.80628 -171.34172 964.32062
1775.0000 -182.89208 -172.29482 10.59726 2.78080 -171.79501 982.24566
1780.0000 -179.74811 -169.62975 10.11836 2.82161 -171.06911 991.93138
1785.0000 -180.67573 -171.25492 9.42081 2.81563 -171.17559 973.32904
1790.0000 -179.81763 -170.54792 9.26971 2.83475 -170.83556 982.77883
1795.0000 -179.59064 -170.78131 8.80933 2.84430 -170.66567 976.86438
1800.0000 -179.69737 -168.86801 10.82936 2.99776 -167.93641 1081.10883
1805.0000 -179.04484 -168.76424 10.28059 2.92795 -169.17792 1037.69235
1810.0000 -179.73961 -168.62145 11.11815 3.01113 -167.69868 1080.01616
1815.0000 -180.61124 -170.24310 10.36814 2.87495 -170.12047 991.41349
1820.0000 -179.79598 -169.78197 10.01400 2.86922 -170.22240 1021.71044
1825.0000 -180.52654 -170.93514 9.59140 2.82437 -171.02013 979.08631
1830.0000 -179.12599 -170.21663 8.90937 2.86668 -170.26767 987.49168
1835.0000 -181.60224 -173.19930 8.40294 2.76637 -172.05152 921.00020
1840.0000 -181.76725 -172.85307 8.91418 2.72941 -172.70890 912.11437
1845.0000 -180.45670 -170.57778 9.87892 2.73007 -172.69715 945.70443
1850.0000 -179.44990 -171.15726 8.29264 2.79023 -171.62722 959.80901
1855.0000 -180.21082 -171.63985 8.57097 2.81560 -171.17612 951.64637
1860.0000 -180.12438 -170.94414 9.18024 2.82126 -171.07535 958.98264
1865.0000 -183.39233 -173.06088 10.33145 2.76179 -172.13308 939.14263
1870.0000 -181.23368 -171.99077 9.24291 2.75965 -172.17102 928.01232
1875.0000 -181.34426 -170.77078 10.57348 2.84810 -170.59805 999.79322
1880.0000 -180.72079 -171.68308 9.03771 2.78905 -171.64821 950.10224
1885.0000 -180.70906 -171.81269 8.89637 2.77968 -171.81495 934.04098
1890.0000 -181.73435 -173.39489 8.33947 2.73237 -172.65623 901.66955
1895.0000 -180.15689 -172.14664 8.01026 2.72157 -172.84834 914.99121
1900.0000 -181.04788 -170.45404 10.59385 2.78660 -171.69180 954.49149
1905.0000 -179.34153 -170.18253 9.15900 2.83066 -170.90825 961.06151
1910.0000 -180.10437 -170.62614 9.47823 2.87211 -170.17100 1014.57554
1915.0000 -179.73161 -170.79524 8.93637 2.82531 -171.00346 995.37389
1920.0000 -179.50955 -170.92374 8.58581 2.77685 -171.86513 927.68632
1925.0000 -180.34270 -169.72736 10.61534 2.92592 -169.21415 1007.48798
1930.0000 -180.13795 -170.83047 9.30748 2.88552 -169.93258 1037.08430
1935.0000 -182.60794 -173.16236 9.44557 2.77614 -171.87775 958.98734
1940.0000 -182.75519 -173.41011 9.34508 2.74459 -172.43887 937.30750
1945.0000 -181.35795 -174.05818 7.29976 2.66235 -173.90161 853.26086
1950.0000 -183.45820 -173.56334 9.89486 2.66557 -173.84424 884.94701
1955.0000 -181.14708 -172.91549 8.23159 2.72704 -172.75108 924.73016
1960.0000 -181.54152 -169.89300 11.64851 2.83328 -170.86159 977.85802
1965.0000 -179.25711 -168.17564 11.08147 2.92695 -169.19571 1045.54741
1970.0000 -179.40045 -169.81892 9.58153 2.93303 -169.08767 1049.17317
1975.0000 -179.78750 -169.58420 10.20330 2.89058 -169.84254 1018.96769
1980.0000 -181.67898 -171.97471 9.70427 2.89222 -169.81341 1021.25214
1985.0000 -182.19951 -173.35666 8.84285 2.72329 -172.81776 902.83522
1990.0000 -183.23566 -173.41758 9.81808 2.71363 -172.98954 905.51182
1995.0000 -182.57446 -174.87135 7.70311 2.63463 -174.39451 821.46794
2000.0000 -180.66911 -170.53857 10.13053 2.76624 -172.05393 954.64656
FREEZING PROCESS: loop number 9 T-loop= 952.00000000000000
main_MD> interactions number 9 at Temperature= 952.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 5.61389 3.97251 -2.58467
force_rgl> df(natom) -0.15174 1.19739 0.05485
2005.0000 -181.62926 -172.67009 8.95917 2.83240 -170.87736 980.49235
2010.0000 -182.57037 -173.32228 9.24809 2.64069 -174.28665 853.57124
2015.0000 -181.05436 -172.72594 8.32842 2.69125 -173.38758 862.11791
2020.0000 -181.87633 -172.87000 9.00633 2.72116 -172.85563 906.49349
2025.0000 -182.50474 -172.68582 9.81892 2.75513 -172.25141 925.25067
2030.0000 -181.43149 -172.63417 8.79732 2.73841 -172.54891 937.47910
2035.0000 -180.44508 -173.23747 7.20761 2.75929 -172.17756 932.95184
2040.0000 -181.87001 -171.53821 10.33179 2.75011 -172.34074 930.62854
2045.0000 -181.30764 -172.83142 8.47623 2.76597 -172.05874 941.17816
2050.0000 -180.42342 -171.88609 8.53733 2.70166 -173.20239 902.27297
2055.0000 -181.89569 -172.03343 9.86226 2.75402 -172.27124 931.38395
2060.0000 -181.16987 -173.22665 7.94323 2.76220 -172.12569 963.77507
2065.0000 -180.58127 -173.41798 7.16330 2.72425 -172.80066 917.54795
2070.0000 -180.13298 -172.44827 7.68470 2.76196 -172.13008 884.07601
2075.0000 -180.35835 -172.21995 8.13840 2.79186 -171.59820 900.17912
2080.0000 -181.50392 -170.92182 10.58209 2.82872 -170.94265 983.20141
2085.0000 -179.57861 -169.82524 9.75337 2.82541 -171.00151 963.14268
2090.0000 -181.78633 -172.35166 9.43467 2.75463 -172.26037 908.76458
2095.0000 -178.89175 -170.83548 8.05628 2.76783 -172.02565 951.33650
2100.0000 -181.48413 -173.42358 8.06055 2.77490 -171.89991 945.11334
2105.0000 -180.70975 -172.24776 8.46199 2.73127 -172.67591 877.62028
2110.0000 -182.32128 -170.99384 11.32744 2.79927 -171.46645 953.27793
2115.0000 -179.30027 -171.34065 7.95962 2.73225 -172.65845 924.98951
2120.0000 -181.63184 -172.91549 8.71635 2.76227 -172.12453 933.17526
2125.0000 -178.68693 -168.99969 9.68724 2.78041 -171.80183 963.01089
2130.0000 -180.16105 -171.54730 8.61375 2.85437 -170.48651 959.42113
2135.0000 -183.07072 -174.71853 8.35219 2.68340 -173.52709 845.31955
2140.0000 -181.18747 -173.27865 7.90882 2.67435 -173.68815 869.88613
2145.0000 -181.39879 -172.88027 8.51851 2.76343 -172.10394 906.39841
2150.0000 -181.18405 -171.81536 9.36868 2.77699 -171.86272 948.45479
2155.0000 -180.74476 -171.21237 9.53239 2.73973 -172.52529 922.83159
2160.0000 -180.93604 -170.80695 10.12909 2.78328 -171.75092 931.05208
2165.0000 -181.42198 -171.78224 9.63974 2.74208 -172.48362 934.40053
2170.0000 -179.62974 -169.84952 9.78022 2.80087 -171.43801 966.88549
2175.0000 -181.08094 -171.64974 9.43120 2.81986 -171.10038 970.24480
2180.0000 -180.71200 -170.72427 9.98773 2.84697 -170.61816 990.19318
2185.0000 -180.14106 -171.30533 8.83572 2.83272 -170.87160 987.29689
2190.0000 -182.43226 -173.95964 8.47262 2.75462 -172.26064 935.01650
2195.0000 -182.09481 -173.39498 8.69983 2.63736 -174.34593 849.74689
2200.0000 -179.56044 -171.23408 8.32635 2.76506 -172.07495 933.97781
2205.0000 -180.81743 -172.96378 7.85365 2.75869 -172.18819 929.08106
2210.0000 -181.80322 -174.20530 7.59792 2.69137 -173.38533 876.56492
2215.0000 -181.21426 -173.15250 8.06176 2.67006 -173.76436 865.40397
2220.0000 -183.61909 -174.94819 8.67090 2.68434 -173.51052 888.89515
2225.0000 -182.97974 -174.66457 8.31517 2.68724 -173.45884 894.50611
2230.0000 -182.28712 -172.84356 9.44356 2.68320 -173.53064 896.43785
2235.0000 -181.69818 -172.65230 9.04588 2.74052 -172.51124 915.12701
2240.0000 -182.04917 -171.24766 10.80151 2.75552 -172.24458 951.30828
2245.0000 -178.90160 -170.72405 8.17755 2.78279 -171.75963 918.03000
2250.0000 -180.43862 -171.25638 9.18224 2.81465 -171.19291 946.17135
FREEZING PROCESS: loop number 10 T-loop= 927.00000000000000
main_MD> interactions number 10 at Temperature= 927.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -2.49196 -3.44801 -1.58219
force_rgl> df(natom) -0.20338 -1.69290 0.12833
2255.0000 -180.61847 -171.37437 9.24410 2.78019 -171.80583 971.75681
2260.0000 -180.51615 -172.46369 8.05247 2.78867 -171.65494 947.79662
2265.0000 -181.19725 -171.26683 9.93043 2.81021 -171.27196 983.53008
2270.0000 -180.24448 -171.13541 9.10907 2.82295 -171.04542 970.96458
2275.0000 -179.40403 -170.65418 8.74985 2.84837 -170.59317 982.50833
2280.0000 -180.37116 -170.24086 10.13030 2.93331 -169.08268 1008.50645
2285.0000 -181.70775 -172.18176 9.52599 2.79850 -171.48019 919.65101
2290.0000 -179.92065 -171.25069 8.66996 2.79691 -171.50836 934.52630
2295.0000 -181.13921 -172.80294 8.33627 2.78852 -171.65759 968.71917
2300.0000 -179.69292 -170.56164 9.13129 2.82747 -170.96500 980.48313
2305.0000 -179.09408 -169.29578 9.79830 2.90199 -169.63970 1018.92737
2310.0000 -182.17537 -171.56021 10.61517 2.87082 -170.19407 1007.42094
2315.0000 -181.75000 -173.84134 7.90866 2.74271 -172.47240 939.06173
2320.0000 -180.62130 -171.54727 9.07403 2.77412 -171.91378 938.65008
2325.0000 -181.76836 -173.91281 7.85555 2.67688 -173.64309 860.18168
2330.0000 -180.82062 -173.05365 7.76697 2.65409 -174.04847 837.83342
2335.0000 -183.66012 -174.76860 8.89152 2.66006 -173.94229 861.24823
2340.0000 -182.52850 -174.30735 8.22115 2.58884 -175.20895 837.88550
2345.0000 -182.78774 -173.63866 9.14907 2.60875 -174.85473 833.32568
2350.0000 -180.82830 -173.20376 7.62454 2.66461 -173.86135 885.68256
2355.0000 -182.33654 -172.63688 9.69965 2.70729 -173.10230 914.46296
2360.0000 -182.04148 -171.72468 10.31680 2.75574 -172.24069 934.62263
2365.0000 -181.04590 -172.67846 8.36744 2.73671 -172.57907 887.37642
2370.0000 -182.56828 -172.91409 9.65419 2.73254 -172.65327 897.51412
2375.0000 -182.80346 -172.88586 9.91759 2.75792 -172.20188 938.90868
2380.0000 -179.81422 -171.38813 8.42609 2.79491 -171.54409 964.07017
2385.0000 -181.02176 -173.18567 7.83610 2.73159 -172.67006 917.13552
2390.0000 -180.33393 -170.82716 9.50677 2.73631 -172.58613 938.19645
2395.0000 -181.20081 -172.87158 8.32923 2.79150 -171.60464 927.03684
2400.0000 -179.93332 -172.19861 7.73470 2.74195 -172.48585 897.75028
2405.0000 -181.45805 -173.84427 7.61378 2.73448 -172.61867 898.72530
2410.0000 -181.34531 -172.18096 9.16435 2.74022 -172.51662 926.40562
2415.0000 -180.70357 -171.60507 9.09850 2.74886 -172.36296 936.87903
2420.0000 -182.52863 -175.18139 7.34724 2.74739 -172.38918 929.77122
2425.0000 -181.34129 -173.14449 8.19679 2.63706 -174.35122 862.56321
2430.0000 -180.60858 -171.02756 9.58102 2.76292 -172.11292 960.80347
2435.0000 -181.03164 -170.33484 10.69680 2.82898 -170.93807 1000.17911
2440.0000 -179.22385 -168.99556 10.22829 2.90311 -169.61980 1029.74946
2445.0000 -180.93618 -171.91850 9.01768 2.89489 -169.76592 1025.53371
2450.0000 -183.70175 -174.60201 9.09974 2.73335 -172.63875 928.07160
2455.0000 -183.32030 -175.58712 7.73319 2.59967 -175.01628 820.37457
2460.0000 -180.93980 -171.13539 9.80442 2.69628 -173.29814 910.46964
2465.0000 -180.00766 -170.56699 9.44067 2.82221 -171.05849 985.10002
2470.0000 -180.58817 -171.02287 9.56530 2.86685 -170.26467 1005.06582
2475.0000 -182.81866 -171.53768 11.28098 2.75073 -172.32973 919.37030
2480.0000 -181.81473 -173.46233 8.35240 2.78293 -171.75710 919.91134
2485.0000 -182.29716 -174.11926 8.17790 2.64739 -174.16759 888.03932
2490.0000 -181.43553 -172.15199 9.28354 2.69997 -173.23251 909.46426
2495.0000 -184.05759 -175.46752 8.59007 2.70272 -173.18349 914.08390
2500.0000 -181.98238 -174.53302 7.44936 2.62587 -174.55038 834.54719
FREEZING PROCESS: loop number 11 T-loop= 902.00000000000000
main_MD> interactions number 11 at Temperature= 902.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -3.15509 -1.40127 -1.48015
force_rgl> df(natom) -0.48829 3.76388 0.50735
2505.0000 -181.97461 -173.99677 7.97784 2.66364 -173.87852 873.21139
2510.0000 -181.83671 -172.78478 9.05193 2.71437 -172.97638 872.78898
2515.0000 -180.70255 -173.20542 7.49713 2.70964 -173.06045 899.73341
2520.0000 -180.61281 -171.58351 9.02930 2.72064 -172.86486 911.35758
2525.0000 -180.10577 -169.91583 10.18994 2.81486 -171.18918 961.36221
2530.0000 -183.23516 -174.70297 8.53219 2.76089 -172.14905 931.70825
2535.0000 -182.18641 -173.34976 8.83665 2.64109 -174.27957 852.14812
2540.0000 -182.84493 -174.46069 8.38424 2.65757 -173.98649 891.15327
2545.0000 -181.93313 -172.13783 9.79530 2.64948 -174.13048 875.52039
2550.0000 -182.08491 -172.76601 9.31890 2.72093 -172.85972 903.43276
2555.0000 -182.05957 -172.72096 9.33860 2.74716 -172.39320 932.04048
2560.0000 -181.68465 -173.18676 8.49789 2.66896 -173.78406 887.93917
2565.0000 -182.08872 -172.56830 9.52043 2.72174 -172.84533 903.46177
2570.0000 -183.45734 -174.84868 8.60867 2.63250 -174.43243 835.34547
2575.0000 -181.76030 -170.59327 11.16703 2.72601 -172.76942 945.18585
2580.0000 -179.73123 -170.35273 9.37850 2.87653 -170.09239 980.45239
2585.0000 -180.93216 -172.47617 8.45599 2.75993 -172.16605 939.94384
2590.0000 -181.22142 -171.84379 9.37763 2.78615 -171.69988 964.27021
2595.0000 -180.96173 -172.34707 8.61466 2.71197 -173.01906 904.47166
2600.0000 -181.47114 -173.14692 8.32422 2.67555 -173.66673 893.49675
2605.0000 -180.74770 -172.05416 8.69354 2.76898 -172.00510 941.72884
2610.0000 -183.28905 -173.33821 9.95084 2.67759 -173.63056 881.55559
2615.0000 -179.91625 -170.46344 9.45281 2.76118 -172.14386 928.23566
2620.0000 -180.58016 -172.28650 8.29365 2.82577 -170.99523 967.07625
2625.0000 -182.43369 -172.32996 10.10373 2.75910 -172.18083 933.76737
2630.0000 -181.06151 -171.34617 9.71534 2.74204 -172.48420 936.93882
2635.0000 -182.32629 -174.45330 7.87299 2.73877 -172.54237 933.85318
2640.0000 -181.97104 -172.59187 9.37917 2.65403 -174.04943 882.13401
2645.0000 -182.98886 -173.89380 9.09506 2.64104 -174.28044 851.14214
2650.0000 -182.82415 -173.89662 8.92753 2.66771 -173.80622 870.91106
2655.0000 -180.67591 -171.63296 9.04294 2.78391 -171.73958 949.09692
2660.0000 -183.33001 -174.28177 9.04824 2.67421 -173.69054 894.38386
2665.0000 -182.21246 -175.00177 7.21070 2.57191 -175.50991 835.64003
2670.0000 -183.16364 -175.88697 7.27667 2.60855 -174.85832 816.25896
2675.0000 -181.05721 -172.71727 8.33994 2.60001 -175.01020 830.45150
2680.0000 -181.13184 -172.70482 8.42702 2.74792 -172.37972 921.59708
2685.0000 -181.64453 -172.71394 8.93058 2.69508 -173.31952 894.58099
2690.0000 -180.66328 -172.50468 8.15860 2.69989 -173.23396 891.48545
2695.0000 -183.28377 -173.70408 9.57969 2.74085 -172.50541 930.61706
2700.0000 -180.35966 -172.18495 8.17471 2.69424 -173.33440 909.29159
2705.0000 -181.94275 -172.49800 9.44475 2.72714 -172.74924 929.46234
2710.0000 -182.22735 -173.24662 8.98073 2.73048 -172.68994 912.75604
2715.0000 -182.52363 -174.02461 8.49903 2.66947 -173.77489 869.97068
2720.0000 -182.35999 -172.20246 10.15753 2.66118 -173.92232 850.54062
2725.0000 -180.71301 -171.33247 9.38054 2.80770 -171.31650 975.95869
2730.0000 -181.69913 -172.81844 8.88069 2.74967 -172.34856 924.80841
2735.0000 -183.39090 -173.67612 9.71478 2.68501 -173.49856 889.34548
2740.0000 -181.57654 -171.71059 9.86595 2.72996 -172.69915 884.14367
2745.0000 -182.21453 -172.89554 9.31899 2.78540 -171.71321 951.72639
2750.0000 -181.99794 -172.62968 9.36826 2.79718 -171.50363 954.73697
FREEZING PROCESS: loop number 12 T-loop= 877.00000000000000
main_MD> interactions number 12 at Temperature= 877.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.18347 -1.48744 -1.60740
force_rgl> df(natom) -0.90039 0.99475 -0.01897
2755.0000 -183.40230 -174.23196 9.17033 2.68073 -173.57460 882.81350
2760.0000 -180.12833 -171.39306 8.73527 2.75182 -172.31030 915.17369
2765.0000 -181.65308 -173.64552 8.00756 2.69644 -173.29524 890.54734
2770.0000 -179.31612 -171.36723 7.94889 2.79147 -171.60526 939.62423
2775.0000 -181.42093 -173.60087 7.82006 2.77490 -171.89993 949.04874
2780.0000 -184.21694 -175.05642 9.16052 2.65890 -173.96288 862.47753
2785.0000 -181.21048 -172.55435 8.65613 2.61380 -174.76493 852.41959
2790.0000 -182.25787 -173.46502 8.79285 2.75434 -172.26548 919.60493
2795.0000 -182.93089 -174.62297 8.30792 2.66970 -173.77087 891.93767
2800.0000 -182.48006 -174.60067 7.87939 2.61076 -174.81898 833.79862
2805.0000 -185.46513 -176.51169 8.95344 2.54846 -175.92706 808.20528
2810.0000 -184.05366 -175.56957 8.48409 2.54916 -175.91450 799.64423
2815.0000 -182.73236 -174.72982 8.00254 2.58717 -175.23865 805.99960
2820.0000 -182.05371 -171.49134 10.56237 2.68098 -173.57012 894.36125
2825.0000 -181.89554 -172.94628 8.94925 2.75763 -172.20707 904.99225
2830.0000 -183.48932 -174.88108 8.60823 2.66741 -173.81148 860.39366
2835.0000 -179.88251 -171.28843 8.59409 2.74449 -172.44075 941.16577
2840.0000 -181.68655 -174.53521 7.15134 2.70464 -173.14939 910.48057
2845.0000 -182.37243 -173.96203 8.41039 2.63867 -174.32266 822.63551
2850.0000 -182.33037 -173.48586 8.84451 2.66157 -173.91540 851.98103
2855.0000 -180.78255 -171.57044 9.21210 2.74732 -172.39029 924.82256
2860.0000 -182.84510 -171.87275 10.97234 2.81405 -171.20362 959.47648
2865.0000 -183.25464 -172.99247 10.26217 2.73574 -172.59634 923.17452
2870.0000 -181.75108 -172.45257 9.29851 2.75103 -172.32431 926.77952
2875.0000 -180.40585 -171.51031 8.89554 2.74194 -172.48608 908.97927
2880.0000 -181.43629 -172.98331 8.45297 2.67503 -173.67610 864.43354
2885.0000 -181.87279 -172.09873 9.77406 2.75772 -172.20534 939.64552
2890.0000 -182.48482 -173.72063 8.76419 2.71987 -172.87857 927.48101
2895.0000 -182.96865 -174.14725 8.82140 2.63598 -174.37043 856.37449
2900.0000 -184.29032 -175.51743 8.77289 2.59369 -175.12262 832.83094
2905.0000 -183.59266 -174.27357 9.31909 2.59850 -175.03705 836.33485
2910.0000 -181.61818 -173.16160 8.45658 2.67495 -173.67736 866.00454
2915.0000 -182.23169 -172.82323 9.40846 2.65983 -173.94635 892.64635
2920.0000 -182.57986 -174.17911 8.40075 2.67558 -173.66619 894.99864
2925.0000 -181.92907 -173.76601 8.16305 2.66879 -173.78694 865.30202
2930.0000 -181.36049 -173.74100 7.61949 2.67490 -173.67836 866.91823
2935.0000 -182.95946 -174.17142 8.78804 2.68521 -173.49500 886.60399
2940.0000 -182.70775 -174.11848 8.58927 2.62435 -174.57727 852.02992
2945.0000 -183.24802 -174.98793 8.26009 2.63762 -174.34141 855.59213
2950.0000 -180.04345 -171.35628 8.68717 2.72748 -172.74318 897.57687
2955.0000 -181.22859 -172.68495 8.54364 2.77263 -171.94025 920.59366
2960.0000 -180.12397 -171.61764 8.50633 2.72190 -172.84243 907.79895
2965.0000 -182.92576 -174.72347 8.20229 2.66130 -173.92025 857.60510
2970.0000 -183.89656 -177.99777 5.89879 2.50801 -176.64632 772.96469
2975.0000 -183.25462 -174.66951 8.58511 2.53579 -176.15239 782.10597
2980.0000 -184.14052 -175.70903 8.43149 2.57587 -175.43957 822.44726
2985.0000 -181.63732 -173.53056 8.10677 2.64268 -174.25131 857.50200
2990.0000 -182.53769 -173.98020 8.55749 2.68475 -173.50309 856.21185
2995.0000 -182.05664 -173.71302 8.34362 2.68293 -173.53551 894.82593
3000.0000 -182.37185 -175.15099 7.22087 2.63580 -174.37363 874.91807
FREEZING PROCESS: loop number 13 T-loop= 852.00000000000000
main_MD> interactions number 13 at Temperature= 852.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.14380 -2.47317 0.30263
force_rgl> df(natom) -0.37446 1.14386 0.39306
3005.0000 -183.70341 -174.93936 8.76405 2.60099 -174.99272 849.08079
3010.0000 -181.72578 -173.39431 8.33147 2.59321 -175.13110 813.46677
3015.0000 -183.04792 -173.97091 9.07701 2.66080 -173.92910 880.01758
3020.0000 -182.20923 -173.70056 8.50867 2.60778 -174.87211 861.98818
3025.0000 -183.44078 -174.67772 8.76306 2.61373 -174.76620 801.97179
3030.0000 -183.14392 -174.10762 9.03630 2.67982 -173.59090 897.55347
3035.0000 -180.52673 -172.57963 7.94710 2.68886 -173.43014 872.67286
3040.0000 -180.53093 -173.06423 7.46670 2.69451 -173.32950 892.97944
3045.0000 -182.20291 -174.65869 7.54422 2.65093 -174.10465 843.58206
3050.0000 -183.63709 -175.86125 7.77584 2.56974 -175.54849 792.23068
3055.0000 -183.62474 -176.23812 7.38662 2.54481 -175.99193 788.50705
3060.0000 -183.67219 -174.95768 8.71451 2.57147 -175.51776 823.45150
3065.0000 -182.77947 -174.68346 8.09601 2.63214 -174.43873 844.81510
3070.0000 -183.06463 -175.60940 7.45523 2.63597 -174.37070 844.69299
3075.0000 -184.27326 -177.33692 6.93634 2.56983 -175.54690 815.04849
3080.0000 -182.50691 -175.23802 7.26890 2.51714 -176.48399 762.74176
3085.0000 -182.34415 -173.53540 8.80875 2.66168 -173.91336 906.76978
3090.0000 -181.48838 -172.91177 8.57661 2.70554 -173.13345 909.16900
3095.0000 -181.90693 -173.53851 8.36843 2.69381 -173.34207 879.25435
3100.0000 -182.48097 -173.31122 9.16975 2.69579 -173.30689 903.01091
3105.0000 -183.50563 -174.64391 8.86172 2.64552 -174.20082 858.57162
3110.0000 -182.49394 -172.46789 10.02605 2.69070 -173.39732 906.38476
3115.0000 -184.87922 -175.92820 8.95102 2.66742 -173.81134 877.60011
3120.0000 -184.96025 -176.20721 8.75303 2.51701 -176.48636 769.65715
3125.0000 -184.08050 -176.11335 7.96715 2.54159 -176.04923 806.96195
3130.0000 -183.67619 -176.07355 7.60264 2.57124 -175.52184 822.37366
3135.0000 -183.42762 -175.86219 7.56543 2.55341 -175.83894 776.64723
3140.0000 -181.18798 -172.87595 8.31203 2.62487 -174.56815 857.09938
3145.0000 -183.82277 -174.92984 8.89294 2.72601 -172.76944 931.75175
3150.0000 -182.24910 -174.91862 7.33048 2.61052 -174.82326 851.06746
3155.0000 -182.08553 -174.39102 7.69451 2.65224 -174.08137 846.61264
3160.0000 -182.20258 -173.37831 8.82427 2.69634 -173.29701 869.28988
3165.0000 -182.50695 -172.55148 9.95547 2.74404 -172.44869 925.71359
3170.0000 -184.21379 -174.64595 9.56784 2.70273 -173.18341 920.07728
3175.0000 -182.48347 -175.43791 7.04557 2.55888 -175.74171 809.96627
3180.0000 -182.88855 -173.99820 8.89035 2.58634 -175.25325 833.49225
3185.0000 -182.51771 -173.65956 8.85815 2.63727 -174.34752 840.85194
3190.0000 -183.16448 -176.50588 6.65859 2.62236 -174.61279 868.76025
3195.0000 -183.99619 -175.75565 8.24054 2.52054 -176.42358 774.34363
3200.0000 -183.24149 -176.38607 6.85542 2.50054 -176.77923 760.88425
3205.0000 -183.06195 -175.21046 7.85149 2.55028 -175.89468 775.79522
3210.0000 -182.37495 -173.81583 8.55912 2.64833 -174.15088 873.77011
3215.0000 -181.88622 -175.41033 6.47589 2.61736 -174.70158 823.00909
3220.0000 -183.34839 -175.87515 7.47324 2.57327 -175.48574 816.87490
3225.0000 -182.78486 -175.65476 7.13009 2.56368 -175.65636 809.35664
3230.0000 -182.62534 -172.98723 9.63811 2.59244 -175.14480 826.83884
3235.0000 -181.73109 -173.21426 8.51683 2.61729 -174.70293 838.50403
3240.0000 -182.42057 -173.80300 8.61756 2.66461 -173.86127 877.79510
3245.0000 -180.62158 -172.30916 8.31242 2.71020 -173.05059 877.77049
3250.0000 -181.04784 -172.71971 8.32812 2.75077 -172.32907 919.59307
FREEZING PROCESS: loop number 14 T-loop= 827.00000000000000
main_MD> interactions number 14 at Temperature= 827.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 3.88854 0.85273 0.61784
force_rgl> df(natom) 3.45732 7.97085 1.45491
3255.0000 -181.64069 -172.87163 8.76906 2.70674 -173.11212 894.84534
3260.0000 -184.27256 -175.63682 8.63574 2.64469 -174.21569 868.88438
3265.0000 -184.04809 -176.26785 7.78024 2.57219 -175.50500 814.87924
3270.0000 -182.68878 -175.68647 7.00231 2.54354 -176.01455 788.69052
3275.0000 -184.04067 -175.83286 8.20781 2.56973 -175.54867 791.65385
3280.0000 -184.51824 -176.35428 8.16396 2.52867 -176.27898 774.59171
3285.0000 -182.64187 -175.53792 7.10395 2.56122 -175.70004 793.36417
3290.0000 -181.99389 -173.98702 8.00688 2.61494 -174.74478 822.65212
3295.0000 -183.58556 -175.52403 8.06153 2.57891 -175.38546 816.82878
3300.0000 -183.35851 -174.57731 8.78120 2.63345 -174.41555 844.53863
3305.0000 -185.02600 -176.93228 8.09372 2.54026 -176.07285 800.32261
3310.0000 -184.51615 -176.00021 8.51595 2.49659 -176.84941 772.49593
3315.0000 -183.68793 -176.20308 7.48484 2.49846 -176.81631 769.07306
3320.0000 -184.22913 -176.62628 7.60285 2.50400 -176.71768 762.58114
3325.0000 -183.92496 -175.88766 8.03730 2.52571 -176.33162 770.40818
3330.0000 -183.06856 -175.20208 7.86648 2.61384 -174.76419 831.26020
3335.0000 -184.12010 -177.80973 6.31037 2.53779 -176.11683 764.29002
3340.0000 -183.29704 -176.33164 6.96540 2.46412 -177.42688 734.96551
3345.0000 -184.14541 -175.43044 8.71497 2.56199 -175.68632 800.71612
3350.0000 -184.37912 -176.22544 8.15368 2.56720 -175.59374 823.85641
3355.0000 -183.51863 -177.21057 6.30806 2.53341 -176.19470 790.15980
3360.0000 -185.11307 -177.76274 7.35033 2.48179 -177.11265 745.15394
3365.0000 -184.41373 -177.09879 7.31494 2.43796 -177.89210 743.53085
3370.0000 -183.92347 -177.27241 6.65106 2.44247 -177.81190 721.80374
3375.0000 -184.72930 -178.00183 6.72747 2.44394 -177.78577 735.95856
3380.0000 -183.59408 -175.15748 8.43660 2.46724 -177.37148 749.71035
3385.0000 -184.63921 -176.71064 7.92857 2.52522 -176.34040 792.40682
3390.0000 -183.45622 -175.94623 7.50999 2.52401 -176.36187 775.08638
3395.0000 -182.26597 -174.42752 7.83844 2.58890 -175.20778 812.58997
3400.0000 -182.49268 -175.03429 7.45838 2.60056 -175.00046 792.63449
3405.0000 -182.32570 -174.14276 8.18293 2.62623 -174.54392 843.02320
3410.0000 -180.96628 -172.40152 8.56475 2.67892 -173.60690 865.97024
3415.0000 -184.55391 -176.10614 8.44777 2.63629 -174.36493 852.09144
3420.0000 -181.40209 -172.75908 8.64301 2.62483 -174.56888 858.88044
3425.0000 -182.65314 -173.28144 9.37171 2.70874 -173.07652 905.52107
3430.0000 -181.98275 -173.06523 8.91751 2.68386 -173.51900 881.54798
3435.0000 -183.20253 -173.88243 9.32010 2.68230 -173.54668 868.61402
3440.0000 -181.96239 -174.29297 7.66942 2.65947 -173.95269 851.52781
3445.0000 -181.87564 -173.49346 8.38218 2.68290 -173.53611 881.37155
3450.0000 -183.13388 -173.55981 9.57407 2.66695 -173.81971 875.78690
3455.0000 -183.27153 -174.99071 8.28082 2.68805 -173.44446 881.79586
3460.0000 -184.10713 -176.54393 7.56320 2.59513 -175.09707 830.75499
3465.0000 -183.73045 -175.95164 7.77881 2.56295 -175.66930 789.07995
3470.0000 -183.85663 -174.55525 9.30138 2.56998 -175.54421 805.21935
3475.0000 -183.94972 -174.85758 9.09214 2.61601 -174.72565 855.56252
3480.0000 -183.60294 -176.00148 7.60146 2.57405 -175.47189 814.75688
3485.0000 -181.45531 -173.32528 8.13002 2.63291 -174.42517 862.93341
3490.0000 -182.60523 -173.47432 9.13091 2.72363 -172.81169 887.69545
3495.0000 -183.12149 -174.98701 8.13449 2.66635 -173.83043 869.42549
3500.0000 -183.29936 -175.78147 7.51790 2.57182 -175.51150 825.93337
FREEZING PROCESS: loop number 15 T-loop= 802.00000000000000
main_MD> interactions number 15 at Temperature= 802.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.81432 4.14081 -0.62966
force_rgl> df(natom) -1.96994 2.85255 -0.57966
3505.0000 -183.45099 -175.32101 8.12998 2.60152 -174.98328 828.84653
3510.0000 -181.74113 -174.00556 7.73557 2.61721 -174.70435 831.16343
3515.0000 -182.64249 -173.89819 8.74430 2.65377 -174.05417 868.65441
3520.0000 -183.84804 -174.69316 9.15488 2.64083 -174.28429 849.77115
3525.0000 -184.40454 -178.23448 6.17006 2.53822 -176.10912 788.09843
3530.0000 -183.99762 -175.89265 8.10497 2.50274 -176.74004 744.07886
3535.0000 -184.31854 -176.15436 8.16418 2.50399 -176.71788 742.97218
3540.0000 -183.12008 -175.77878 7.34130 2.58325 -175.30831 827.80501
3545.0000 -182.38894 -175.32095 7.06800 2.54957 -175.90731 820.93947
3550.0000 -182.91811 -174.79344 8.12468 2.57988 -175.36818 807.29603
3555.0000 -183.28130 -175.61768 7.66361 2.63652 -174.36094 854.18697
3560.0000 -184.74721 -176.55697 8.19024 2.53815 -176.11033 796.87987
3565.0000 -182.90967 -175.91248 6.99719 2.50179 -176.75705 766.01359
3570.0000 -183.28959 -176.57018 6.71941 2.58171 -175.33558 806.34184
3575.0000 -185.02804 -177.82261 7.20543 2.51474 -176.52661 769.03079
3580.0000 -183.90734 -177.83201 6.07533 2.45640 -177.56431 739.87476
3585.0000 -184.18005 -176.37867 7.80138 2.51121 -176.58947 779.19745
3590.0000 -185.39179 -177.87839 7.51339 2.52026 -176.42854 764.85256
3595.0000 -185.87599 -177.72806 8.14794 2.47409 -177.24956 753.04262
3600.0000 -183.73840 -176.61284 7.12556 2.48576 -177.04212 754.65058
3605.0000 -184.27086 -176.37534 7.89552 2.52451 -176.35294 758.77747
3610.0000 -183.88797 -176.55840 7.32957 2.48453 -177.06391 746.27251
3615.0000 -183.65231 -175.66727 7.98504 2.53652 -176.13932 789.76559
3620.0000 -182.48393 -174.63777 7.84616 2.59204 -175.15187 820.48354
3625.0000 -184.01143 -175.50893 8.50250 2.61393 -174.76268 845.05316
3630.0000 -182.84428 -174.91435 7.92993 2.53484 -176.16926 814.67745
3635.0000 -183.94214 -174.67889 9.26325 2.61467 -174.74957 844.51999
3640.0000 -181.51131 -174.59800 6.91331 2.61778 -174.69426 840.82270
3645.0000 -183.51367 -176.28836 7.22531 2.53054 -176.24563 761.77417
3650.0000 -184.76912 -178.09397 6.67515 2.49904 -176.80587 749.51408
3655.0000 -185.04074 -177.69784 7.34290 2.46759 -177.36516 734.92610
3660.0000 -184.01159 -175.92606 8.08553 2.50790 -176.64841 781.01174
3665.0000 -183.85506 -176.88591 6.96915 2.53748 -176.12230 765.08395
3670.0000 -184.27349 -175.41481 8.85867 2.56858 -175.56920 813.21951
3675.0000 -183.37027 -174.59228 8.77799 2.63261 -174.43047 861.57673
3680.0000 -183.74422 -175.88426 7.85995 2.59095 -175.17130 821.23389
3685.0000 -185.13853 -177.13300 8.00553 2.51982 -176.43641 769.77752
3690.0000 -183.64732 -174.96776 8.67956 2.57246 -175.50012 808.70612
3695.0000 -184.27453 -176.23700 8.03753 2.60174 -174.97942 816.82422
3700.0000 -183.73792 -174.76063 8.97729 2.58847 -175.21543 814.60760
3705.0000 -183.21382 -174.62556 8.58826 2.60080 -174.99607 816.45621
3710.0000 -182.55670 -174.59469 7.96201 2.59566 -175.08755 823.02612
3715.0000 -184.26556 -176.29525 7.97031 2.63770 -174.33984 845.65647
3720.0000 -182.78438 -172.64161 10.14277 2.63595 -174.37102 863.64676
3725.0000 -182.05644 -173.74629 8.31015 2.67970 -173.59303 899.94470
3730.0000 -182.30434 -174.65175 7.65260 2.64967 -174.12697 845.44977
3735.0000 -183.00344 -175.56243 7.44101 2.56077 -175.70810 787.72390
3740.0000 -184.70399 -175.64676 9.05723 2.55166 -175.87002 811.59764
3745.0000 -184.17276 -176.02390 8.14885 2.51688 -176.48859 796.27632
3750.0000 -185.23571 -177.98303 7.25268 2.46012 -177.49805 755.16205
FREEZING PROCESS: loop number 16 T-loop= 777.00000000000000
main_MD> interactions number 16 at Temperature= 777.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -5.65236 -3.14548 2.75235
force_rgl> df(natom) -1.38896 0.15186 -2.91240
3755.0000 -184.50438 -176.31208 8.19230 2.49148 -176.94040 773.64700
3760.0000 -184.75994 -177.55521 7.20473 2.54085 -176.06235 821.35100
3765.0000 -185.39804 -178.48479 6.91324 2.46426 -177.42438 733.98037
3770.0000 -184.26600 -177.80792 6.45808 2.38425 -178.84739 697.31085
3775.0000 -183.25828 -175.80025 7.45803 2.54316 -176.02120 788.73088
3780.0000 -183.06310 -175.04580 8.01729 2.53346 -176.19377 786.10227
3785.0000 -182.19634 -175.47568 6.72066 2.63134 -174.45297 823.45607
3790.0000 -183.45201 -176.48796 6.96405 2.48219 -177.10551 744.25585
3795.0000 -184.33209 -177.23073 7.10136 2.47360 -177.25832 747.25498
3800.0000 -184.44544 -176.07521 8.37024 2.50273 -176.74024 770.57327
3805.0000 -184.84815 -176.90238 7.94577 2.50379 -176.72146 757.57485
3810.0000 -185.33718 -177.62635 7.71083 2.43821 -177.88766 729.75155
3815.0000 -183.82053 -175.82124 7.99929 2.50123 -176.76697 769.83335
3820.0000 -183.50367 -175.19469 8.30899 2.58455 -175.28512 834.28027
3825.0000 -185.45887 -176.69655 8.76232 2.54303 -176.02362 800.83427
3830.0000 -182.47426 -175.27490 7.19936 2.58338 -175.30596 813.69472
3835.0000 -183.91114 -175.58784 8.32330 2.56441 -175.64340 773.82836
3840.0000 -184.66765 -175.83818 8.82947 2.55148 -175.87329 784.30303
3845.0000 -181.60129 -173.79010 7.81120 2.61642 -174.71835 841.79603
3850.0000 -183.43007 -176.64898 6.78109 2.57359 -175.48010 794.33090
3855.0000 -182.67566 -175.78079 6.89488 2.53354 -176.19238 793.58151
3860.0000 -184.67502 -175.58297 9.09205 2.57129 -175.52104 824.10554
3865.0000 -183.80375 -174.92506 8.87868 2.59083 -175.17347 829.27233
3870.0000 -184.29331 -175.57536 8.71795 2.59428 -175.11203 842.92980
3875.0000 -182.82738 -176.29442 6.53296 2.54257 -176.03173 779.04115
3880.0000 -183.23663 -175.93587 7.30076 2.56734 -175.59129 806.81118
3885.0000 -185.56991 -177.47221 8.09771 2.53360 -176.19124 788.07470
3890.0000 -185.90833 -179.18113 6.72721 2.43027 -178.02893 704.27145
3895.0000 -184.60034 -178.11790 6.48244 2.39927 -178.58027 712.77885
3900.0000 -185.23825 -178.04127 7.19698 2.44168 -177.82594 738.96172
3905.0000 -183.59392 -176.41062 7.18329 2.48891 -176.98609 746.07343
3910.0000 -183.10679 -176.12488 6.98191 2.55554 -175.80104 797.60130
3915.0000 -182.55174 -174.46581 8.08593 2.57870 -175.38914 797.78716
3920.0000 -184.83858 -177.79442 7.04416 2.53342 -176.19449 794.56552
3925.0000 -185.21207 -178.47669 6.73537 2.45645 -177.56326 742.03840
3930.0000 -184.97612 -177.71020 7.26593 2.39411 -178.67199 717.15641
3935.0000 -184.33177 -175.99380 8.33796 2.46943 -177.33247 765.98273
3940.0000 -183.64349 -175.29695 8.34654 2.57368 -175.47851 819.15202
3945.0000 -182.84865 -175.12830 7.72035 2.56453 -175.64121 808.38790
3950.0000 -183.51636 -176.26121 7.25515 2.54003 -176.07694 772.84315
3955.0000 -184.15922 -175.72417 8.43505 2.55609 -175.79128 789.18387
3960.0000 -185.23374 -177.30158 7.93216 2.54158 -176.04930 811.72787
3965.0000 -184.44828 -177.25698 7.19130 2.49287 -176.91558 760.12482
3970.0000 -183.82788 -177.00779 6.82010 2.47710 -177.19611 730.42317
3975.0000 -182.76782 -175.35287 7.41495 2.50420 -176.71419 731.27212
3980.0000 -183.31411 -175.32187 7.99224 2.57103 -175.52567 817.64627
3985.0000 -183.17644 -175.32004 7.85640 2.62156 -174.62704 835.45795
3990.0000 -182.72848 -175.48146 7.24702 2.63428 -174.40081 866.43024
3995.0000 -184.27784 -176.89544 7.38240 2.53585 -176.15127 806.80956
4000.0000 -184.46289 -177.11232 7.35057 2.45191 -177.64400 710.14002
FREEZING PROCESS: loop number 17 T-loop= 752.00000000000000
main_MD> interactions number 17 at Temperature= 752.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.28740 -1.60989 0.22071
force_rgl> df(natom) 1.74987 3.59682 -0.04057
4005.0000 -186.14182 -178.71630 7.42552 2.41172 -178.35892 701.53448
4010.0000 -183.88065 -175.60608 8.27456 2.49596 -176.86077 760.76986
4015.0000 -180.85811 -174.21174 6.64637 2.57913 -175.38160 791.34132
4020.0000 -184.90662 -177.13364 7.77298 2.56103 -175.70350 773.77634
4025.0000 -184.62799 -177.37875 7.24923 2.47370 -177.25662 734.26272
4030.0000 -184.60195 -178.27583 6.32613 2.40662 -178.44962 675.54066
4035.0000 -183.76240 -177.03017 6.73223 2.42681 -178.09042 709.98867
4040.0000 -182.85474 -175.37937 7.47537 2.53154 -176.22788 763.97277
4045.0000 -183.89471 -176.50296 7.39175 2.56367 -175.65648 811.74173
4050.0000 -184.10266 -176.90939 7.19328 2.51745 -176.47843 767.06443
4055.0000 -183.01298 -175.09106 7.92192 2.58717 -175.23857 824.12158
4060.0000 -184.05931 -177.29924 6.76006 2.53169 -176.22518 786.89653
4065.0000 -186.10381 -179.36739 6.73642 2.43942 -177.86624 727.29193
4070.0000 -185.47695 -178.17421 7.30275 2.39576 -178.64262 687.04339
4075.0000 -184.28377 -176.78686 7.49691 2.46191 -177.46633 755.89302
4080.0000 -182.71569 -175.13063 7.58506 2.53488 -176.16844 741.87375
4085.0000 -183.70442 -177.34392 6.36051 2.53822 -176.10915 767.87983
4090.0000 -185.79755 -178.95484 6.84271 2.37492 -179.01334 664.27924
4095.0000 -184.86741 -176.79368 8.07373 2.46075 -177.48694 757.01371
4100.0000 -185.17328 -178.28356 6.88971 2.47933 -177.15641 741.59369
4105.0000 -185.15265 -177.51682 7.63582 2.42985 -178.03637 702.47787
4110.0000 -183.81163 -176.93598 6.87564 2.51573 -176.50910 746.46520
4115.0000 -184.50372 -176.08399 8.41973 2.52686 -176.31118 764.31842
4120.0000 -184.50626 -178.12060 6.38567 2.48208 -177.10748 751.80674
4125.0000 -184.34826 -178.21313 6.13513 2.43009 -178.03207 704.06959
4130.0000 -184.86468 -177.81471 7.04998 2.44263 -177.80915 727.06917
4135.0000 -184.64495 -178.22352 6.42143 2.43509 -177.94330 712.15413
4140.0000 -184.32639 -175.69280 8.63359 2.51934 -176.44496 795.60753
4145.0000 -184.88557 -178.13693 6.74863 2.48381 -177.07671 745.23414
4150.0000 -185.76906 -178.12227 7.64679 2.44051 -177.84691 737.66362
4155.0000 -184.66117 -177.21176 7.44941 2.42956 -178.04158 727.51255
4160.0000 -185.60055 -178.62369 6.97686 2.41013 -178.38709 692.77627
4165.0000 -183.89296 -176.89606 6.99690 2.48225 -177.10453 765.42008
4170.0000 -185.07311 -177.60307 7.47004 2.47129 -177.29938 735.53323
4175.0000 -183.63608 -177.56330 6.07278 2.48450 -177.06444 739.39969
4180.0000 -185.56092 -178.22488 7.33604 2.44821 -177.70983 715.62819
4185.0000 -183.62194 -177.10307 6.51887 2.44078 -177.84212 718.06634
4190.0000 -184.73879 -177.56600 7.17279 2.48461 -177.06245 760.15643
4195.0000 -184.51266 -177.06580 7.44686 2.48347 -177.08288 751.67688
4200.0000 -185.00973 -177.91572 7.09401 2.48083 -177.12972 756.48383
4205.0000 -184.15357 -176.70488 7.44869 2.46984 -177.32516 747.45985
4210.0000 -183.50343 -177.11039 6.39304 2.49407 -176.89436 732.64431
4215.0000 -183.48648 -175.46786 8.01863 2.50241 -176.74596 747.05227
4220.0000 -184.98937 -175.56607 9.42330 2.55092 -175.88333 803.81349
4225.0000 -184.54385 -177.50301 7.04084 2.49298 -176.91361 790.54935
4230.0000 -183.58686 -176.30422 7.28264 2.53433 -176.17823 791.03972
4235.0000 -184.85011 -177.27176 7.57835 2.49379 -176.89921 780.34734
4240.0000 -184.06113 -177.52917 6.53196 2.45349 -177.61604 717.61165
4245.0000 -184.95810 -177.77383 7.18426 2.42513 -178.12028 714.53723
4250.0000 -185.55272 -177.35836 8.19436 2.44966 -177.68413 732.09432
FREEZING PROCESS: loop number 18 T-loop= 727.00000000000000
main_MD> interactions number 18 at Temperature= 727.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -3.73079 3.12060 6.60312
force_rgl> df(natom) -0.67880 4.11769 0.69140
4255.0000 -184.59063 -176.56495 8.02568 2.51949 -176.44224 789.29438
4260.0000 -183.22759 -176.69533 6.53226 2.52215 -176.39488 754.15010
4265.0000 -184.68383 -177.93176 6.75207 2.49137 -176.94225 753.13104
4270.0000 -185.22813 -177.24965 7.97848 2.46717 -177.37263 746.40480
4275.0000 -185.54767 -178.78994 6.75773 2.45837 -177.52924 751.43286
4280.0000 -184.50017 -178.40744 6.09273 2.38361 -178.85882 699.78830
4285.0000 -183.93701 -176.75481 7.18220 2.44379 -177.78858 728.34322
4290.0000 -184.54405 -178.27746 6.26659 2.48446 -177.06515 756.00687
4295.0000 -186.82795 -180.07771 6.75023 2.39024 -178.74092 710.55550
4300.0000 -186.72991 -181.14666 5.58325 2.25668 -181.11620 589.80841
4305.0000 -185.20703 -178.29748 6.90955 2.34676 -179.51414 666.40992
4310.0000 -185.42073 -178.90407 6.51666 2.40127 -178.54474 689.25780
4315.0000 -185.78230 -176.97733 8.80498 2.43970 -177.86120 737.14769
4320.0000 -183.67277 -177.06101 6.61176 2.49651 -176.85096 754.48989
4325.0000 -185.38802 -178.11799 7.27003 2.45756 -177.54368 699.38446
4330.0000 -184.99539 -178.58856 6.40683 2.44438 -177.77793 731.49719
4335.0000 -184.09179 -177.91774 6.17405 2.43879 -177.87737 710.51659
4340.0000 -186.16113 -178.72898 7.43215 2.40766 -178.43107 693.07265
4345.0000 -185.74649 -178.57444 7.17205 2.40913 -178.40497 715.21511
4350.0000 -186.91464 -180.01168 6.90296 2.40375 -178.50065 711.12739
4355.0000 -185.18694 -178.56114 6.62580 2.36965 -179.10708 694.29046
4360.0000 -186.10241 -179.09147 7.01094 2.41829 -178.24194 717.79714
4365.0000 -185.67316 -179.60935 6.06381 2.37938 -178.93404 687.15010
4370.0000 -185.86666 -179.30102 6.56564 2.31973 -179.99491 641.09689
4375.0000 -184.06079 -176.57200 7.48879 2.44547 -177.75858 701.64142
4380.0000 -184.72261 -177.70132 7.02129 2.45968 -177.50594 735.56166
4385.0000 -185.35828 -179.41129 5.94699 2.39566 -178.64449 675.78068
4390.0000 -184.80985 -178.71684 6.09302 2.36082 -179.26415 664.34704
4395.0000 -185.23092 -178.69813 6.53278 2.44055 -177.84609 704.78726
4400.0000 -186.61062 -178.97009 7.64053 2.37903 -178.94018 685.37895
4405.0000 -185.02643 -177.15401 7.87242 2.44757 -177.72132 737.08556
4410.0000 -184.27941 -177.68292 6.59648 2.47572 -177.22073 779.77706
4415.0000 -186.48823 -178.94604 7.54219 2.39784 -178.60569 703.22379
4420.0000 -184.90066 -177.76778 7.13288 2.43788 -177.89363 713.75596
4425.0000 -185.85998 -178.58821 7.27177 2.36917 -179.11557 677.74532
4430.0000 -183.78403 -176.91883 6.86520 2.45465 -177.59540 740.60556
4435.0000 -184.34533 -176.56138 7.78395 2.48119 -177.12333 739.58193
4440.0000 -185.22389 -177.76606 7.45783 2.44691 -177.73299 749.59070
4445.0000 -184.87009 -177.82493 7.04517 2.45976 -177.50441 740.67208
4450.0000 -184.57803 -177.50469 7.07333 2.46103 -177.48189 724.25782
4455.0000 -183.92028 -176.29975 7.62053 2.48136 -177.12034 736.53123
4460.0000 -183.58553 -176.86285 6.72268 2.50806 -176.64550 759.51305
4465.0000 -184.66428 -176.95442 7.70985 2.46949 -177.33146 722.38688
4470.0000 -184.29139 -176.44096 7.85042 2.48391 -177.07503 765.02415
4475.0000 -184.82426 -176.98769 7.83657 2.50650 -176.67325 764.11392
4480.0000 -183.88696 -177.17748 6.70948 2.46448 -177.42048 745.95885
4485.0000 -186.26495 -178.77768 7.48727 2.42652 -178.09559 727.21118
4490.0000 -185.80841 -179.15392 6.65449 2.39913 -178.58282 713.71306
4495.0000 -185.59466 -179.22827 6.36639 2.36495 -179.19070 687.92046
4500.0000 -185.47140 -179.44995 6.02145 2.34957 -179.46410 656.51262
FREEZING PROCESS: loop number 19 T-loop= 702.00000000000000
main_MD> interactions number 19 at Temperature= 702.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.10952 -4.36927 -2.09039
force_rgl> df(natom) 1.61332 3.45073 -0.61741
4505.0000 -184.85543 -178.40772 6.44771 2.41182 -178.35698 716.61632
4510.0000 -186.55481 -179.08118 7.47363 2.37557 -179.00173 665.32731
4515.0000 -185.61774 -178.95869 6.65905 2.38751 -178.78937 684.50649
4520.0000 -186.78270 -181.03506 5.74763 2.37546 -179.00375 682.21212
4525.0000 -186.55223 -180.32529 6.22694 2.28828 -180.55423 612.74312
4530.0000 -185.95150 -178.30772 7.64378 2.35909 -179.29479 701.60808
4535.0000 -184.20941 -177.19358 7.01583 2.43602 -177.92677 738.25487
4540.0000 -186.40614 -178.74412 7.66202 2.43196 -177.99890 718.89420
4545.0000 -186.25428 -179.23830 7.01597 2.37629 -178.98901 683.57239
4550.0000 -186.96036 -180.28778 6.67258 2.33050 -179.80322 662.60002
4555.0000 -186.22014 -180.21694 6.00320 2.28763 -180.56567 647.30518
4560.0000 -185.90528 -178.36749 7.53779 2.34657 -179.51752 690.75891
4565.0000 -186.39928 -179.85726 6.54202 2.36824 -179.13204 676.96567
4570.0000 -185.26287 -179.37047 5.89239 2.35132 -179.43312 673.87989
4575.0000 -186.15266 -178.84900 7.30366 2.39172 -178.71449 717.25709
4580.0000 -184.72910 -177.92510 6.80400 2.40662 -178.44961 716.49491
4585.0000 -185.29852 -178.17696 7.12156 2.46428 -177.42413 750.16763
4590.0000 -185.59182 -178.48783 7.10399 2.40093 -178.55079 698.18158
4595.0000 -184.15481 -178.04765 6.10716 2.41354 -178.32650 701.07145
4600.0000 -184.22378 -177.24572 6.97807 2.43479 -177.94853 701.08123
4605.0000 -185.32015 -177.61526 7.70489 2.47224 -177.28253 754.61982
4610.0000 -185.56449 -179.37876 6.18573 2.39631 -178.63289 721.61793
4615.0000 -185.90110 -178.05883 7.84226 2.37527 -179.00708 692.20780
4620.0000 -186.43315 -180.04185 6.39130 2.35375 -179.38983 666.73471
4625.0000 -186.12327 -179.68771 6.43556 2.33669 -179.69330 657.98296
4630.0000 -186.20980 -179.14652 7.06328 2.33699 -179.68784 674.60144
4635.0000 -186.22781 -180.41319 5.81462 2.31347 -180.10618 639.40886
4640.0000 -185.82282 -180.11553 5.70729 2.28792 -180.56050 610.60021
4645.0000 -185.45820 -179.96875 5.48945 2.32261 -179.94359 632.06981
4650.0000 -185.01609 -179.44748 5.56861 2.40431 -178.49069 685.71516
4655.0000 -185.97080 -179.74161 6.22919 2.37062 -179.08974 658.88173
4660.0000 -186.16964 -180.44068 5.72895 2.29816 -180.37844 625.10351
4665.0000 -185.89612 -179.04102 6.85510 2.30519 -180.25335 651.93289
4670.0000 -186.79544 -179.58705 7.20839 2.37305 -179.04666 701.01225
4675.0000 -186.36614 -179.78757 6.57857 2.33526 -179.71862 677.09943
4680.0000 -186.45213 -179.85541 6.59672 2.35382 -179.38861 688.56869
4685.0000 -186.13717 -178.56010 7.57707 2.34819 -179.48862 692.33397
4690.0000 -185.42253 -177.84675 7.57578 2.41542 -178.29297 707.85548
4695.0000 -184.10766 -177.41584 6.69182 2.46627 -177.38871 732.63374
4700.0000 -185.03910 -178.39506 6.64404 2.42756 -178.07721 693.73239
4705.0000 -183.35938 -176.67357 6.68582 2.43514 -177.94240 719.88937
4710.0000 -185.76835 -179.69893 6.06942 2.40264 -178.52029 693.82153
4715.0000 -184.99855 -177.50403 7.49452 2.38917 -178.75996 657.35277
4720.0000 -185.34165 -177.63998 7.70167 2.45562 -177.57807 749.02109
4725.0000 -185.17742 -178.46228 6.71514 2.39055 -178.73541 697.86895
4730.0000 -186.03204 -179.16403 6.86801 2.38864 -178.76924 697.54605
4735.0000 -186.23638 -179.93694 6.29944 2.37760 -178.96574 687.91560
4740.0000 -186.29623 -180.43743 5.85880 2.30187 -180.31249 634.56174
4745.0000 -185.34720 -179.36132 5.98589 2.32429 -179.91376 658.22934
4750.0000 -185.90033 -178.81522 7.08511 2.39623 -178.63433 719.27796
FREEZING PROCESS: loop number 20 T-loop= 677.00000000000000
main_MD> interactions number 20 at Temperature= 677.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -4.17670 -0.27538 1.91063
force_rgl> df(natom) 3.88488 -3.58579 -0.65897
4755.0000 -184.37457 -178.50734 5.86724 2.41629 -178.27757 689.83999
4760.0000 -186.38133 -179.53901 6.84232 2.38716 -178.79555 695.24440
4765.0000 -186.80265 -180.81221 5.99044 2.32750 -179.85658 646.33743
4770.0000 -187.22571 -181.24881 5.97690 2.31624 -180.05697 632.67677
4775.0000 -187.82680 -180.53029 7.29652 2.26973 -180.88402 637.01484
4780.0000 -185.20891 -178.64568 6.56324 2.34411 -179.56129 712.08444
4785.0000 -185.30394 -177.94211 7.36184 2.39135 -178.72120 735.88655
4790.0000 -185.00607 -178.78281 6.22326 2.41825 -178.24271 711.09626
4795.0000 -185.65871 -179.50577 6.15294 2.39091 -178.72890 703.16499
4800.0000 -185.75984 -179.18901 6.57082 2.35573 -179.35468 659.70126
4805.0000 -186.92446 -180.27757 6.64690 2.30107 -180.32669 629.55371
4810.0000 -187.02669 -180.43410 6.59259 2.26792 -180.91628 621.68729
4815.0000 -186.73534 -180.27078 6.46456 2.30411 -180.27259 646.60696
4820.0000 -186.09981 -180.63191 5.46790 2.32269 -179.94216 636.81815
4825.0000 -187.48345 -180.66609 6.81736 2.30937 -180.17910 644.46366
4830.0000 -185.50898 -179.66542 5.84356 2.30491 -180.25841 652.14863
4835.0000 -186.75078 -179.36331 7.38747 2.32493 -179.90242 657.96806
4840.0000 -186.89810 -179.45371 7.44439 2.35840 -179.30703 677.02409
4845.0000 -184.63307 -177.69818 6.93488 2.37974 -178.92768 680.35587
4850.0000 -186.16489 -178.89364 7.27125 2.41630 -178.27746 678.01549
4855.0000 -185.06531 -178.95931 6.10600 2.37824 -178.95423 666.07470
4860.0000 -185.80913 -176.82125 8.98788 2.43127 -178.01119 711.85473
4865.0000 -184.07047 -176.27881 7.79167 2.49066 -176.95500 743.89631
4870.0000 -184.60756 -178.43451 6.17305 2.42597 -178.10545 699.08281
4875.0000 -185.67978 -179.59895 6.08083 2.37418 -179.02647 680.79838
4880.0000 -185.75360 -179.55997 6.19363 2.35402 -179.38506 683.79365
4885.0000 -186.68796 -179.99493 6.69303 2.33050 -179.80324 677.77488
4890.0000 -186.10620 -179.87371 6.23249 2.29969 -180.35122 623.11642
4895.0000 -185.19600 -178.52130 6.67470 2.32563 -179.88988 636.76540
4900.0000 -186.66830 -180.51578 6.15252 2.37547 -179.00351 699.34962
4905.0000 -184.24430 -176.98098 7.26332 2.36948 -179.11007 676.36751
4910.0000 -185.45681 -178.42339 7.03342 2.44398 -177.78505 704.30765
4915.0000 -186.09641 -177.62262 8.47379 2.43928 -177.86876 714.39479
4920.0000 -187.56803 -181.86488 5.70315 2.32792 -179.84915 669.22879
4925.0000 -187.81207 -180.12613 7.68594 2.26263 -181.01027 629.97673
4930.0000 -186.83035 -180.22869 6.60167 2.27529 -180.78515 636.95824
4935.0000 -185.20329 -178.64791 6.55537 2.32540 -179.89408 652.29724
4940.0000 -185.29205 -177.92457 7.36748 2.40685 -178.44542 706.38308
4945.0000 -185.61108 -179.19889 6.41219 2.41361 -178.32524 696.45484
4950.0000 -185.23188 -179.28792 5.94396 2.36369 -179.21299 667.80686
4955.0000 -185.12012 -178.42330 6.69682 2.40387 -178.49841 705.14990
4960.0000 -187.23056 -179.56358 7.66699 2.40629 -178.45538 685.43935
4965.0000 -186.47955 -179.51551 6.96404 2.31105 -180.14924 658.92220
4970.0000 -185.41803 -178.91842 6.49961 2.33952 -179.64291 673.34666
4975.0000 -185.80833 -179.87701 5.93131 2.35798 -179.31457 671.11004
4980.0000 -185.96594 -179.66538 6.30056 2.31439 -180.08985 650.90793
4985.0000 -185.95844 -179.84940 6.10905 2.35635 -179.34356 683.54183
4990.0000 -186.94601 -180.26989 6.67611 2.31830 -180.02019 638.23548
4995.0000 -185.26499 -179.04476 6.22023 2.35502 -179.36717 662.52347
5000.0000 -187.03132 -179.47119 7.56013 2.34713 -179.50757 681.40514
FREEZING PROCESS: loop number 21 T-loop= 652.00000000000000
main_MD> interactions number 21 at Temperature= 652.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.11198 2.39719 -0.68292
force_rgl> df(natom) 3.08030 2.24824 -2.09279
5005.0000 -186.07266 -179.53725 6.53541 2.33451 -179.73195 661.11641
5010.0000 -186.34443 -180.00780 6.33662 2.32198 -179.95485 652.98638
5015.0000 -185.95006 -180.06863 5.88144 2.33125 -179.79004 645.90365
5020.0000 -185.96967 -179.93094 6.03873 2.31085 -180.15276 613.94199
5025.0000 -184.98696 -177.92876 7.05820 2.38520 -178.83044 671.59001
5030.0000 -185.18432 -177.89286 7.29146 2.42274 -178.16280 722.07352
5035.0000 -185.92983 -178.50091 7.42892 2.40531 -178.47277 717.32557
5040.0000 -187.25597 -180.76988 6.48608 2.34845 -179.48410 664.64121
5045.0000 -188.01458 -181.99263 6.02195 2.22334 -181.70908 583.22938
5050.0000 -187.17985 -181.52001 5.65984 2.20263 -182.07746 581.20908
5055.0000 -187.46572 -181.71913 5.74659 2.25365 -181.17009 609.75803
5060.0000 -185.85900 -180.48254 5.37645 2.27292 -180.82724 613.50899
5065.0000 -186.03864 -179.40491 6.63372 2.30203 -180.30959 634.35516
5070.0000 -186.12724 -180.16856 5.95869 2.30944 -180.17779 636.02924
5075.0000 -184.26417 -178.10962 6.15455 2.38957 -178.75271 688.26227
5080.0000 -186.54286 -180.29434 6.24852 2.34457 -179.55314 665.10289
5085.0000 -185.23772 -178.69265 6.54507 2.34099 -179.61680 665.39067
5090.0000 -185.29629 -179.53157 5.76472 2.37054 -179.09123 667.29876
5095.0000 -185.34160 -179.12479 6.21681 2.35232 -179.41529 654.98492
5100.0000 -184.39713 -178.17408 6.22305 2.41740 -178.25781 739.21480
5105.0000 -185.33097 -179.05509 6.27589 2.41444 -178.31043 698.85698
5110.0000 -186.12059 -179.41045 6.71014 2.39389 -178.67588 691.08848
5115.0000 -187.03638 -180.29629 6.74009 2.30928 -180.18077 622.75190
5120.0000 -184.67905 -178.81714 5.86191 2.35643 -179.34222 664.73353
5125.0000 -185.32302 -178.29774 7.02528 2.42555 -178.11288 717.82490
5130.0000 -185.98320 -179.31675 6.66645 2.36275 -179.22981 655.92671
5135.0000 -185.35856 -179.23539 6.12317 2.35798 -179.31457 663.59138
5140.0000 -185.97661 -180.29772 5.67889 2.37262 -179.05418 683.98878
5145.0000 -186.41442 -179.86333 6.55109 2.30706 -180.22020 647.27148
5150.0000 -185.91861 -179.38195 6.53666 2.32200 -179.95440 651.68910
5155.0000 -187.76400 -181.10822 6.65578 2.27184 -180.84657 613.54386
5160.0000 -185.53616 -179.82008 5.71608 2.29400 -180.45239 639.88224
5165.0000 -185.34949 -180.10960 5.23988 2.33192 -179.77800 642.48205
5170.0000 -185.79057 -178.88832 6.90225 2.37058 -179.09052 669.45536
5175.0000 -184.87702 -178.31324 6.56379 2.45690 -177.55543 757.01093
5180.0000 -184.44603 -177.78848 6.65754 2.43606 -177.92603 720.32875
5185.0000 -185.20722 -178.63341 6.57381 2.43073 -178.02083 698.59673
5190.0000 -184.83370 -178.60509 6.22862 2.36508 -179.18829 667.59996
5195.0000 -185.85918 -178.86613 6.99306 2.40181 -178.53503 699.18301
5200.0000 -185.64353 -179.08084 6.56269 2.36878 -179.12250 682.27510
5205.0000 -185.85774 -179.61102 6.24671 2.35859 -179.30378 680.08259
5210.0000 -186.74448 -180.11875 6.62573 2.32467 -179.90699 662.35108
5215.0000 -185.88615 -179.90113 5.98501 2.31639 -180.05416 643.72378
5220.0000 -186.41862 -179.49610 6.92251 2.34159 -179.60599 669.84465
5225.0000 -185.33909 -179.04115 6.29793 2.34279 -179.58472 661.15681
5230.0000 -186.79576 -181.09879 5.69697 2.32265 -179.94287 638.32831
5235.0000 -186.43617 -179.91271 6.52346 2.26155 -181.02955 618.20257
5240.0000 -185.79182 -180.11931 5.67252 2.32063 -179.97889 659.88365
5245.0000 -186.64376 -180.28821 6.35555 2.32235 -179.94831 656.38904
5250.0000 -185.29973 -179.64786 5.65188 2.34982 -179.45970 667.25377
FREEZING PROCESS: loop number 22 T-loop= 627.00000000000000
main_MD> interactions number 22 at Temperature= 627.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.22684 0.24858 -0.66078
force_rgl> df(natom) 2.96983 1.14836 -2.13882
5255.0000 -186.98504 -181.00807 5.97697 2.27960 -180.70854 611.93914
5260.0000 -187.23607 -181.94875 5.28732 2.27245 -180.83572 608.09979
5265.0000 -187.36537 -181.70159 5.66378 2.20479 -182.03893 566.50601
5270.0000 -188.19694 -182.81860 5.37834 2.18696 -182.35605 570.95979
5275.0000 -187.77448 -181.83678 5.93770 2.17992 -182.48129 558.34026
5280.0000 -187.43848 -181.24322 6.19526 2.20917 -181.96106 594.91299
5285.0000 -187.51494 -181.64723 5.86771 2.25193 -181.20070 621.95535
5290.0000 -186.41060 -180.73124 5.67936 2.25942 -181.06745 611.51012
5295.0000 -186.77112 -180.23733 6.53379 2.27701 -180.75460 619.46021
5300.0000 -186.57541 -180.21166 6.36375 2.32166 -179.96056 659.33208
5305.0000 -186.95313 -180.96044 5.99270 2.29072 -180.51075 607.42798
5310.0000 -187.88007 -180.26037 7.61969 2.29267 -180.47600 643.66950
5315.0000 -188.12137 -181.76694 6.35443 2.25527 -181.14114 627.81457
5320.0000 -186.93981 -180.87698 6.06282 2.27839 -180.73003 646.19799
5325.0000 -186.93705 -181.24935 5.68770 2.25836 -181.08633 630.70072
5330.0000 -187.12040 -180.74699 6.37342 2.25590 -181.13001 617.18114
5335.0000 -185.10484 -178.79481 6.31003 2.34063 -179.62310 669.02799
5340.0000 -187.38538 -181.26136 6.12402 2.35608 -179.34829 693.92477
5345.0000 -187.91265 -182.58006 5.33259 2.20698 -182.00011 610.32494
5350.0000 -187.35790 -182.24236 5.11554 2.18826 -182.33298 577.56548
5355.0000 -187.50337 -181.47570 6.02766 2.20712 -181.99754 592.51648
5360.0000 -187.96776 -181.83493 6.13283 2.22460 -181.68671 606.96199
5365.0000 -187.50086 -181.47094 6.02992 2.21013 -181.94406 568.35260
5370.0000 -185.25269 -179.38438 5.86831 2.30737 -180.21459 658.00115
5375.0000 -186.40298 -180.56863 5.83435 2.32407 -179.91773 654.14397
5380.0000 -186.49231 -180.47999 6.01231 2.31392 -180.09824 656.22905
5385.0000 -185.36202 -179.29552 6.06650 2.35533 -179.36166 664.39830
5390.0000 -185.78176 -179.39225 6.38951 2.35776 -179.31856 664.53038
5395.0000 -186.50226 -180.25129 6.25096 2.36921 -179.11495 656.86652
5400.0000 -187.10371 -180.77161 6.33210 2.30537 -180.25019 647.00941
5405.0000 -187.29355 -181.23569 6.05786 2.28909 -180.53978 648.86822
5410.0000 -187.73026 -180.92431 6.80595 2.28841 -180.55178 638.99818
5415.0000 -187.35173 -181.95175 5.39998 2.23969 -181.41825 587.71352
5420.0000 -187.76453 -180.98991 6.77463 2.24973 -181.23966 620.24298
5425.0000 -185.98521 -180.45463 5.53057 2.29608 -180.41546 638.33285
5430.0000 -186.27762 -180.41844 5.85918 2.35358 -179.39277 661.59569
5435.0000 -186.22993 -180.80842 5.42151 2.31358 -180.10425 632.94628
5440.0000 -187.82426 -182.25258 5.57168 2.21210 -181.90893 587.42325
5445.0000 -187.05746 -181.71892 5.33854 2.19537 -182.20650 569.52449
5450.0000 -187.52181 -181.63870 5.88311 2.20910 -181.96240 567.66088
5455.0000 -186.07200 -179.88089 6.19111 2.32162 -179.96126 656.21165
5460.0000 -187.62804 -180.42742 7.20062 2.32924 -179.82572 646.70491
5465.0000 -186.83664 -180.08329 6.75335 2.31341 -180.10722 648.68548
5470.0000 -186.15774 -180.72489 5.43285 2.27980 -180.70493 622.39739
5475.0000 -185.77448 -179.82736 5.94712 2.32217 -179.95139 637.98925
5480.0000 -187.06842 -181.42777 5.64065 2.31025 -180.16336 638.19702
5485.0000 -187.51058 -181.97485 5.53573 2.20804 -181.98127 575.54627
5490.0000 -186.61021 -180.83824 5.77197 2.23034 -181.58457 587.15068
5495.0000 -185.80429 -180.52401 5.28029 2.27566 -180.77861 624.00776
5500.0000 -186.22967 -181.23939 4.99028 2.27756 -180.74480 619.04526
FREEZING PROCESS: loop number 23 T-loop= 602.00000000000000
main_MD> interactions number 23 at Temperature= 602.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 3.71895 -0.22294 -0.72391
force_rgl> df(natom) -2.77317 1.23371 -2.84029
5505.0000 -187.08252 -181.18982 5.89269 2.24557 -181.31376 611.04933
5510.0000 -186.09196 -180.23299 5.85897 2.28001 -180.70125 603.24121
5515.0000 -186.06759 -180.81137 5.25623 2.26684 -180.93555 590.87358
5520.0000 -187.45536 -180.43882 7.01654 2.28264 -180.65455 631.29700
5525.0000 -187.19359 -180.90464 6.28895 2.26251 -181.01239 650.29174
5530.0000 -186.94083 -181.50935 5.43148 2.22695 -181.64496 608.19382
5535.0000 -186.98784 -180.44176 6.54608 2.25130 -181.21183 634.34005
5540.0000 -187.30464 -181.60492 5.69972 2.23778 -181.45219 609.27560
5545.0000 -187.61898 -182.46858 5.15040 2.20804 -181.98114 556.08087
5550.0000 -188.46355 -183.19962 5.26393 2.14719 -183.06339 532.31563
5555.0000 -188.22852 -182.94726 5.28125 2.17523 -182.56473 566.38369
5560.0000 -186.91398 -181.50754 5.40644 2.21760 -181.81125 587.43784
5565.0000 -187.51999 -181.93442 5.58556 2.22812 -181.62403 589.21240
5570.0000 -187.73306 -181.90332 5.82975 2.22654 -181.65211 610.79617
5575.0000 -186.89711 -181.29822 5.59888 2.18177 -182.44834 560.20382
5580.0000 -187.32096 -181.46470 5.85626 2.24082 -181.39829 577.58591
5585.0000 -187.32016 -182.26022 5.05994 2.21131 -181.92302 598.37572
5590.0000 -186.37357 -180.98274 5.39083 2.23696 -181.46682 613.17186
5595.0000 -187.01606 -182.20531 4.81075 2.24008 -181.41142 597.09825
5600.0000 -186.14462 -181.45163 4.69298 2.22628 -181.65681 591.52106
5605.0000 -187.28221 -181.32733 5.95488 2.23462 -181.50852 588.04329
5610.0000 -188.19690 -182.18850 6.00840 2.23003 -181.59006 606.82453
5615.0000 -186.46420 -181.16930 5.29490 2.21503 -181.85693 579.86353
5620.0000 -187.80489 -181.51412 6.29077 2.25033 -181.22906 602.74072
5625.0000 -187.76119 -181.97167 5.78951 2.24578 -181.30991 607.99797
5630.0000 -186.84120 -181.74144 5.09976 2.21868 -181.79188 587.23451
5635.0000 -188.38083 -182.66390 5.71693 2.18336 -182.42005 569.80781
5640.0000 -187.36487 -180.45683 6.90803 2.21790 -181.80585 576.20053
5645.0000 -187.36205 -181.41665 5.94540 2.26089 -181.04135 606.64199
5650.0000 -186.10739 -180.45124 5.65615 2.25289 -181.18348 587.43590
5655.0000 -187.06836 -182.10050 4.96786 2.26330 -180.99845 600.75353
5660.0000 -185.93948 -180.60336 5.33612 2.21549 -181.84878 579.50486
5665.0000 -187.19401 -180.92984 6.26417 2.29753 -180.38968 647.45659
5670.0000 -186.35326 -180.37646 5.97680 2.29215 -180.48536 645.15867
5675.0000 -187.62648 -182.24213 5.38435 2.27801 -180.73686 652.55044
5680.0000 -188.25609 -182.12905 6.12704 2.21245 -181.90279 592.58749
5685.0000 -188.10554 -182.46827 5.63727 2.19995 -182.12514 594.79970
5690.0000 -187.10916 -181.48215 5.62701 2.21806 -181.80294 590.67407
5695.0000 -186.65016 -181.13178 5.51838 2.21924 -181.78205 600.65610
5700.0000 -186.88364 -181.24127 5.64237 2.28042 -180.69399 627.91342
5705.0000 -187.59616 -180.85765 6.73851 2.25558 -181.13565 598.95826
5710.0000 -187.22822 -181.41279 5.81543 2.23681 -181.46949 592.40287
5715.0000 -186.86241 -180.71593 6.14648 2.28007 -180.70010 643.07621
5720.0000 -186.57058 -181.33041 5.24018 2.27073 -180.86621 629.24088
5725.0000 -186.83932 -180.05040 6.78891 2.28601 -180.59458 622.86213
5730.0000 -187.01973 -180.55499 6.46475 2.31492 -180.08032 631.55664
5735.0000 -187.65047 -181.61796 6.03251 2.24565 -181.31238 588.59742
5740.0000 -187.24947 -180.22789 7.02157 2.28649 -180.58599 612.72759
5745.0000 -187.95887 -182.62281 5.33605 2.21618 -181.83642 580.75014
5750.0000 -187.59883 -182.87734 4.72150 2.17051 -182.64865 555.79076
FREEZING PROCESS: loop number 24 T-loop= 577.00000000000000
main_MD> interactions number 24 at Temperature= 577.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.97342 -0.62428 -1.14327
force_rgl> df(natom) -1.31963 -1.68524 -0.37732
5755.0000 -186.28409 -180.78958 5.49450 2.19691 -182.17912 591.60799
5760.0000 -186.44797 -180.15312 6.29485 2.27551 -180.78120 623.69401
5765.0000 -188.00920 -181.36330 6.64590 2.25913 -181.07257 608.13173
5770.0000 -187.82802 -181.40071 6.42731 2.23761 -181.45534 608.87284
5775.0000 -186.67724 -181.20294 5.47430 2.28197 -180.66641 627.34624
5780.0000 -187.02761 -181.49595 5.53166 2.25535 -181.13974 590.03263
5785.0000 -187.80979 -182.49923 5.31056 2.20841 -181.97465 576.76628
5790.0000 -188.20060 -181.00399 7.19660 2.23364 -181.52591 598.74797
5795.0000 -187.72339 -182.20309 5.52031 2.24933 -181.24687 604.54402
5800.0000 -185.99920 -180.58286 5.41634 2.27023 -180.87511 599.57054
5805.0000 -185.82750 -179.86324 5.96426 2.29597 -180.41748 612.70782
5810.0000 -186.68222 -180.90939 5.77283 2.29870 -180.36883 639.29784
5815.0000 -186.60149 -180.47686 6.12462 2.25130 -181.21178 599.22974
5820.0000 -188.27025 -182.34876 5.92149 2.23747 -181.45786 590.21665
5825.0000 -187.53926 -181.88817 5.65109 2.21915 -181.78354 572.82686
5830.0000 -187.05438 -181.64379 5.41059 2.21998 -181.76892 588.43098
5835.0000 -188.64951 -182.88806 5.76145 2.18477 -182.39499 565.18052
5840.0000 -187.93406 -182.61635 5.31771 2.17167 -182.62800 548.65724
5845.0000 -187.48846 -182.34611 5.14236 2.20161 -182.09556 585.57547
5850.0000 -189.26972 -184.45820 4.81152 2.13355 -183.30592 521.52832
5855.0000 -188.98400 -183.83658 5.14742 2.08348 -184.19650 497.90138
5860.0000 -187.27683 -181.81998 5.45685 2.16704 -182.71034 552.94257
5865.0000 -187.36710 -182.18523 5.18187 2.23133 -181.56691 599.94388
5870.0000 -189.16996 -183.18832 5.98164 2.15921 -182.84962 551.74122
5875.0000 -188.97715 -183.03579 5.94136 2.11986 -183.54945 522.07707
5880.0000 -188.82081 -182.85821 5.96260 2.15080 -182.99914 560.12499
5885.0000 -187.56446 -181.96231 5.60215 2.15725 -182.88443 544.03214
5890.0000 -187.76017 -181.86475 5.89543 2.21531 -181.85182 582.17336
5895.0000 -187.76955 -183.04021 4.72934 2.16782 -182.69651 549.95266
5900.0000 -188.48835 -183.58871 4.89965 2.14391 -183.12174 545.39965
5905.0000 -187.88229 -182.79960 5.08268 2.12442 -183.46830 535.19722
5910.0000 -188.36786 -182.87605 5.49182 2.14783 -183.05198 536.36645
5915.0000 -187.38229 -182.00584 5.37645 2.17765 -182.52172 553.29434
5920.0000 -187.45349 -182.26808 5.18541 2.20932 -181.95840 582.67740
5925.0000 -189.23945 -184.15738 5.08207 2.12922 -183.38292 538.27833
5930.0000 -189.48625 -183.95390 5.53235 2.11164 -183.69565 525.44795
5935.0000 -188.80410 -183.40699 5.39711 2.15144 -182.98780 568.33371
5940.0000 -188.88747 -183.66555 5.22192 2.12417 -183.47270 539.99004
5945.0000 -187.34636 -182.65632 4.69004 2.17069 -182.64536 550.38910
5950.0000 -188.46041 -182.54821 5.91219 2.16838 -182.68660 534.51571
5955.0000 -188.40584 -183.14066 5.26518 2.16156 -182.80774 546.10567
5960.0000 -188.58868 -183.58072 5.00796 2.12864 -183.39320 521.47476
5965.0000 -188.30085 -183.63462 4.66622 2.16043 -182.82782 551.27138
5970.0000 -187.76417 -181.47892 6.28525 2.19585 -182.19789 580.74479
5975.0000 -188.27783 -182.46801 5.80982 2.18519 -182.38753 559.68701
5980.0000 -187.40325 -183.11399 4.28926 2.18837 -182.33098 548.45892
5985.0000 -188.42997 -182.87143 5.55854 2.15095 -182.99644 575.15907
5990.0000 -189.78870 -183.28748 6.50122 2.16858 -182.68298 599.68408
5995.0000 -189.54447 -184.47861 5.06587 2.08949 -184.08962 547.30528
6000.0000 -188.29259 -182.52750 5.76509 2.10014 -183.90021 549.82916
FREEZING PROCESS: loop number 25 T-loop= 552.00000000000000
main_MD> interactions number 25 at Temperature= 552.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.99780 0.54019 1.48822
force_rgl> df(natom) -1.00318 4.54318 2.22541
6005.0000 -188.30605 -183.68603 4.62002 2.15309 -182.95853 585.46670
6010.0000 -187.17338 -181.78275 5.39063 2.17301 -182.60422 586.88060
6015.0000 -188.07236 -183.61416 4.45820 2.17041 -182.65050 579.85891
6020.0000 -188.76934 -183.61683 5.15251 2.11201 -183.68910 526.43593
6025.0000 -189.72039 -183.20714 6.51325 2.11081 -183.71033 557.16450
6030.0000 -188.96732 -183.47773 5.48960 2.14627 -183.07981 574.50582
6035.0000 -188.33983 -183.00625 5.33358 2.13491 -183.28177 559.18551
6040.0000 -187.87926 -182.95941 4.91985 2.16418 -182.76115 573.59247
6045.0000 -188.02793 -182.74045 5.28749 2.16583 -182.73189 566.20289
6050.0000 -188.23127 -182.66455 5.56673 2.18870 -182.32508 592.78885
6055.0000 -188.87117 -183.48637 5.38481 2.16048 -182.82705 539.80179
6060.0000 -187.87481 -182.00886 5.86594 2.19542 -182.20570 572.16095
6065.0000 -187.23905 -181.90679 5.33226 2.20211 -182.08657 583.68409
6070.0000 -187.66272 -182.23522 5.42750 2.21431 -181.86961 581.21247
6075.0000 -187.92276 -182.37924 5.54351 2.19181 -182.26974 559.34168
6080.0000 -187.65696 -182.23467 5.42230 2.15404 -182.94149 546.07420
6085.0000 -187.72751 -183.22091 4.50660 2.14808 -183.04752 534.21757
6090.0000 -188.10070 -182.66052 5.44018 2.16427 -182.75953 541.33548
6095.0000 -187.74060 -182.51132 5.22928 2.19211 -182.26457 552.84568
6100.0000 -186.90305 -181.41585 5.48720 2.21179 -181.91447 564.96932
6105.0000 -187.87113 -182.47492 5.39621 2.23017 -181.58756 579.71600
6110.0000 -188.60993 -183.19757 5.41235 2.12840 -183.39752 531.39767
6115.0000 -188.06557 -183.26761 4.79796 2.09335 -184.02092 499.88491
6120.0000 -188.25111 -182.76737 5.48374 2.16937 -182.66892 563.40292
6125.0000 -188.58382 -183.40829 5.17553 2.14130 -183.16817 549.10261
6130.0000 -188.74470 -183.63095 5.11375 2.10210 -183.86532 519.19070
6135.0000 -188.25933 -183.03272 5.22661 2.13025 -183.36466 552.59276
6140.0000 -188.33048 -182.42234 5.90814 2.16908 -182.67402 563.35728
6145.0000 -188.47445 -182.85614 5.61831 2.19265 -182.25493 578.34902
6150.0000 -188.32747 -183.28728 5.04019 2.13545 -183.27221 515.74281
6155.0000 -187.75718 -183.39971 4.35747 2.13322 -183.31191 526.24173
6160.0000 -189.10889 -184.20711 4.90178 2.09153 -184.05333 493.84612
6165.0000 -189.13805 -184.20062 4.93743 2.08003 -184.25784 486.03268
6170.0000 -187.57112 -182.19298 5.37814 2.16932 -182.66989 572.60524
6175.0000 -188.19717 -182.83455 5.36262 2.18918 -182.31654 589.62170
6180.0000 -188.03143 -183.52945 4.50198 2.13804 -183.22611 572.17902
6185.0000 -189.71252 -183.70478 6.00774 2.11077 -183.71105 534.00195
6190.0000 -188.81060 -182.66338 6.14722 2.11645 -183.61002 549.45742
6195.0000 -187.99204 -182.76316 5.22889 2.15319 -182.95672 560.62495
6200.0000 -187.63731 -182.05221 5.58510 2.19538 -182.20629 615.85611
6205.0000 -188.75940 -183.16932 5.59008 2.19494 -182.21408 598.68415
6210.0000 -187.94541 -182.93965 5.00576 2.16494 -182.74768 550.33255
6215.0000 -187.38693 -182.64594 4.74099 2.14545 -183.09436 534.75230
6220.0000 -188.09247 -182.79132 5.30114 2.16763 -182.69985 549.27534
6225.0000 -187.92782 -182.89948 5.02834 2.12188 -183.51350 527.02777
6230.0000 -188.68401 -182.93760 5.74642 2.16099 -182.81786 563.55011
6235.0000 -188.42898 -182.15193 6.27705 2.17864 -182.50400 579.62574
6240.0000 -187.07364 -181.71499 5.35866 2.22977 -181.59475 572.74431
6245.0000 -186.84367 -182.75385 4.08983 2.20160 -182.09579 565.19321
6250.0000 -187.78558 -182.51973 5.26585 2.17191 -182.62382 539.79405
FREEZING PROCESS: loop number 26 T-loop= 527.00000000000000
main_MD> interactions number 26 at Temperature= 527.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.74371 1.34759 1.33563
force_rgl> df(natom) -0.26811 0.70310 -0.14712
6255.0000 -187.67968 -182.68591 4.99377 2.15410 -182.94049 531.88892
6260.0000 -189.06320 -183.45204 5.61116 2.16725 -182.70658 544.51818
6265.0000 -189.99403 -184.27681 5.71722 2.07529 -184.34213 504.33553
6270.0000 -188.93297 -183.67081 5.26215 2.07849 -184.28517 513.13166
6275.0000 -189.66617 -184.36887 5.29730 2.11030 -183.71946 542.53139
6280.0000 -189.44863 -183.36707 6.08156 2.10853 -183.75098 534.25530
6285.0000 -188.54161 -183.21996 5.32165 2.13771 -183.23203 561.38822
6290.0000 -189.49061 -184.32936 5.16125 2.14548 -183.09378 563.97220
6295.0000 -188.68553 -184.11936 4.56617 2.08293 -184.20625 527.13640
6300.0000 -189.28398 -183.93993 5.34405 2.11764 -183.58892 527.34513
6305.0000 -189.59862 -183.73079 5.86782 2.10115 -183.88209 526.26841
6310.0000 -189.28078 -185.08744 4.19334 2.10722 -183.77430 523.23126
6315.0000 -188.90423 -183.49889 5.40534 2.08988 -184.08257 496.68093
6320.0000 -188.81853 -182.91797 5.90056 2.15232 -182.97215 557.27241
6325.0000 -189.35178 -183.98260 5.36918 2.12702 -183.42213 540.98074
6330.0000 -189.08748 -183.67810 5.40938 2.11561 -183.62498 541.06331
6335.0000 -189.76063 -183.88850 5.87213 2.10938 -183.73586 547.00543
6340.0000 -188.66378 -183.91344 4.75034 2.08550 -184.16051 530.03768
6345.0000 -189.79190 -183.86908 5.92282 2.07584 -184.33221 528.33519
6350.0000 -188.80747 -183.75355 5.05392 2.06397 -184.54342 544.27758
6355.0000 -190.30363 -185.49608 4.80755 2.08083 -184.24346 567.74801
6360.0000 -190.67851 -186.18437 4.49414 1.99373 -185.79266 501.14813
6365.0000 -191.14952 -186.27956 4.86996 1.95416 -186.49640 466.49290
6370.0000 -190.70647 -185.67558 5.03089 1.99405 -185.78693 496.53059
6375.0000 -190.87066 -185.73851 5.13215 1.98245 -185.99315 489.68231
6380.0000 -190.99669 -186.15115 4.84554 1.99209 -185.82171 492.53167
6385.0000 -190.40643 -185.25357 5.15286 2.00612 -185.57225 496.01908
6390.0000 -188.73596 -183.52952 5.20644 2.08362 -184.19388 557.04511
6395.0000 -189.22071 -183.88964 5.33107 2.10532 -183.80796 563.81835
6400.0000 -188.96243 -184.10486 4.85757 2.10439 -183.82454 563.54723
6405.0000 -188.61443 -183.99926 4.61517 2.12187 -183.51367 580.89714
6410.0000 -189.00152 -184.28159 4.71993 2.11451 -183.64456 546.92830
6415.0000 -189.48607 -184.25279 5.23328 2.07612 -184.32724 532.81164
6420.0000 -189.35570 -183.92156 5.43414 2.09289 -184.02913 521.50411
6425.0000 -190.54418 -185.05991 5.48427 2.05707 -184.66612 516.83253
6430.0000 -188.79954 -183.57418 5.22536 2.07889 -184.27805 527.33797
6435.0000 -188.62073 -182.92285 5.69788 2.11914 -183.56218 542.71579
6440.0000 -188.93183 -183.98032 4.95151 2.10200 -183.86704 524.02729
6445.0000 -189.24092 -184.57254 4.66838 2.08349 -184.19628 514.34857
6450.0000 -188.64568 -184.12861 4.51707 2.08882 -184.10140 503.13763
6455.0000 -188.84982 -183.79519 5.05464 2.11819 -183.57911 526.39997
6460.0000 -188.23418 -183.22201 5.01218 2.12889 -183.38877 528.17254
6465.0000 -188.48802 -184.64723 3.84079 2.10855 -183.75056 515.01968
6470.0000 -189.06885 -184.23258 4.83627 2.06435 -184.53664 483.91603
6475.0000 -188.78425 -183.52433 5.25993 2.11326 -183.66680 525.16048
6480.0000 -188.77560 -184.29065 4.48495 2.08030 -184.25295 496.73422
6485.0000 -188.88562 -183.94433 4.94129 2.09672 -183.96101 502.24227
6490.0000 -188.39788 -182.63944 5.75844 2.12724 -183.41815 514.35636
6495.0000 -187.55883 -181.94394 5.61489 2.20943 -181.95652 590.91406
6500.0000 -188.97801 -183.61736 5.36065 2.16580 -182.73243 539.34010
FREEZING PROCESS: loop number 27 T-loop= 502.00000000000000
main_MD> interactions number 27 at Temperature= 502.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.51888 -1.77250 2.01291
force_rgl> df(natom) -2.16949 1.18972 1.18610
6505.0000 -189.02179 -183.92780 5.09400 2.08510 -184.16759 511.64490
6510.0000 -189.61716 -185.26074 4.35643 2.05251 -184.74723 472.02451
6515.0000 -188.79946 -184.33707 4.46239 2.05120 -184.77059 461.61362
6520.0000 -189.34071 -185.07149 4.26921 2.07931 -184.27050 481.74317
6525.0000 -188.81941 -183.95851 4.86090 2.07749 -184.30296 475.94344
6530.0000 -188.95459 -184.36877 4.58583 2.09523 -183.98741 488.73257
6535.0000 -189.16516 -185.07246 4.09269 2.04745 -184.83723 461.18469
6540.0000 -188.71145 -183.76614 4.94531 2.05933 -184.62583 477.92422
6545.0000 -188.36313 -183.60318 4.75995 2.09687 -183.95831 495.03349
6550.0000 -188.80173 -184.27125 4.53048 2.09512 -183.98945 496.10337
6555.0000 -189.46860 -184.25651 5.21209 2.11669 -183.60575 509.96400
6560.0000 -188.39017 -184.04734 4.34283 2.08884 -184.10105 491.87624
6565.0000 -189.57607 -184.69016 4.88591 2.08869 -184.10378 503.80247
6570.0000 -188.19195 -183.37015 4.82180 2.10614 -183.79341 506.02279
6575.0000 -187.13934 -182.07150 5.06784 2.15692 -182.89027 528.02139
6580.0000 -187.44401 -182.32338 5.12063 2.21761 -181.81100 566.05082
6585.0000 -188.73783 -183.66398 5.07385 2.13907 -183.20779 523.45725
6590.0000 -188.56622 -183.69629 4.86993 2.11313 -183.66913 525.97189
6595.0000 -189.74474 -183.70200 6.04273 2.13119 -183.34792 535.09697
6600.0000 -187.76015 -183.10307 4.65707 2.12970 -183.37440 514.78456
6605.0000 -188.82120 -183.64356 5.17764 2.09348 -184.01854 477.14470
6610.0000 -189.20235 -184.19232 5.01002 2.10053 -183.89327 513.82491
6615.0000 -189.23141 -184.37001 4.86140 2.04779 -184.83120 484.16843
6620.0000 -189.69858 -185.56665 4.13193 2.05554 -184.69324 489.40216
6625.0000 -190.70860 -185.69912 5.00948 2.01761 -185.36797 465.86184
6630.0000 -190.72077 -185.92691 4.79386 2.00231 -185.64005 456.64211
6635.0000 -189.29351 -184.57377 4.71974 2.04636 -184.85661 505.06351
6640.0000 -189.22855 -184.29587 4.93268 2.07284 -184.38565 506.85287
6645.0000 -189.60612 -184.43143 5.17469 2.07120 -184.41481 528.14317
6650.0000 -189.94944 -184.72524 5.22420 2.05657 -184.67494 526.95870
6655.0000 -190.29387 -185.61591 4.67795 2.02462 -185.24315 499.52033
6660.0000 -189.80580 -185.94968 3.85612 2.00952 -185.51183 490.00879
6665.0000 -190.85698 -186.58324 4.27374 1.96489 -186.30545 452.03159
6670.0000 -190.89106 -185.97743 4.91363 1.97109 -186.19519 462.99929
6675.0000 -189.88071 -185.73070 4.15001 1.96977 -186.21870 452.94746
6680.0000 -191.46030 -187.07866 4.38164 1.96273 -186.34396 437.66619
6685.0000 -189.95817 -185.17813 4.78004 1.95987 -186.39477 454.99969
6690.0000 -189.83450 -184.75218 5.08232 2.03749 -185.01427 509.31806
6695.0000 -189.21258 -184.49018 4.72240 2.06862 -184.46063 527.75029
6700.0000 -190.05899 -185.46157 4.59742 2.04455 -184.88878 488.83791
6705.0000 -190.31010 -185.37073 4.93937 1.99833 -185.71075 460.45116
6710.0000 -189.38018 -184.45582 4.92436 2.07484 -184.35009 510.00162
6715.0000 -189.51438 -184.68445 4.82992 2.06693 -184.49079 491.69456
6720.0000 -189.00464 -184.23591 4.76874 2.04038 -184.96291 468.95382
6725.0000 -187.75026 -183.36208 4.38818 2.10052 -183.89333 505.99543
6730.0000 -188.97835 -184.90532 4.07304 2.08813 -184.11375 500.36150
6735.0000 -189.90323 -184.93790 4.96532 2.03828 -185.00021 483.85535
6740.0000 -190.35092 -186.13012 4.22080 2.01668 -185.38442 472.87322
6745.0000 -189.49447 -185.05172 4.44276 2.00283 -185.63068 464.57228
6750.0000 -190.31540 -185.54247 4.77293 2.03354 -185.08460 526.71047
FREEZING PROCESS: loop number 28 T-loop= 477.00000000000000
main_MD> interactions number 28 at Temperature= 477.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -2.80379 -0.82658 0.48710
force_rgl> df(natom) 1.44328 1.06471 -0.55539
6755.0000 -190.82256 -185.78945 5.03311 1.98587 -185.93238 519.84222
6760.0000 -192.05424 -187.42800 4.62624 1.96075 -186.37913 505.90324
6765.0000 -191.58160 -186.31804 5.26356 1.95149 -186.54378 497.41140
6770.0000 -191.24089 -187.05371 4.18718 1.94475 -186.66364 500.48185
6775.0000 -191.80732 -186.37254 5.43478 1.93932 -186.76024 492.19757
6780.0000 -192.23937 -186.76970 5.46967 1.97237 -186.17237 514.42054
6785.0000 -191.35854 -186.70586 4.65268 1.95399 -186.49938 499.64573
6790.0000 -191.64164 -186.32707 5.31457 1.96302 -186.33880 509.41893
6795.0000 -190.59323 -185.52000 5.07323 1.99573 -185.75692 530.27508
6800.0000 -191.79923 -186.64110 5.15812 1.99021 -185.85511 525.87662
6805.0000 -191.38683 -186.78205 4.60478 1.95180 -186.53835 495.55726
6810.0000 -191.88437 -187.40220 4.48217 1.93488 -186.83916 486.30313
6815.0000 -191.90204 -187.36784 4.53420 1.88368 -187.74979 445.11995
6820.0000 -190.90819 -186.46191 4.44628 1.90411 -187.38649 463.51670
6825.0000 -190.74928 -185.90430 4.84498 1.96070 -186.38002 515.62501
6830.0000 -190.95604 -186.58382 4.37223 1.98559 -185.93736 525.84474
6835.0000 -191.74309 -187.65270 4.09039 1.89986 -187.46204 455.75152
6840.0000 -191.19831 -186.66357 4.53474 1.94034 -186.74201 491.83718
6845.0000 -191.78692 -187.10149 4.68543 1.91430 -187.20514 470.15045
6850.0000 -192.14180 -187.16246 4.97934 1.91160 -187.25324 467.48231
6855.0000 -191.65816 -186.89348 4.76468 1.93254 -186.88084 483.22913
6860.0000 -190.57770 -186.43705 4.14065 1.94145 -186.72228 489.39416
6865.0000 -192.07960 -187.08681 4.99279 1.93998 -186.74847 489.61612
6870.0000 -191.11623 -185.91727 5.19895 1.93547 -186.82877 483.04951
6875.0000 -190.93724 -186.53128 4.40596 1.97390 -186.14526 516.41250
6880.0000 -191.48199 -186.83830 4.64369 1.96770 -186.25552 513.83216
6885.0000 -191.64870 -187.14224 4.50646 1.93677 -186.80565 486.87894
6890.0000 -191.58923 -186.62321 4.96602 1.95843 -186.42037 506.28221
6895.0000 -190.94288 -186.30720 4.63568 1.96324 -186.33487 504.80986
6900.0000 -190.36126 -186.04245 4.31880 1.98125 -186.01452 522.78703
6905.0000 -191.81981 -186.08340 5.73641 1.98090 -186.02077 519.51646
6910.0000 -192.18759 -187.18683 5.00076 1.93033 -186.92014 484.35593
6915.0000 -191.78155 -187.21297 4.56858 1.90135 -187.43557 455.55130
6920.0000 -191.44599 -187.19385 4.25214 1.91352 -187.21915 467.57914
6925.0000 -192.03887 -186.93804 5.10084 1.92518 -187.01177 474.47172
6930.0000 -191.28619 -186.61708 4.66911 1.95208 -186.53329 499.61156
6935.0000 -191.00050 -186.82900 4.17149 1.92264 -187.05684 476.52555
6940.0000 -190.95786 -186.54927 4.40859 1.94899 -186.58823 493.34833
6945.0000 -192.69714 -187.17799 5.51915 1.92231 -187.06278 474.85478
6950.0000 -191.33288 -185.58821 5.74467 1.94238 -186.70583 484.89219
6955.0000 -191.24579 -186.60578 4.64001 1.98279 -185.98709 526.37450
6960.0000 -193.03115 -187.93550 5.09566 1.89943 -187.46961 455.79819
6965.0000 -191.39320 -186.71887 4.67433 1.91914 -187.11917 472.84834
6970.0000 -191.59165 -187.14046 4.45119 1.91057 -187.27147 466.71565
6975.0000 -191.81340 -186.94537 4.86803 1.94750 -186.61483 500.48303
6980.0000 -191.08346 -186.39143 4.69203 1.93443 -186.84725 481.10774
6985.0000 -191.65229 -186.34118 5.31110 1.96310 -186.33735 505.03579
6990.0000 -191.31665 -186.21286 5.10380 1.93706 -186.80043 485.38272
6995.0000 -192.06778 -187.40078 4.66700 1.93451 -186.84583 487.07597
7000.0000 -191.97262 -187.15009 4.82253 1.88697 -187.69117 445.22549
FREEZING PROCESS: loop number 29 T-loop= 452.00000000000000
main_MD> interactions number 29 at Temperature= 452.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.54877 -0.68344 -2.47790
force_rgl> df(natom) 2.09358 1.15954 -0.11083
7005.0000 -191.25593 -187.19899 4.05694 1.90696 -187.33574 464.33449
7010.0000 -191.88599 -186.65299 5.23301 1.93610 -186.81750 491.97762
7015.0000 -191.82695 -186.96795 4.85900 1.93231 -186.88486 485.04172
7020.0000 -191.38650 -186.83963 4.54687 1.96282 -186.34225 505.99762
7025.0000 -191.44237 -186.68456 4.75782 1.91670 -187.16243 466.89496
7030.0000 -192.00357 -187.69459 4.30898 1.91161 -187.25308 463.47387
7035.0000 -192.25154 -187.43694 4.81460 1.89901 -187.47715 454.70131
7040.0000 -191.52888 -187.05740 4.47149 1.89964 -187.46600 459.88947
7045.0000 -192.57728 -187.36245 5.21484 1.90796 -187.31800 465.46833
7050.0000 -192.07254 -187.61349 4.45905 1.92422 -187.02882 478.17516
7055.0000 -192.61899 -188.65860 3.96039 1.84990 -188.35057 418.31724
7060.0000 -192.47789 -188.39945 4.07844 1.85225 -188.30876 414.18470
7065.0000 -191.14526 -186.66889 4.47637 1.92273 -187.05528 474.49386
7070.0000 -192.32031 -188.20072 4.11959 1.92001 -187.10357 469.41582
7075.0000 -191.47021 -187.50029 3.96992 1.86699 -188.04656 429.55081
7080.0000 -192.26652 -187.60328 4.66324 1.90110 -187.43991 457.11683
7085.0000 -192.22449 -187.86203 4.36246 1.86137 -188.14657 421.24209
7090.0000 -191.63106 -187.66778 3.96329 1.89642 -187.52312 452.95247
7095.0000 -191.97791 -187.53686 4.44106 1.89555 -187.53873 450.16862
7100.0000 -190.97113 -186.80342 4.16771 1.91221 -187.24243 463.57838
7105.0000 -191.89421 -186.51642 5.37778 1.94875 -186.59260 499.23363
7110.0000 -192.28115 -188.21713 4.06402 1.90340 -187.39911 461.24554
7115.0000 -192.79778 -188.25570 4.54208 1.85847 -188.19817 424.47933
7120.0000 -191.71522 -187.55146 4.16376 1.88469 -187.73173 442.68146
7125.0000 -191.84237 -187.96152 3.88085 1.89776 -187.49934 456.24865
7130.0000 -191.98777 -187.42404 4.56373 1.85511 -188.25793 423.58703
7135.0000 -192.20852 -186.70114 5.50738 1.90084 -187.44449 458.92214
7140.0000 -191.13536 -187.14116 3.99420 1.94602 -186.64106 493.58941
7145.0000 -191.85150 -187.33580 4.51570 1.90808 -187.31587 462.87381
7150.0000 -191.78286 -186.18568 5.59717 1.92332 -187.04472 471.99725
7155.0000 -191.85937 -187.49549 4.36388 1.91393 -187.21181 470.25253
7160.0000 -192.34029 -187.66403 4.67627 1.88251 -187.77050 441.15634
7165.0000 -191.32642 -187.69247 3.63395 1.89399 -187.56631 456.02337
7170.0000 -191.67846 -186.82039 4.85807 1.91097 -187.26435 465.81700
7175.0000 -191.77819 -187.84929 3.92890 1.92865 -186.95007 472.15708
7180.0000 -191.46445 -187.26730 4.19715 1.89519 -187.54514 444.60251
7185.0000 -192.45023 -188.33693 4.11330 1.90146 -187.43352 454.08083
7190.0000 -191.65359 -187.45548 4.19811 1.88021 -187.81151 441.39959
7195.0000 -192.93538 -188.68614 4.24924 1.86712 -188.04421 428.22709
7200.0000 -192.26669 -188.33116 3.93553 1.86098 -188.15352 424.45178
7205.0000 -192.39521 -188.20872 4.18648 1.86177 -188.13946 426.57668
7210.0000 -192.34392 -187.99561 4.34831 1.86736 -188.04007 433.15687
7215.0000 -192.08298 -187.67976 4.40322 1.86705 -188.04546 430.71784
7220.0000 -192.77030 -188.98594 3.78436 1.86922 -188.00684 429.64124
7225.0000 -191.66559 -187.68040 3.98519 1.87019 -187.98974 432.06779
7230.0000 -191.93881 -187.45786 4.48095 1.88598 -187.70894 444.47623
7235.0000 -191.85895 -187.80668 4.05227 1.89581 -187.53411 452.24060
7240.0000 -191.84795 -187.34480 4.50315 1.91538 -187.18599 466.89059
7245.0000 -191.32472 -187.08675 4.23797 1.91660 -187.16421 467.72254
7250.0000 -191.50692 -187.17217 4.33475 1.91335 -187.22204 467.45421
FREEZING PROCESS: loop number 30 T-loop= 427.00000000000000
main_MD> interactions number 30 at Temperature= 427.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.99661 0.57284 -2.06273
force_rgl> df(natom) 0.06660 3.04375 1.65228
7255.0000 -191.81802 -187.43098 4.38704 1.92276 -187.05482 476.59527
7260.0000 -192.14876 -188.22069 3.92806 1.89837 -187.48843 458.33848
7265.0000 -192.29723 -188.43887 3.85835 1.84138 -188.50202 407.75949
7270.0000 -192.13319 -188.42186 3.71133 1.83832 -188.55641 406.47002
7275.0000 -191.34362 -187.36215 3.98147 1.86950 -188.00197 431.57944
7280.0000 -192.15544 -187.34660 4.80884 1.91340 -187.22116 469.28750
7285.0000 -191.87911 -187.32465 4.55446 1.90944 -187.29171 463.12499
7290.0000 -191.37087 -187.10715 4.26373 1.90085 -187.44446 458.62282
7295.0000 -192.29584 -187.44443 4.85141 1.90384 -187.39130 458.42468
7300.0000 -191.54079 -187.40324 4.13755 1.88774 -187.67752 448.10683
7305.0000 -192.23959 -187.68359 4.55599 1.90901 -187.29929 464.24513
7310.0000 -192.04401 -187.19351 4.85050 1.90455 -187.37856 461.71499
7315.0000 -192.20664 -187.65938 4.54726 1.89986 -187.46200 455.94448
7320.0000 -191.99598 -187.87407 4.12191 1.90388 -187.39044 458.60421
7325.0000 -191.86388 -187.89352 3.97036 1.88286 -187.76432 446.88967
7330.0000 -192.24731 -188.14586 4.10145 1.85194 -188.31421 416.80029
7335.0000 -192.57352 -188.87748 3.69603 1.83391 -188.63480 401.21492
7340.0000 -192.76516 -188.07245 4.69271 1.83714 -188.57741 406.05927
7345.0000 -192.74628 -188.29496 4.45131 1.85526 -188.25522 420.80982
7350.0000 -191.97170 -187.56179 4.40991 1.88845 -187.66499 445.52213
7355.0000 -191.03509 -187.06375 3.97134 1.88951 -187.64614 449.28925
7360.0000 -192.50804 -187.73946 4.76858 1.90255 -187.41418 467.03696
7365.0000 -192.87487 -188.39315 4.48173 1.87141 -187.96791 438.01568
7370.0000 -192.03687 -188.14501 3.89186 1.83699 -188.58016 407.12955
7375.0000 -191.72906 -187.53390 4.19516 1.89391 -187.56784 451.84792
7380.0000 -192.49931 -188.46579 4.03352 1.87347 -187.93136 431.73901
7385.0000 -192.01498 -188.21373 3.80124 1.84860 -188.37361 415.39966
7390.0000 -192.73757 -188.10157 4.63601 1.84358 -188.46286 410.54000
7395.0000 -191.98353 -187.93714 4.04639 1.88676 -187.69490 454.93221
7400.0000 -191.47902 -186.94012 4.53890 1.86887 -188.01311 431.25985
7405.0000 -192.62053 -188.34499 4.27554 1.89470 -187.55386 452.99443
7410.0000 -192.32139 -188.38987 3.93152 1.86383 -188.10269 426.61784
7415.0000 -191.92771 -188.24958 3.67814 1.85361 -188.28446 422.24748
7420.0000 -191.67979 -188.21311 3.46668 1.84559 -188.42718 414.14025
7425.0000 -192.74531 -188.95680 3.78850 1.86577 -188.06832 428.73048
7430.0000 -192.56074 -187.93416 4.62658 1.90720 -187.33151 459.20122
7435.0000 -191.96173 -188.11040 3.85132 1.86895 -188.01167 432.23042
7440.0000 -192.63246 -188.72266 3.90980 1.87055 -187.98330 436.42569
7445.0000 -192.27684 -188.38482 3.89202 1.84905 -188.36562 415.86456
7450.0000 -192.69251 -188.75372 3.93879 1.86750 -188.03754 429.13678
7455.0000 -192.47793 -189.11265 3.36529 1.82340 -188.82188 395.08142
7460.0000 -192.78628 -188.49384 4.29243 1.82332 -188.82316 394.31896
7465.0000 -191.79338 -186.92421 4.86917 1.86813 -188.02624 429.94231
7470.0000 -192.83457 -188.69375 4.14082 1.87747 -187.86027 440.73938
7475.0000 -192.34363 -187.83819 4.50544 1.86037 -188.16439 425.68966
7480.0000 -192.08913 -187.84562 4.24351 1.87065 -187.98155 431.60732
7485.0000 -192.28243 -188.09090 4.19153 1.86093 -188.15439 425.47841
7490.0000 -192.17388 -188.64892 3.52496 1.82948 -188.71366 399.32343
7495.0000 -192.08957 -188.54881 3.54075 1.83865 -188.55063 406.04808
7500.0000 -192.46919 -188.70555 3.76364 1.86349 -188.10878 424.71567
FREEZING PROCESS: loop number 31 T-loop= 402.00000000000000
main_MD> interactions number 31 at Temperature= 402.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.04379 -1.05837 -1.17775
force_rgl> df(natom) -4.25912 0.33163 -0.80400
7505.0000 -192.07318 -188.16716 3.90602 1.82936 -188.71586 399.09001
7510.0000 -191.46424 -187.41977 4.04447 1.87156 -187.96525 434.27941
7515.0000 -192.22567 -188.19283 4.03284 1.87499 -187.90429 437.51022
7520.0000 -192.23112 -187.94804 4.28308 1.85587 -188.24426 420.55190
7525.0000 -193.00410 -189.01264 3.99146 1.83899 -188.54446 409.19236
7530.0000 -192.73197 -188.76649 3.96548 1.82481 -188.79671 395.79035
7535.0000 -193.26835 -190.25606 3.01229 1.78525 -189.50033 361.65298
7540.0000 -192.23491 -188.76283 3.47208 1.80456 -189.15690 381.44774
7545.0000 -192.57271 -188.87423 3.69848 1.81625 -188.94903 386.68982
7550.0000 -192.23242 -188.61300 3.61942 1.80913 -189.07560 379.53686
7555.0000 -193.17375 -188.97907 4.19467 1.83220 -188.66539 403.34869
7560.0000 -191.95821 -188.16054 3.79766 1.82549 -188.78471 396.33716
7565.0000 -192.77860 -188.77242 4.00618 1.82472 -188.79834 393.68031
7570.0000 -192.75478 -189.49786 3.25692 1.80842 -189.08827 380.96884
7575.0000 -193.15097 -189.08936 4.06161 1.80424 -189.16263 378.41999
7580.0000 -192.01415 -188.20251 3.81164 1.84597 -188.42033 412.55354
7585.0000 -192.20645 -188.85814 3.34831 1.83847 -188.55374 406.25971
7590.0000 -192.46469 -188.45027 4.01443 1.83743 -188.57224 404.38547
7595.0000 -192.52474 -188.75689 3.76785 1.83674 -188.58448 403.16819
7600.0000 -192.30186 -188.57505 3.72681 1.82766 -188.74607 396.33893
7605.0000 -192.93170 -188.77757 4.15412 1.85612 -188.23993 419.93417
7610.0000 -192.34076 -188.67624 3.66452 1.81543 -188.96362 388.30163
7615.0000 -192.73452 -188.95661 3.77791 1.84195 -188.49188 415.39169
7620.0000 -192.23912 -188.54924 3.68987 1.84796 -188.38499 415.41184
7625.0000 -193.17652 -189.50317 3.67335 1.80016 -189.23519 378.01057
7630.0000 -192.27704 -188.30365 3.97339 1.84971 -188.35393 417.85856
7635.0000 -192.80769 -189.16688 3.64081 1.83057 -188.69424 398.92125
7640.0000 -192.23838 -188.23860 3.99978 1.81145 -189.03428 383.20362
7645.0000 -191.36702 -187.53741 3.82961 1.87080 -187.97879 429.45876
7650.0000 -193.05860 -188.17638 4.88222 1.88397 -187.74451 444.51342
7655.0000 -192.02613 -188.34158 3.68455 1.86892 -188.01224 433.43079
7660.0000 -192.64380 -189.50230 3.14149 1.82269 -188.83443 394.06950
7665.0000 -193.11980 -189.39150 3.72830 1.78950 -189.42469 366.80092
7670.0000 -192.75531 -189.23449 3.52082 1.81649 -188.94474 385.11342
7675.0000 -192.56476 -188.96129 3.60347 1.82385 -188.81372 394.21536
7680.0000 -192.68100 -188.50465 4.17636 1.81756 -188.92558 391.85924
7685.0000 -193.06041 -189.11675 3.94366 1.81169 -189.02999 384.49437
7690.0000 -192.72971 -189.27016 3.45955 1.81311 -189.00475 387.10682
7695.0000 -192.82038 -189.10822 3.71215 1.80565 -189.13745 376.49892
7700.0000 -193.10506 -189.17434 3.93072 1.80927 -189.07310 382.49516
7705.0000 -192.41430 -189.07227 3.34202 1.81325 -189.00238 388.67531
7710.0000 -192.01430 -188.45297 3.56133 1.82741 -188.75053 394.87964
7715.0000 -192.34818 -188.59224 3.75594 1.84033 -188.52070 410.63681
7720.0000 -192.28533 -187.76545 4.51987 1.84963 -188.35526 413.74687
7725.0000 -192.79687 -188.59365 4.20322 1.85542 -188.25227 419.35485
7730.0000 -192.39654 -188.85416 3.54238 1.82897 -188.72283 401.19690
7735.0000 -193.09878 -188.99959 4.09919 1.83029 -188.69923 402.11286
7740.0000 -193.22718 -189.28069 3.94649 1.81401 -188.98874 387.75305
7745.0000 -192.72438 -188.38539 4.33899 1.79889 -189.25775 373.19083
7750.0000 -192.62601 -188.11540 4.51060 1.86792 -188.03012 431.44083
FREEZING PROCESS: loop number 32 T-loop= 377.00000000000000
main_MD> interactions number 32 at Temperature= 377.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.82964 0.51996 -0.22231
force_rgl> df(natom) 0.27172 -0.87346 2.57626
7755.0000 -193.45205 -189.66185 3.79019 1.79875 -189.26016 370.42757
7760.0000 -193.39474 -189.71350 3.68124 1.77588 -189.66693 352.27424
7765.0000 -193.17894 -189.62869 3.55024 1.77817 -189.62613 356.02825
7770.0000 -193.31288 -189.79137 3.52151 1.76013 -189.94711 340.89116
7775.0000 -192.78129 -189.24232 3.53898 1.79856 -189.26356 373.12754
7780.0000 -192.35813 -188.59191 3.76622 1.82825 -188.73562 399.86190
7785.0000 -192.82605 -189.52777 3.29828 1.78088 -189.57803 361.34752
7790.0000 -193.18731 -190.04296 3.14435 1.74521 -190.21245 325.75203
7795.0000 -193.73687 -190.18532 3.55156 1.73910 -190.32099 323.00512
7800.0000 -192.42155 -188.70265 3.71890 1.78380 -189.52607 362.27525
7805.0000 -192.66288 -188.82719 3.83569 1.81121 -189.03864 382.70878
7810.0000 -192.84866 -189.08949 3.75917 1.82161 -188.85367 392.30090
7815.0000 -193.30510 -189.56641 3.73869 1.79214 -189.37773 367.36920
7820.0000 -192.90180 -189.34334 3.55846 1.78206 -189.55709 356.51816
7825.0000 -192.85389 -189.51118 3.34272 1.79468 -189.33255 370.58541
7830.0000 -193.56103 -189.91001 3.65102 1.77779 -189.63293 353.83104
7835.0000 -192.40964 -188.84009 3.56956 1.78528 -189.49984 362.69986
7840.0000 -192.23256 -188.48014 3.75242 1.84568 -188.42557 417.59522
7845.0000 -192.78041 -188.74577 4.03465 1.82874 -188.72678 398.99079
7850.0000 -192.15336 -188.45223 3.70113 1.82583 -188.77851 392.33932
7855.0000 -193.04385 -189.10931 3.93453 1.81715 -188.93290 387.56095
7860.0000 -192.85290 -189.11785 3.73505 1.81701 -188.93543 391.01960
7865.0000 -192.67617 -188.52303 4.15314 1.81974 -188.88688 388.90792
7870.0000 -192.90138 -189.14880 3.75258 1.80664 -189.11983 378.20475
7875.0000 -192.97760 -189.08867 3.88893 1.79422 -189.34072 371.55160
7880.0000 -192.79227 -189.46581 3.32647 1.78952 -189.42435 367.65779
7885.0000 -192.17403 -188.79532 3.37871 1.79907 -189.25446 370.96146
7890.0000 -192.72639 -189.55886 3.16753 1.79667 -189.29712 370.64577
7895.0000 -192.57423 -189.16401 3.41022 1.78366 -189.52850 358.84199
7900.0000 -192.84453 -188.55208 4.29245 1.84227 -188.48624 408.35944
7905.0000 -192.54451 -187.68450 4.86001 1.85978 -188.17486 428.11458
7910.0000 -192.43555 -188.15422 4.28132 1.86288 -188.11972 426.26607
7915.0000 -192.90946 -188.97754 3.93193 1.81936 -188.89365 395.38957
7920.0000 -192.68981 -189.30749 3.38231 1.78159 -189.56535 358.08018
7925.0000 -192.88588 -189.07621 3.80967 1.81694 -188.93666 390.05802
7930.0000 -192.86488 -189.31240 3.55248 1.78738 -189.46243 362.73480
7935.0000 -192.90142 -190.05768 2.84374 1.79822 -189.26968 374.80057
7940.0000 -193.17886 -190.21960 2.95926 1.75850 -189.97608 340.20839
7945.0000 -193.47200 -189.68106 3.79094 1.79767 -189.27942 371.69236
7950.0000 -193.35222 -189.49519 3.85702 1.79247 -189.37189 369.46904
7955.0000 -192.65486 -189.07744 3.57742 1.77666 -189.65312 352.12646
7960.0000 -192.59752 -188.97450 3.62302 1.80145 -189.21217 377.34748
7965.0000 -192.27063 -189.23742 3.03320 1.79389 -189.34665 367.52205
7970.0000 -193.00192 -189.03285 3.96906 1.81394 -188.99004 388.65403
7975.0000 -193.20554 -189.80507 3.40047 1.77815 -189.62660 358.18283
7980.0000 -193.30609 -189.93622 3.36988 1.76832 -189.80144 346.86779
7985.0000 -192.85758 -189.55630 3.30128 1.78321 -189.53664 359.79976
7990.0000 -193.01920 -189.97055 3.04864 1.76285 -189.89869 343.61266
7995.0000 -192.33821 -188.81836 3.51985 1.79579 -189.31288 369.61226
8000.0000 -192.61365 -188.99893 3.61472 1.81748 -188.92709 389.29578
FREEZING PROCESS: loop number 33 T-loop= 352.00000000000000
main_MD> interactions number 33 at Temperature= 352.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.01484 0.87045 -1.37887
force_rgl> df(natom) -0.55298 -1.49044 -0.29518
8005.0000 -193.04092 -189.74509 3.29583 1.80227 -189.19755 373.16607
8010.0000 -193.62276 -189.86202 3.76074 1.75647 -190.01217 337.63448
8015.0000 -193.26579 -189.95979 3.30600 1.76303 -189.89545 346.90817
8020.0000 -193.04821 -189.75602 3.29219 1.75600 -190.02043 339.09387
8025.0000 -192.28739 -189.14178 3.14562 1.77828 -189.62432 354.02487
8030.0000 -192.77281 -189.77294 2.99987 1.78909 -189.43195 362.20176
8035.0000 -192.65821 -189.10741 3.55080 1.77499 -189.68274 354.39629
8040.0000 -193.60971 -190.06437 3.54534 1.77418 -189.69717 351.38291
8045.0000 -192.83378 -189.40096 3.43282 1.76633 -189.83681 346.64480
8050.0000 -192.95777 -189.84251 3.11526 1.80039 -189.23104 372.69226
8055.0000 -193.03482 -189.48409 3.55073 1.77204 -189.73520 350.54987
8060.0000 -193.05309 -189.63639 3.41670 1.78042 -189.58621 355.58562
8065.0000 -192.94834 -189.79637 3.15196 1.76205 -189.91292 340.29865
8070.0000 -192.94436 -189.81424 3.13012 1.76153 -189.92213 342.30295
8075.0000 -192.92843 -189.39362 3.53482 1.77078 -189.75762 351.29602
8080.0000 -193.80845 -190.81381 2.99464 1.73676 -190.36265 321.75364
8085.0000 -193.42187 -190.15950 3.26237 1.74288 -190.25389 326.73812
8090.0000 -193.01286 -189.84465 3.16820 1.77094 -189.75484 349.31933
8095.0000 -193.07808 -189.54653 3.53155 1.76922 -189.78538 346.77961
8100.0000 -192.97431 -189.75460 3.21971 1.77655 -189.65493 355.76953
8105.0000 -192.97000 -190.10686 2.86314 1.75288 -190.07603 335.17798
8110.0000 -192.75776 -189.31236 3.44540 1.74708 -190.17906 330.53185
8115.0000 -193.25776 -190.07800 3.17976 1.77589 -189.66671 359.46299
8120.0000 -193.79922 -190.60791 3.19131 1.74035 -190.29880 323.20417
8125.0000 -193.25805 -190.12725 3.13080 1.73626 -190.37150 321.17163
8130.0000 -193.21810 -190.11335 3.10475 1.76306 -189.89490 342.04280
8135.0000 -193.44178 -190.21625 3.22553 1.76087 -189.93380 341.19373
8140.0000 -193.09291 -189.55068 3.54223 1.76014 -189.94678 340.96282
8145.0000 -193.25901 -189.84384 3.41516 1.77608 -189.66338 355.51576
8150.0000 -192.78703 -189.86096 2.92607 1.75013 -190.12485 331.75138
8155.0000 -192.76584 -188.85263 3.91320 1.80532 -189.14327 378.97144
8160.0000 -193.18438 -190.16278 3.02160 1.78288 -189.54242 358.27435
8165.0000 -193.56997 -189.98953 3.58044 1.75955 -189.95734 344.93549
8170.0000 -193.10594 -189.71309 3.39285 1.76944 -189.78148 347.86153
8175.0000 -193.39059 -190.27157 3.11902 1.76717 -189.82191 344.73827
8180.0000 -193.15797 -189.43689 3.72108 1.74679 -190.18425 335.40706
8185.0000 -193.29938 -189.49902 3.80036 1.79238 -189.37343 367.77882
8190.0000 -192.84019 -189.54746 3.29274 1.76611 -189.84062 343.79540
8195.0000 -192.84246 -188.70373 4.13873 1.81954 -188.89052 394.72561
8200.0000 -193.02522 -189.70539 3.31982 1.79137 -189.39139 371.84057
8205.0000 -193.45178 -190.24606 3.20572 1.75280 -190.07733 333.06323
8210.0000 -192.87871 -189.54677 3.33193 1.77256 -189.72589 352.85345
8215.0000 -192.94993 -188.95926 3.99066 1.77596 -189.66557 352.87995
8220.0000 -193.24662 -189.71671 3.52991 1.80227 -189.19766 376.95287
8225.0000 -193.31824 -189.86167 3.45657 1.77116 -189.75084 351.82296
8230.0000 -192.50040 -188.69604 3.80436 1.80301 -189.18434 376.42743
8235.0000 -193.23555 -189.96150 3.27405 1.79724 -189.28706 369.82156
8240.0000 -193.08773 -189.57457 3.51316 1.76802 -189.80665 347.09353
8245.0000 -192.75397 -189.12773 3.62625 1.77634 -189.65867 354.35635
8250.0000 -193.27283 -190.06600 3.20684 1.78633 -189.48115 373.06483
FREEZING PROCESS: loop number 34 T-loop= 327.00000000000000
main_MD> interactions number 34 at Temperature= 327.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.43124 -0.21530 0.45374
force_rgl> df(natom) 1.17527 0.56203 1.27798
8255.0000 -192.92507 -189.96641 2.95865 1.75949 -189.95839 342.22449
8260.0000 -193.42572 -190.46622 2.95950 1.74168 -190.27515 324.08662
8265.0000 -193.78996 -190.26771 3.52226 1.72562 -190.56078 314.38490
8270.0000 -193.60101 -190.19915 3.40186 1.73596 -190.37680 320.66446
8275.0000 -193.26669 -190.45197 2.81472 1.73535 -190.38781 318.90922
8280.0000 -193.14567 -190.90358 2.24209 1.72641 -190.54666 311.30747
8285.0000 -193.50389 -190.31451 3.18937 1.70577 -190.91375 294.39517
8290.0000 -193.66016 -190.52468 3.13548 1.74075 -190.29171 323.65026
8295.0000 -193.41570 -189.81014 3.60556 1.74322 -190.24775 326.44499
8300.0000 -193.28393 -189.84573 3.43819 1.77391 -189.70198 357.41794
8305.0000 -192.90498 -189.84285 3.06213 1.76451 -189.86909 345.76304
8310.0000 -193.93861 -190.66077 3.27784 1.72813 -190.51615 315.84536
8315.0000 -193.26357 -190.30896 2.95462 1.72975 -190.48734 315.39534
8320.0000 -193.62708 -190.27067 3.35641 1.76876 -189.79358 347.78265
8325.0000 -193.31852 -189.76861 3.54991 1.76796 -189.80784 348.03774
8330.0000 -193.18595 -189.97957 3.20638 1.75904 -189.96647 340.98212
8335.0000 -193.36409 -190.44184 2.92225 1.74714 -190.17805 327.38321
8340.0000 -193.05336 -190.38270 2.67066 1.73433 -190.40592 318.21254
8345.0000 -193.61795 -190.61168 3.00628 1.73320 -190.42602 316.65690
8350.0000 -193.72633 -190.79796 2.92837 1.72214 -190.62272 306.66827
8355.0000 -193.30134 -190.05584 3.24550 1.71828 -190.69133 306.93538
8360.0000 -192.89925 -189.29223 3.60701 1.77403 -189.69976 353.38715
8365.0000 -193.44755 -190.53838 2.90917 1.76708 -189.82337 350.82328
8370.0000 -193.67677 -190.03092 3.64585 1.75023 -190.12309 332.37390
8375.0000 -193.53865 -189.93266 3.60599 1.75360 -190.06314 335.12734
8380.0000 -193.56922 -190.57001 2.99921 1.74173 -190.27433 323.66123
8385.0000 -193.41105 -190.50294 2.90811 1.72243 -190.61758 306.15378
8390.0000 -193.70354 -190.50493 3.19861 1.71954 -190.66898 304.76112
8395.0000 -192.96890 -189.89052 3.07839 1.74966 -190.13315 329.65020
8400.0000 -193.65653 -190.19461 3.46192 1.75135 -190.10325 334.64760
8405.0000 -193.55341 -190.67936 2.87404 1.74137 -190.28068 324.97499
8410.0000 -193.41685 -190.69512 2.72174 1.72377 -190.59363 308.58688
8415.0000 -193.68475 -190.28069 3.40406 1.73940 -190.31573 320.89942
8420.0000 -193.36162 -190.70848 2.65314 1.72938 -190.49391 313.44842
8425.0000 -192.99984 -189.61576 3.38408 1.74715 -190.17788 329.86512
8430.0000 -193.66765 -190.81016 2.85749 1.73767 -190.34641 320.63253
8435.0000 -193.71228 -190.43279 3.27949 1.71714 -190.71159 305.27027
8440.0000 -193.74820 -189.70710 4.04110 1.77177 -189.74000 351.25964
8445.0000 -192.67129 -189.71490 2.95639 1.77352 -189.70885 353.88640
8450.0000 -193.23244 -189.75141 3.48103 1.76900 -189.78936 347.46269
8455.0000 -193.11408 -189.61814 3.49593 1.77747 -189.63864 353.99313
8460.0000 -193.33926 -189.25033 4.08893 1.80290 -189.18636 375.62945
8465.0000 -193.09330 -190.05048 3.04282 1.76431 -189.87262 342.51075
8470.0000 -193.07367 -189.81161 3.26206 1.73908 -190.32143 321.94272
8475.0000 -193.18993 -189.90172 3.28821 1.75865 -189.97335 335.97941
8480.0000 -192.90809 -190.22038 2.68772 1.74378 -190.23784 326.00148
8485.0000 -193.56735 -190.69151 2.87584 1.73104 -190.46437 315.72904
8490.0000 -193.23674 -189.95927 3.27747 1.72901 -190.50046 311.42782
8495.0000 -193.18118 -189.94410 3.23708 1.77101 -189.75350 347.54679
8500.0000 -193.18190 -189.56178 3.62012 1.77767 -189.63508 352.32790
FREEZING PROCESS: loop number 35 T-loop= 302.00000000000000
main_MD> interactions number 35 at Temperature= 302.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.17929 0.89029 -0.02344
force_rgl> df(natom) -0.63321 -0.39756 -2.25312
8505.0000 -193.74290 -191.17740 2.56550 1.72693 -190.53743 310.91385
8510.0000 -193.52805 -190.79534 2.73270 1.71775 -190.70074 303.34102
8515.0000 -193.25319 -190.22917 3.02402 1.73454 -190.40214 321.07173
8520.0000 -194.16629 -191.89667 2.26962 1.69388 -191.12517 285.77767
8525.0000 -194.26695 -191.37016 2.89679 1.67256 -191.50439 264.88169
8530.0000 -194.34312 -191.62326 2.71986 1.68088 -191.35646 273.05843
8535.0000 -194.08863 -191.61961 2.46903 1.66700 -191.60328 260.17172
8540.0000 -193.68374 -191.22176 2.46198 1.69698 -191.07015 284.79816
8545.0000 -193.85990 -190.82203 3.03787 1.68784 -191.23267 279.13724
8550.0000 -193.40960 -190.71009 2.69950 1.72075 -190.64731 309.23000
8555.0000 -193.94515 -191.44213 2.50301 1.68984 -191.19702 279.22988
8560.0000 -194.11598 -191.17946 2.93652 1.66596 -191.62185 259.96279
8565.0000 -193.31636 -190.58258 2.73377 1.70181 -190.98417 288.92954
8570.0000 -193.17136 -190.43814 2.73321 1.73203 -190.44670 314.80394
8575.0000 -194.29994 -191.45555 2.84439 1.70679 -190.89559 294.34122
8580.0000 -193.93079 -190.95984 2.97095 1.69670 -191.07515 284.92770
8585.0000 -193.96268 -191.02843 2.93426 1.69832 -191.04630 285.38636
8590.0000 -193.38017 -190.37290 3.00727 1.70780 -190.87769 294.51199
8595.0000 -193.74965 -190.59532 3.15433 1.73605 -190.37525 321.77035
8600.0000 -193.68921 -190.93476 2.75445 1.71801 -190.69605 306.63861
8605.0000 -193.21287 -190.43163 2.78124 1.71596 -190.73256 303.33288
8610.0000 -193.51125 -189.82474 3.68651 1.74903 -190.14445 330.60469
8615.0000 -193.79786 -190.69276 3.10510 1.72705 -190.53528 311.60340
8620.0000 -194.04653 -191.14400 2.90253 1.71175 -190.80740 296.37724
8625.0000 -193.65245 -190.91692 2.73553 1.69966 -191.02252 290.87027
8630.0000 -194.14646 -191.35949 2.78697 1.70261 -190.97002 292.83950
8635.0000 -193.83711 -190.65548 3.18163 1.70747 -190.88359 296.94987
8640.0000 -193.45679 -190.46189 2.99490 1.72605 -190.55315 313.42184
8645.0000 -193.16879 -190.30089 2.86790 1.73409 -190.41018 318.36409
8650.0000 -193.49768 -190.52039 2.97729 1.72183 -190.62814 307.78648
8655.0000 -193.68105 -190.57342 3.10763 1.73360 -190.41886 317.39081
8660.0000 -193.91003 -190.44203 3.46800 1.71577 -190.73590 301.32373
8665.0000 -193.88543 -190.68041 3.20502 1.72943 -190.49301 313.96997
8670.0000 -193.19905 -190.17884 3.02021 1.72502 -190.57147 311.84337
8675.0000 -193.25423 -190.28451 2.96972 1.74449 -190.22516 329.17434
8680.0000 -194.05334 -191.25520 2.79814 1.71752 -190.70475 304.82354
8685.0000 -193.67022 -191.20220 2.46803 1.69820 -191.04835 287.47419
8690.0000 -193.55521 -190.33747 3.21774 1.71306 -190.78408 301.18372
8695.0000 -193.71685 -191.11150 2.60536 1.71780 -190.69981 305.83094
8700.0000 -193.22060 -190.42838 2.79222 1.72449 -190.58094 313.04148
8705.0000 -193.90678 -190.83476 3.07202 1.74372 -190.23893 327.72737
8710.0000 -193.74161 -190.77460 2.96701 1.70760 -190.88117 296.20997
8715.0000 -193.14190 -190.61078 2.53113 1.71164 -190.80937 299.27212
8720.0000 -194.08131 -191.14615 2.93516 1.70849 -190.86535 299.89759
8725.0000 -193.55044 -190.84113 2.70931 1.70754 -190.88238 295.31877
8730.0000 -193.66271 -190.77978 2.88293 1.70632 -190.90399 293.03242
8735.0000 -193.68214 -190.50907 3.17307 1.71142 -190.81327 299.53889
8740.0000 -193.92293 -191.07289 2.85005 1.73050 -190.47403 315.96761
8745.0000 -193.75993 -190.94112 2.81881 1.70436 -190.93893 292.46080
8750.0000 -193.87363 -191.06190 2.81173 1.70581 -190.91314 292.63601
main_MD> EXECUTION TIME: 0 [day], 0 [hour], 13 [min], 24.4294162 [s].
main_MD> Deallocating global variables
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