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nanoparticlesims/growth_Melting_Silver_ICO_3269/freezeSims/run_54/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_54.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 = 54 ntipo2 = 0
read_input> Finish reading input
main_MD> Allocating global variables
main_MD> Number of outputs that will be created: 1600
main_MD> Size of nv and nvoiz: 54 5400
main_MD> Size of nv and nvoiz: 54 5400
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 = 54
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> 8.8106967543403146E-004 -3.3528069190082652E-002 -1.8315642483108633E-002 initial drift of cluster / NP1 for coalescence
init> 0.29476175732112647 0.29333726472630817 0.29612432499910812 scaling for velocity /for coalescence NP1
init.f90 > facguy = 3.5722054089766505E-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) 2.55022 -2.13488 2.33893
force_rgl> df(natom) 2.26869 0.64796 1.95118
preparo> THERMALIZATION PROCESS AT 1102.4760507425235
preparo> TOTAL ENERGY, KINETIC EN., POT. ENERGY, DELTA
5000 -118.33475590534492 9.3497047280483336 -127.68446063339326 6.1651810299738355E-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 32
FREEZING PROCESS: loop number 1 T-loop= 1082.0000000000000
main_MD> interactions number 1 at Temperature= 1082.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 6.61297 1.02325 0.92409
force_rgl> df(natom) 0.94224 -0.81406 -0.46665
5.0000 -125.82227 -117.80683 8.01544 2.90206 -117.83935 1120.22641
10.0000 -125.08050 -117.55101 7.52949 2.84150 -118.70459 1091.92482
15.0000 -125.19704 -117.04866 8.14839 2.92301 -117.54013 1152.08858
20.0000 -126.40311 -118.24301 8.16010 2.96731 -116.90726 1146.01922
25.0000 -126.57146 -117.57536 8.99610 2.89033 -118.00699 1137.81237
30.0000 -126.06654 -117.18264 8.88390 2.96630 -116.92157 1188.22716
35.0000 -126.37891 -117.93621 8.44270 2.95123 -117.13692 1208.10020
40.0000 -127.09842 -120.70653 6.39189 2.81095 -119.14105 1071.79611
45.0000 -126.04388 -119.94166 6.10221 2.70648 -120.63354 991.05416
50.0000 -126.85899 -118.35985 8.49914 2.81822 -119.03713 1083.87548
55.0000 -126.47802 -118.60423 7.87379 2.89191 -117.98443 1148.32461
60.0000 -127.56430 -119.40380 8.16050 2.79163 -119.41708 1086.37110
65.0000 -127.82553 -118.00821 9.81732 2.77589 -119.64199 1072.70607
70.0000 -126.97224 -119.75579 7.21645 2.79933 -119.30702 1100.22815
75.0000 -127.54437 -118.46645 9.07792 2.86527 -118.36502 1154.91282
80.0000 -126.08895 -118.26763 7.82132 2.89433 -117.94985 1160.90393
85.0000 -126.30459 -118.52250 7.78209 2.93276 -117.40082 1155.34121
90.0000 -126.80360 -118.17834 8.62526 2.79227 -119.40795 1070.48647
95.0000 -126.71814 -118.86052 7.85762 2.91819 -117.60896 1147.66943
100.0000 -125.92227 -117.73425 8.18802 2.85942 -118.44865 1103.03427
105.0000 -126.99684 -119.53258 7.46425 2.81970 -119.01606 1122.98237
110.0000 -126.17182 -117.91955 8.25226 2.82877 -118.88653 1086.61547
115.0000 -127.09292 -119.99029 7.10263 2.83269 -118.83043 1089.22412
120.0000 -128.87951 -120.52981 8.34970 2.66952 -121.16157 992.52790
125.0000 -127.68177 -120.58706 7.09471 2.68022 -121.00869 983.75042
130.0000 -125.97608 -118.89640 7.07969 2.73652 -120.20436 1050.61986
135.0000 -123.99661 -116.95605 7.04056 2.87656 -118.20373 1101.71250
140.0000 -126.25329 -119.26397 6.98932 2.95574 -117.07249 1179.04061
145.0000 -127.27008 -117.89422 9.37586 2.79161 -119.41735 1072.59292
150.0000 -126.00193 -118.77310 7.22883 2.89188 -117.98485 1149.99084
155.0000 -127.48558 -120.75470 6.73088 2.79703 -119.33993 1090.82530
160.0000 -127.01663 -119.59894 7.41769 2.77504 -119.65403 1081.72965
165.0000 -127.06673 -120.18351 6.88322 2.72861 -120.31745 1021.42864
170.0000 -127.02298 -118.97884 8.04414 2.83762 -118.76000 1097.02536
175.0000 -125.49335 -117.79150 7.70185 2.83848 -118.74775 1115.16632
180.0000 -127.58132 -119.60205 7.97928 2.94097 -117.28348 1182.93230
185.0000 -127.82348 -120.37213 7.45135 2.67968 -121.01644 1008.05937
190.0000 -126.73899 -119.17965 7.55934 2.76554 -119.78987 1044.33668
195.0000 -125.98451 -117.52073 8.46378 2.85091 -118.57015 1113.56501
200.0000 -127.40098 -118.18165 9.21933 2.92294 -117.54116 1151.56555
205.0000 -125.09246 -118.84923 6.24324 2.86698 -118.34055 1112.96596
210.0000 -126.76390 -119.67976 7.08414 2.80171 -119.27305 1063.61109
215.0000 -126.74940 -118.87707 7.87232 2.82636 -118.92089 1104.01125
220.0000 -126.49597 -118.79697 7.69899 2.86344 -118.39117 1140.75155
225.0000 -127.98942 -120.24668 7.74274 2.74873 -120.02991 1063.86806
230.0000 -127.57196 -121.01133 6.56063 2.74041 -120.14878 1043.02167
235.0000 -127.92980 -120.43415 7.49565 2.68171 -120.98753 970.02442
240.0000 -125.67318 -118.92131 6.75186 2.82732 -118.90712 1096.13487
245.0000 -126.81659 -118.94935 7.86724 2.86726 -118.33654 1102.01545
250.0000 -127.01178 -119.79799 7.21379 2.73472 -120.23013 998.66083
FREEZING PROCESS: loop number 2 T-loop= 1057.0000000000000
main_MD> interactions number 2 at Temperature= 1057.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 4.63782 -7.36356 -5.46378
force_rgl> df(natom) 2.40660 -0.27596 -1.12704
255.0000 -126.12169 -118.81063 7.31106 2.78773 -119.47277 1047.78616
260.0000 -127.15309 -119.83476 7.31833 2.74018 -120.15206 1047.45625
265.0000 -126.12951 -117.95240 8.17711 2.77617 -119.63790 1044.80792
270.0000 -125.07143 -116.43087 8.64056 2.92553 -117.50411 1148.72697
275.0000 -126.25898 -117.67371 8.58527 2.94631 -117.20716 1140.01136
280.0000 -124.67237 -117.16372 7.50866 2.91487 -117.65635 1143.03353
285.0000 -126.96965 -119.52998 7.43967 2.84154 -118.70405 1102.94015
290.0000 -126.38471 -119.11450 7.27021 2.78200 -119.55461 1052.68189
295.0000 -128.28462 -121.99576 6.28886 2.65429 -121.37919 992.11497
300.0000 -126.61628 -119.30578 7.31050 2.65066 -121.43101 955.16746
305.0000 -127.61475 -119.93749 7.67726 2.72593 -120.35574 993.41395
310.0000 -127.60890 -121.06657 6.54234 2.70311 -120.68171 1012.99970
315.0000 -127.98659 -120.51878 7.46781 2.67266 -121.11672 996.81011
320.0000 -126.38919 -119.83630 6.55289 2.72475 -120.37252 1027.51893
325.0000 -125.85190 -119.19095 6.66095 2.80976 -119.15811 1113.32006
330.0000 -128.59797 -120.72883 7.86914 2.72448 -120.37637 1032.69425
335.0000 -127.47839 -119.84469 7.63369 2.72972 -120.30152 1015.12451
340.0000 -126.42145 -118.36200 8.05945 2.81107 -119.13939 1083.14416
345.0000 -127.07821 -119.01170 8.06651 2.85690 -118.48455 1108.03344
350.0000 -125.86329 -119.03540 6.82789 2.86356 -118.38947 1169.41110
355.0000 -126.83788 -118.78744 8.05044 2.85125 -118.56525 1108.49947
360.0000 -124.58672 -117.55530 7.03142 2.87040 -118.29173 1072.29470
365.0000 -126.97686 -118.94222 8.03464 2.85429 -118.52188 1094.91604
370.0000 -127.33216 -121.14384 6.18831 2.80063 -119.28856 1095.11640
375.0000 -127.38527 -120.90289 6.48238 2.66198 -121.26940 989.72406
380.0000 -128.43839 -119.60632 8.83207 2.68655 -120.91834 978.34076
385.0000 -127.84896 -120.14279 7.70617 2.76054 -119.86129 1043.41828
390.0000 -128.87712 -121.98925 6.88787 2.73252 -120.26152 1082.24332
395.0000 -128.84772 -121.21563 7.63208 2.67734 -121.04991 1016.66286
400.0000 -128.37866 -120.85620 7.52246 2.60788 -122.04222 967.49446
405.0000 -126.74769 -119.95293 6.79476 2.78181 -119.55731 1104.69652
410.0000 -125.02182 -117.91654 7.10528 2.84742 -118.61998 1140.18039
415.0000 -127.29360 -120.14290 7.15070 2.80227 -119.26501 1052.54170
420.0000 -128.46149 -120.36326 8.09822 2.77334 -119.67838 1102.36345
425.0000 -128.34631 -120.97883 7.36748 2.69046 -120.86241 1033.92822
430.0000 -126.72783 -120.24580 6.48203 2.71821 -120.46599 1035.84990
435.0000 -128.80861 -121.50826 7.30035 2.68220 -120.98046 982.89310
440.0000 -127.35417 -120.65566 6.69851 2.63443 -121.66294 925.03644
445.0000 -126.91143 -120.69464 6.21679 2.70238 -120.69217 974.86984
450.0000 -128.30862 -121.83167 6.47694 2.68287 -120.97086 980.53791
455.0000 -127.62871 -120.79968 6.82903 2.65905 -121.31114 977.92298
460.0000 -125.92118 -119.35129 6.56989 2.67752 -121.04738 973.59162
465.0000 -126.25390 -119.64125 6.61265 2.83662 -118.77430 1083.47272
470.0000 -127.89653 -119.82259 8.07394 2.72813 -120.32422 1011.60339
475.0000 -127.17550 -119.59866 7.57684 2.78271 -119.54457 1093.36299
480.0000 -125.23759 -118.89287 6.34471 2.83383 -118.81418 1082.26438
485.0000 -126.83137 -120.98100 5.85037 2.75556 -119.93243 1066.03527
490.0000 -127.10328 -120.65478 6.44850 2.67597 -121.06942 987.46647
495.0000 -127.74705 -120.15369 7.59335 2.64606 -121.49675 975.90765
500.0000 -128.61791 -122.18575 6.43216 2.65974 -121.30126 959.95301
FREEZING PROCESS: loop number 3 T-loop= 1032.0000000000000
main_MD> interactions number 3 at Temperature= 1032.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.64901 -1.63061 -0.14914
force_rgl> df(natom) -0.33406 3.03935 3.48249
505.0000 -128.52088 -121.73111 6.78977 2.64214 -121.55275 951.09373
510.0000 -127.09178 -120.26586 6.82592 2.67734 -121.04992 1000.81450
515.0000 -129.36464 -121.35763 8.00701 2.70814 -120.60993 997.42064
520.0000 -127.41262 -119.98741 7.42521 2.68386 -120.95667 968.37783
525.0000 -127.23956 -119.51885 7.72071 2.82863 -118.88847 1122.12044
530.0000 -126.88919 -119.64146 7.24773 2.74071 -120.14452 1021.76927
535.0000 -126.46450 -120.21533 6.24917 2.78140 -119.56326 1056.80047
540.0000 -129.22725 -123.16283 6.06442 2.63410 -121.66762 955.49699
545.0000 -127.09991 -119.96026 7.13965 2.65718 -121.33789 984.89629
550.0000 -126.93155 -119.18959 7.74196 2.73184 -120.27123 1039.30744
555.0000 -126.85458 -120.17658 6.67800 2.83264 -118.83122 1080.00680
560.0000 -128.01366 -121.51765 6.49602 2.73264 -120.25978 1023.17097
565.0000 -128.06032 -120.05857 8.00175 2.70076 -120.71532 1011.00501
570.0000 -126.00870 -118.87858 7.13011 2.80119 -119.28051 1083.62069
575.0000 -126.36063 -119.45104 6.90959 2.79148 -119.41915 1050.98227
580.0000 -127.88356 -119.11390 8.76966 2.76574 -119.78698 1044.08584
585.0000 -128.85184 -120.56986 8.28198 2.80705 -119.19677 1072.92363
590.0000 -126.66220 -119.26071 7.40149 2.74217 -120.12374 1036.27534
595.0000 -126.45519 -119.64918 6.80601 2.77205 -119.69684 1077.30130
600.0000 -126.93384 -118.44740 8.48645 2.84024 -118.72256 1140.82665
605.0000 -128.20784 -121.81155 6.39630 2.74165 -120.13115 1026.63175
610.0000 -128.56756 -120.71425 7.85331 2.63920 -121.59484 979.95549
615.0000 -127.57326 -119.57242 8.00084 2.72430 -120.37899 1021.00304
620.0000 -127.03348 -119.49331 7.54018 2.81068 -119.14495 1094.97736
625.0000 -126.06210 -117.84967 8.21243 2.82500 -118.94033 1083.54758
630.0000 -126.67563 -118.51873 8.15690 2.86187 -118.41365 1156.40888
635.0000 -126.86416 -120.54518 6.31898 2.77066 -119.71672 1053.66888
640.0000 -127.69735 -120.51848 7.17887 2.74352 -120.10433 1028.92592
645.0000 -127.08255 -121.49591 5.58664 2.71958 -120.44648 1007.08938
650.0000 -126.62271 -120.31803 6.30468 2.70244 -120.69126 1012.26343
655.0000 -126.89275 -120.27398 6.61877 2.71380 -120.52898 1037.83656
660.0000 -125.74667 -118.63402 7.11266 2.75676 -119.91520 1047.74326
665.0000 -127.05829 -120.33221 6.72608 2.75919 -119.88053 1030.00860
670.0000 -128.77819 -119.66134 9.11685 2.69151 -120.84745 976.13108
675.0000 -125.42027 -119.21307 6.20720 2.83967 -118.73078 1107.48389
680.0000 -126.39575 -118.87207 7.52369 2.78217 -119.55226 1068.64533
685.0000 -128.27876 -119.44622 8.83254 2.83230 -118.83597 1097.75412
690.0000 -126.70842 -119.09878 7.60964 2.79369 -119.38758 1069.31651
695.0000 -126.01829 -120.24352 5.77478 2.72576 -120.35819 998.78288
700.0000 -125.48786 -118.79482 6.69304 2.82626 -118.92230 1121.24091
705.0000 -126.19338 -119.08151 7.11186 2.77203 -119.69707 1030.07685
710.0000 -127.41162 -121.66872 5.74290 2.77491 -119.65590 1091.39995
715.0000 -127.00148 -119.48590 7.51558 2.71980 -120.44332 984.20316
720.0000 -128.04153 -120.98639 7.05514 2.75321 -119.96599 1026.57282
725.0000 -127.51348 -121.19900 6.31447 2.66533 -121.22150 991.65820
730.0000 -127.85416 -121.77841 6.07574 2.69271 -120.83033 986.77882
735.0000 -128.05486 -120.53809 7.51677 2.67928 -121.02211 984.96591
740.0000 -127.42656 -119.58345 7.84311 2.69404 -120.81134 977.89557
745.0000 -127.44927 -120.69909 6.75018 2.67049 -121.14773 989.06946
750.0000 -126.43915 -119.04484 7.39430 2.72672 -120.34443 1037.12202
FREEZING PROCESS: loop number 4 T-loop= 1007.0000000000000
main_MD> interactions number 4 at Temperature= 1007.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.34844 -3.76577 -0.87659
force_rgl> df(natom) 0.90089 -0.67811 -1.30370
755.0000 -126.67080 -118.39745 8.27334 2.79720 -119.33744 1096.45884
760.0000 -129.66010 -122.47005 7.19005 2.71163 -120.56002 1033.42751
765.0000 -128.26831 -122.12794 6.14037 2.63739 -121.62070 958.92581
770.0000 -126.68382 -118.75802 7.92581 2.77272 -119.68722 1021.49456
775.0000 -127.58284 -121.59809 5.98476 2.71208 -120.55353 1036.65039
780.0000 -128.15168 -121.96392 6.18776 2.63354 -121.67566 957.75073
785.0000 -127.60085 -120.26878 7.33208 2.63009 -121.72499 954.11787
790.0000 -127.15497 -118.63758 8.51738 2.81662 -119.06012 1107.28787
795.0000 -126.70406 -119.92796 6.77610 2.74484 -120.08557 1030.90121
800.0000 -127.59984 -119.40692 8.19292 2.77966 -119.58812 1075.19393
805.0000 -127.94541 -119.92317 8.02224 2.83102 -118.85439 1089.83647
810.0000 -127.05157 -120.02857 7.02300 2.77864 -119.60267 1072.11086
815.0000 -128.76600 -120.92468 7.84132 2.69253 -120.83293 983.84574
820.0000 -127.31146 -121.56729 5.74417 2.65594 -121.35565 1006.84466
825.0000 -128.67797 -122.14207 6.53590 2.62542 -121.79171 950.14616
830.0000 -127.10621 -120.18703 6.91918 2.74787 -120.04227 1018.28678
835.0000 -128.78346 -123.10962 5.67384 2.62241 -121.83469 941.37663
840.0000 -126.47197 -121.38953 5.08244 2.64257 -121.54667 923.99047
845.0000 -128.28823 -121.62288 6.66535 2.63935 -121.59268 941.51658
850.0000 -129.35405 -123.33294 6.02110 2.54111 -122.99610 903.98622
855.0000 -129.01437 -122.31659 6.69778 2.60287 -122.11375 961.10272
860.0000 -126.20573 -119.91639 6.28934 2.69816 -120.75239 1000.64733
865.0000 -125.60907 -118.71930 6.88976 2.70574 -120.64413 1026.88973
870.0000 -126.26740 -119.65453 6.61287 2.79921 -119.30877 1064.10067
875.0000 -126.88089 -121.08663 5.79425 2.75819 -119.89484 1046.69034
880.0000 -128.77640 -122.02974 6.74666 2.62639 -121.77775 956.33569
885.0000 -129.25481 -121.94817 7.30664 2.59200 -122.26907 921.34767
890.0000 -127.61409 -121.09558 6.51852 2.65708 -121.33927 974.59516
895.0000 -126.93910 -121.65811 5.28099 2.68742 -120.90589 982.48019
900.0000 -128.52741 -122.12443 6.40298 2.66594 -121.21274 998.05915
905.0000 -128.84554 -120.02620 8.81934 2.66571 -121.21598 957.44712
910.0000 -128.39387 -121.19877 7.19510 2.70048 -120.71928 1019.44674
915.0000 -128.58734 -122.26506 6.32229 2.62990 -121.72763 970.21191
920.0000 -126.37036 -119.15949 7.21087 2.67019 -121.15206 1017.13523
925.0000 -127.16194 -119.12211 8.03983 2.79928 -119.30776 1103.49711
930.0000 -126.44952 -117.95937 8.49015 2.88901 -118.02580 1128.08100
935.0000 -126.15386 -118.56251 7.59135 2.86218 -118.40911 1145.92952
940.0000 -128.60940 -121.27863 7.33077 2.68614 -120.92412 995.69895
945.0000 -129.32508 -122.67982 6.64525 2.64679 -121.48632 994.01931
950.0000 -129.60920 -122.20064 7.40856 2.60307 -122.11092 998.20308
955.0000 -128.29166 -120.09837 8.19329 2.73825 -120.17965 1050.53405
960.0000 -126.40180 -118.93947 7.46233 2.75336 -119.96387 1021.11916
965.0000 -125.01555 -118.44596 6.56959 2.81506 -119.08233 1062.15827
970.0000 -125.70642 -119.35179 6.35463 2.84930 -118.59321 1100.71677
975.0000 -128.75969 -122.93286 5.82683 2.69236 -120.83526 937.09275
980.0000 -127.07380 -118.98459 8.08921 2.72295 -120.39826 1013.93343
985.0000 -127.02202 -119.93948 7.08255 2.81003 -119.15416 1098.09161
990.0000 -126.52640 -120.29564 6.23076 2.72432 -120.37869 999.08686
995.0000 -126.19789 -119.24613 6.95176 2.79586 -119.35669 1082.61494
1000.0000 -127.55903 -121.00440 6.55463 2.76178 -119.84357 1037.50434
FREEZING PROCESS: loop number 5 T-loop= 982.00000000000000
main_MD> interactions number 5 at Temperature= 982.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.29915 0.18048 1.66145
force_rgl> df(natom) -2.78905 4.02925 1.58007
1005.0000 -128.63822 -122.44575 6.19247 2.60874 -122.03001 931.15107
1010.0000 -128.41149 -122.64925 5.76225 2.62634 -121.77849 948.70226
1015.0000 -129.06159 -122.03230 7.02929 2.61647 -121.91946 956.51380
1020.0000 -127.24234 -121.25137 5.99098 2.60539 -122.07785 951.58746
1025.0000 -127.45309 -119.46621 7.98688 2.76843 -119.74856 1043.93312
1030.0000 -127.31484 -119.57904 7.73579 2.74923 -120.02285 1074.24274
1035.0000 -126.20931 -120.39152 5.81779 2.75816 -119.89528 1036.97410
1040.0000 -126.93659 -120.24789 6.68871 2.73996 -120.15529 993.64039
1045.0000 -127.80619 -122.23414 5.57206 2.68038 -121.00644 975.17542
1050.0000 -126.41780 -120.35314 6.06466 2.63951 -121.59037 957.98581
1055.0000 -129.42641 -122.37403 7.05238 2.70719 -120.62339 1014.67088
1060.0000 -127.78702 -121.84660 5.94042 2.60333 -122.10723 906.52407
1065.0000 -127.54620 -121.58165 5.96454 2.59241 -122.26328 958.50543
1070.0000 -127.86841 -120.91533 6.95309 2.59014 -122.29573 909.54721
1075.0000 -128.39539 -121.20981 7.18558 2.66247 -121.26229 962.97438
1080.0000 -126.57920 -119.43656 7.14264 2.77217 -119.69508 1026.56631
1085.0000 -126.08957 -119.55282 6.53675 2.80852 -119.17572 1053.79727
1090.0000 -128.96567 -122.98092 5.98475 2.65210 -121.41055 934.28832
1095.0000 -129.85114 -124.16432 5.68681 2.49911 -123.59622 879.50971
1100.0000 -128.08947 -121.37621 6.71326 2.55615 -122.78124 925.14629
1105.0000 -129.16857 -123.15875 6.00983 2.60728 -122.05076 940.12060
1110.0000 -129.31080 -124.00911 5.30169 2.50772 -123.47325 860.26215
1115.0000 -128.14049 -122.14165 5.99884 2.54766 -122.90264 908.39145
1120.0000 -127.59576 -121.62785 5.96791 2.62918 -121.73786 952.85317
1125.0000 -128.11101 -123.01093 5.10008 2.58660 -122.34622 934.46367
1130.0000 -129.20219 -120.78768 8.41451 2.60805 -122.03984 937.69508
1135.0000 -128.03462 -120.77541 7.25921 2.69891 -120.74167 1007.51555
1140.0000 -127.33117 -120.87649 6.45467 2.69076 -120.85812 1008.61621
1145.0000 -127.65641 -121.14714 6.50927 2.66711 -121.19597 1001.26696
1150.0000 -129.53964 -122.02316 7.51648 2.66823 -121.18006 988.44631
1155.0000 -129.01217 -120.99079 8.02139 2.59766 -122.18821 912.11305
1160.0000 -129.63380 -123.28111 6.35269 2.55237 -122.83523 912.58943
1165.0000 -129.98889 -123.44221 6.54668 2.57077 -122.57241 908.89242
1170.0000 -129.28875 -121.63619 7.65256 2.54574 -122.92996 889.88872
1175.0000 -127.80108 -120.16830 7.63277 2.70797 -120.61235 1019.42701
1180.0000 -126.88509 -119.02412 7.86098 2.79130 -119.42182 1129.38662
1185.0000 -127.11353 -120.08329 7.03024 2.76601 -119.78312 1046.09852
1190.0000 -128.26459 -120.17673 8.08785 2.84589 -118.64195 1134.26605
1195.0000 -127.24892 -119.87172 7.37720 2.75489 -119.94196 1042.38575
1200.0000 -128.03895 -121.29441 6.74454 2.70645 -120.63403 1020.09640
1205.0000 -127.53407 -119.63230 7.90177 2.65287 -121.39944 1017.00655
1210.0000 -126.03441 -118.93991 7.09450 2.79934 -119.30695 1094.36485
1215.0000 -127.50311 -120.92206 6.58106 2.79312 -119.39583 1053.62526
1220.0000 -127.03050 -120.68472 6.34578 2.67349 -121.10493 977.97421
1225.0000 -128.28666 -122.11658 6.17008 2.56921 -122.59467 893.39194
1230.0000 -128.22242 -119.30708 8.91534 2.69505 -120.79692 987.38160
1235.0000 -126.67262 -120.02415 6.64847 2.78127 -119.56505 1064.26440
1240.0000 -128.77403 -121.23799 7.53604 2.76645 -119.77686 1055.42773
1245.0000 -127.61041 -120.46547 7.14494 2.71825 -120.46542 1008.26939
1250.0000 -128.82427 -120.76016 8.06411 2.65953 -121.30436 997.34252
FREEZING PROCESS: loop number 6 T-loop= 957.00000000000000
main_MD> interactions number 6 at Temperature= 957.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.22747 0.75543 0.67050
force_rgl> df(natom) 0.74368 -0.26597 -3.04845
1255.0000 -127.75818 -120.23518 7.52299 2.73084 -120.28551 1033.36454
1260.0000 -127.63284 -120.70355 6.92930 2.72150 -120.41901 1039.04573
1265.0000 -128.31674 -121.46110 6.85564 2.71802 -120.46873 1049.36414
1270.0000 -128.71571 -121.61876 7.09695 2.64055 -121.57545 967.48807
1275.0000 -127.60950 -121.40380 6.20570 2.68251 -120.97603 1013.95153
1280.0000 -129.22076 -122.13475 7.08601 2.60641 -122.06326 941.07518
1285.0000 -130.12847 -122.42000 7.70847 2.59307 -122.25378 962.71475
1290.0000 -128.56315 -122.22934 6.33381 2.55624 -122.77995 924.82195
1295.0000 -128.88638 -123.59804 5.28834 2.48811 -123.75332 837.71929
1300.0000 -128.30074 -121.40909 6.89165 2.61176 -121.98676 923.89170
1305.0000 -127.26854 -120.22379 7.04475 2.66436 -121.23533 982.08284
1310.0000 -128.18996 -120.58418 7.60578 2.73657 -120.20373 1035.03576
1315.0000 -126.32360 -119.09254 7.23106 2.75699 -119.91202 1088.08299
1320.0000 -128.27886 -121.59475 6.68412 2.73623 -120.20853 1023.03743
1325.0000 -127.62478 -120.90838 6.71640 2.65498 -121.36937 944.24814
1330.0000 -128.10156 -120.40306 7.69849 2.69682 -120.77154 1003.75603
1335.0000 -126.94263 -119.86402 7.07861 2.74285 -120.11391 1027.61578
1340.0000 -129.10688 -121.66389 7.44299 2.66252 -121.26163 965.92761
1345.0000 -128.10976 -121.14239 6.96737 2.66347 -121.24798 985.61284
1350.0000 -129.18041 -122.55475 6.62566 2.56584 -122.64278 884.36975
1355.0000 -129.10035 -122.60371 6.49664 2.58785 -122.32842 909.13327
1360.0000 -129.25947 -123.62715 5.63232 2.48778 -123.75811 845.31762
1365.0000 -129.90928 -123.61541 6.29387 2.49336 -123.67830 874.62117
1370.0000 -129.61595 -123.60716 6.00879 2.53644 -123.06289 890.51097
1375.0000 -129.72670 -123.59426 6.13244 2.51385 -123.38563 885.17083
1380.0000 -128.59044 -122.25334 6.33710 2.53941 -123.02050 892.16893
1385.0000 -128.37995 -120.64934 7.73062 2.59099 -122.28356 919.44345
1390.0000 -129.40876 -122.68211 6.72664 2.68465 -120.94544 1013.09835
1395.0000 -128.03703 -120.89333 7.14370 2.59620 -122.20906 954.47347
1400.0000 -128.03727 -120.82054 7.21673 2.70630 -120.63608 996.56028
1405.0000 -128.45825 -122.98433 5.47392 2.65287 -121.39952 941.32364
1410.0000 -127.46663 -121.23781 6.22882 2.64253 -121.54723 952.43451
1415.0000 -127.28056 -120.93153 6.34902 2.72096 -120.42676 1002.05889
1420.0000 -128.88282 -122.60220 6.28062 2.60587 -122.07092 917.99493
1425.0000 -129.35326 -123.44223 5.91104 2.53249 -123.11926 852.03662
1430.0000 -129.19960 -122.72610 6.47350 2.53057 -123.14675 857.70110
1435.0000 -128.89196 -122.78954 6.10241 2.59848 -122.17659 934.60019
1440.0000 -129.01966 -121.62028 7.39938 2.62042 -121.86301 981.73586
1445.0000 -128.71824 -122.40448 6.31375 2.63665 -121.63118 970.01015
1450.0000 -129.32863 -123.96978 5.35885 2.54857 -122.88952 888.15187
1455.0000 -129.24992 -123.78616 5.46376 2.51427 -123.37962 829.35160
1460.0000 -129.91990 -124.60999 5.30991 2.45228 -124.26522 811.53726
1465.0000 -129.96686 -124.14807 5.81879 2.45986 -124.15690 830.21828
1470.0000 -129.31738 -123.03631 6.28106 2.45292 -124.25606 797.50587
1475.0000 -127.49705 -121.62901 5.86804 2.57256 -122.54687 907.73839
1480.0000 -127.75468 -120.75404 7.00064 2.64594 -121.49854 950.00508
1485.0000 -128.47485 -121.71794 6.75691 2.62857 -121.74672 943.32012
1490.0000 -126.80671 -119.53290 7.27380 2.76229 -119.83625 1071.30901
1495.0000 -127.25978 -121.15811 6.10167 2.70877 -120.60091 1041.31403
1500.0000 -129.13707 -122.71343 6.42364 2.66035 -121.29258 934.88182
FREEZING PROCESS: loop number 7 T-loop= 932.00000000000000
main_MD> interactions number 7 at Temperature= 932.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.95094 -2.62995 1.65168
force_rgl> df(natom) -1.01475 0.58535 -1.92628
1505.0000 -129.22003 -123.09833 6.12170 2.56682 -122.62886 894.25004
1510.0000 -128.83428 -122.46128 6.37300 2.56184 -122.70001 887.73960
1515.0000 -127.82887 -121.60908 6.21979 2.61500 -121.94047 909.35705
1520.0000 -129.48855 -123.11389 6.37467 2.57516 -122.50965 927.64455
1525.0000 -130.38328 -123.28314 7.10015 2.52387 -123.24244 892.66027
1530.0000 -129.61742 -123.18681 6.43061 2.50817 -123.46673 880.58716
1535.0000 -127.56496 -121.83532 5.72964 2.57209 -122.55351 920.38119
1540.0000 -130.60079 -124.11210 6.48870 2.46502 -124.08325 828.67726
1545.0000 -129.30345 -123.67720 5.62625 2.48255 -123.83279 807.81501
1550.0000 -127.22465 -121.32737 5.89728 2.56926 -122.59397 926.64820
1555.0000 -128.29569 -120.90216 7.39353 2.66746 -121.19108 998.04071
1560.0000 -130.49876 -123.03158 7.46718 2.65333 -121.39294 1000.09352
1565.0000 -130.55160 -123.99036 6.56124 2.52252 -123.26176 892.29374
1570.0000 -129.95812 -124.02382 5.93430 2.46292 -124.11320 832.04281
1575.0000 -128.66771 -122.93655 5.73116 2.48165 -123.84562 869.95456
1580.0000 -129.18482 -121.95972 7.22510 2.59311 -122.25323 926.26967
1585.0000 -127.41885 -120.74714 6.67172 2.61758 -121.90364 954.37787
1590.0000 -128.62384 -121.21462 7.40923 2.66812 -121.18166 957.26311
1595.0000 -127.09775 -120.58588 6.51187 2.69378 -120.81497 992.40231
1600.0000 -127.20950 -118.78695 8.42255 2.81160 -119.13182 1057.65219
1605.0000 -126.14779 -119.21368 6.93411 2.79852 -119.31869 1057.86896
1610.0000 -127.30604 -118.48819 8.81785 2.84822 -118.60856 1130.24792
1615.0000 -128.00315 -120.10753 7.89562 2.75408 -119.95347 1081.80764
1620.0000 -128.30910 -121.03462 7.27448 2.63592 -121.64160 957.65751
1625.0000 -128.09116 -123.01418 5.07698 2.58177 -122.41531 928.47767
1630.0000 -128.16182 -121.83236 6.32946 2.56439 -122.66351 923.91713
1635.0000 -128.17624 -122.53490 5.64134 2.56592 -122.64166 911.09234
1640.0000 -130.04788 -123.83006 6.21782 2.52153 -123.27585 859.78610
1645.0000 -129.17870 -123.84491 5.33380 2.45374 -124.24439 843.07853
1650.0000 -128.64325 -122.49540 6.14785 2.56875 -122.60125 931.65241
1655.0000 -128.43293 -122.17994 6.25300 2.55897 -122.74105 916.29286
1660.0000 -129.33332 -122.17671 7.15661 2.63577 -121.64372 982.23910
1665.0000 -129.75073 -122.94768 6.80304 2.55130 -122.85064 894.59451
1670.0000 -127.99849 -121.26846 6.73003 2.59740 -122.19200 917.55996
1675.0000 -128.74388 -122.13068 6.61321 2.60394 -122.09857 906.51087
1680.0000 -128.56736 -121.08597 7.48140 2.64556 -121.50390 936.24095
1685.0000 -127.37655 -119.35038 8.02617 2.75500 -119.94039 1034.36597
1690.0000 -127.63823 -120.24198 7.39625 2.80867 -119.17368 1061.70557
1695.0000 -128.70890 -120.91869 7.79021 2.75672 -119.91578 1066.50284
1700.0000 -128.06796 -120.93217 7.13579 2.63396 -121.66964 970.26919
1705.0000 -127.82387 -121.64573 6.17813 2.64550 -121.50482 938.35482
1710.0000 -128.06264 -120.87293 7.18971 2.60065 -122.14551 959.07926
1715.0000 -127.13831 -121.80779 5.33052 2.66570 -121.21613 959.16183
1720.0000 -128.02086 -120.51065 7.51021 2.69871 -120.74452 979.21663
1725.0000 -129.05237 -123.69691 5.35546 2.57845 -122.46271 911.81372
1730.0000 -127.26710 -121.51807 5.74903 2.53640 -123.06338 860.30880
1735.0000 -126.59794 -120.15192 6.44602 2.71007 -120.58235 1011.39034
1740.0000 -128.28337 -121.94530 6.33807 2.64578 -121.50082 981.97951
1745.0000 -128.10052 -121.07564 7.02488 2.57761 -122.47464 926.66247
1750.0000 -129.56671 -122.47208 7.09462 2.61423 -121.95150 955.07339
FREEZING PROCESS: loop number 8 T-loop= 907.00000000000000
main_MD> interactions number 8 at Temperature= 907.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 3.02176 -0.66418 1.17683
force_rgl> df(natom) -0.78935 -0.88578 -1.72342
1755.0000 -127.73476 -121.39961 6.33515 2.58964 -122.30282 908.86680
1760.0000 -128.98243 -121.39691 7.58552 2.69649 -120.77627 992.46783
1765.0000 -129.19209 -123.13405 6.05803 2.58065 -122.43125 900.82016
1770.0000 -128.55943 -122.67208 5.88734 2.56417 -122.66666 900.77484
1775.0000 -129.81492 -123.72204 6.09289 2.49995 -123.58424 875.17487
1780.0000 -129.39081 -123.02069 6.37012 2.46895 -124.02701 837.50794
1785.0000 -128.81222 -122.53120 6.28102 2.60987 -122.01376 931.22836
1790.0000 -129.18066 -121.84364 7.33702 2.59928 -122.16503 925.84372
1795.0000 -129.73852 -124.08099 5.65753 2.51326 -123.39410 873.13084
1800.0000 -128.01147 -122.76738 5.24408 2.52029 -123.29356 885.67937
1805.0000 -129.95938 -123.59917 6.36021 2.44191 -124.41332 807.13645
1810.0000 -130.45367 -123.00647 7.44720 2.49078 -123.71519 852.17159
1815.0000 -129.09559 -122.96817 6.12742 2.54781 -122.90038 901.77590
1820.0000 -130.69653 -124.59136 6.10518 2.52138 -123.27803 884.20614
1825.0000 -127.80939 -120.94678 6.86261 2.52998 -123.15518 885.78140
1830.0000 -129.55547 -122.61825 6.93722 2.67920 -121.02326 990.79788
1835.0000 -128.89496 -122.83672 6.05824 2.54388 -122.95652 863.44200
1840.0000 -129.60664 -123.36212 6.24452 2.56091 -122.71333 875.68836
1845.0000 -129.17504 -122.60103 6.57400 2.51700 -123.34055 874.87481
1850.0000 -128.50170 -122.90432 5.59738 2.54284 -122.97149 875.51246
1855.0000 -129.11052 -123.91087 5.19966 2.50409 -123.52502 877.50232
1860.0000 -127.98247 -121.64529 6.33718 2.59158 -122.27509 924.22882
1865.0000 -131.23934 -124.76599 6.47334 2.51063 -123.43161 865.21342
1870.0000 -131.46957 -124.55885 6.91072 2.42530 -124.65068 840.10609
1875.0000 -129.05303 -124.46479 4.58824 2.49262 -123.68891 877.15813
1880.0000 -128.39555 -122.56806 5.82749 2.49179 -123.70072 858.64179
1885.0000 -128.29310 -121.79513 6.49797 2.61193 -121.98434 915.52604
1890.0000 -129.91432 -124.20542 5.70890 2.57650 -122.49061 882.48714
1895.0000 -129.51360 -123.06778 6.44583 2.49902 -123.59741 879.11127
1900.0000 -128.67399 -122.47010 6.20389 2.56019 -122.72359 899.21480
1905.0000 -128.96813 -121.88833 7.07980 2.59813 -122.18147 901.29537
1910.0000 -128.15623 -121.78361 6.37262 2.60070 -122.14479 938.06358
1915.0000 -128.89686 -123.42556 5.47130 2.55801 -122.75467 898.41456
1920.0000 -129.39637 -124.19177 5.20460 2.40730 -124.90788 776.28096
1925.0000 -129.67177 -123.56734 6.10443 2.49971 -123.58760 876.55784
1930.0000 -130.68175 -124.73848 5.94327 2.42494 -124.65581 812.60162
1935.0000 -130.18937 -123.40065 6.78871 2.44596 -124.35559 815.29452
1940.0000 -129.33635 -124.14835 5.18800 2.43722 -124.48038 828.34882
1945.0000 -129.21098 -123.66047 5.55051 2.45644 -124.20577 804.70889
1950.0000 -130.13758 -123.34701 6.79057 2.49142 -123.70610 857.70078
1955.0000 -128.91876 -122.68654 6.23222 2.57799 -122.46923 916.50461
1960.0000 -129.00912 -123.61310 5.39602 2.52409 -123.23926 845.20502
1965.0000 -129.48834 -123.40298 6.08536 2.56654 -122.63291 912.97774
1970.0000 -129.62406 -124.11722 5.50684 2.50020 -123.58064 824.28081
1975.0000 -130.82453 -125.22911 5.59542 2.42294 -124.68442 812.56784
1980.0000 -129.57511 -123.55555 6.01956 2.50887 -123.45669 865.91728
1985.0000 -129.15351 -122.86727 6.28623 2.48670 -123.77352 848.07341
1990.0000 -129.57718 -122.94662 6.63057 2.56722 -122.62315 905.61123
1995.0000 -129.29728 -123.99850 5.29879 2.48685 -123.77136 853.93666
2000.0000 -130.36521 -124.35758 6.00763 2.44491 -124.37046 815.26993
FREEZING PROCESS: loop number 9 T-loop= 882.00000000000000
main_MD> interactions number 9 at Temperature= 882.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 3.55872 -6.62779 0.67219
force_rgl> df(natom) 0.59204 -2.46845 0.03485
2005.0000 -131.17697 -125.01978 6.15718 2.47519 -123.93793 857.71570
2010.0000 -130.58690 -125.47689 5.11001 2.40886 -124.88556 770.44088
2015.0000 -130.10294 -124.59989 5.50304 2.36480 -125.51507 765.66947
2020.0000 -131.20199 -125.23439 5.96760 2.41547 -124.79109 810.25253
2025.0000 -129.55068 -124.04858 5.50210 2.37521 -125.36636 765.03483
2030.0000 -129.24391 -124.24798 4.99593 2.50477 -123.51528 847.85503
2035.0000 -130.08533 -124.02785 6.05747 2.47614 -123.92429 839.95127
2040.0000 -130.99658 -125.20149 5.79508 2.41232 -124.83617 807.30993
2045.0000 -130.16252 -123.01097 7.15155 2.48471 -123.80185 871.68316
2050.0000 -127.56590 -121.91234 5.65356 2.57801 -122.46891 944.89325
2055.0000 -129.51916 -123.12151 6.39765 2.59462 -122.23164 946.56084
2060.0000 -129.46648 -122.99222 6.47426 2.54967 -122.87388 916.56464
2065.0000 -127.82387 -121.28361 6.54026 2.60699 -122.05501 913.45562
2070.0000 -130.33061 -125.03219 5.29842 2.54265 -122.97409 892.96684
2075.0000 -130.10118 -122.87058 7.23060 2.46342 -124.10611 841.35196
2080.0000 -129.06577 -122.79546 6.27031 2.51248 -123.40515 877.09262
2085.0000 -130.25317 -124.63661 5.61656 2.49027 -123.72249 858.92200
2090.0000 -128.82947 -122.10086 6.72862 2.47600 -123.92641 824.55815
2095.0000 -128.40646 -122.12222 6.28425 2.55800 -122.75484 891.98668
2100.0000 -127.84461 -121.53888 6.30573 2.63044 -121.71991 985.51495
2105.0000 -129.76060 -123.40129 6.35931 2.60692 -122.05595 930.81346
2110.0000 -129.72253 -124.05327 5.66925 2.44737 -124.33544 795.96244
2115.0000 -129.82139 -123.15314 6.66825 2.49355 -123.67560 850.69913
2120.0000 -129.56491 -123.84031 5.72461 2.55725 -122.76559 922.72489
2125.0000 -128.52685 -121.82763 6.69922 2.55068 -122.85936 864.67236
2130.0000 -128.25425 -122.22885 6.02540 2.56991 -122.58474 922.24740
2135.0000 -129.19907 -122.11968 7.07939 2.60780 -122.04331 937.86341
2140.0000 -127.73309 -121.55922 6.17388 2.63203 -121.69720 965.59906
2145.0000 -129.18651 -123.63562 5.55090 2.57440 -122.52054 875.27637
2150.0000 -128.68187 -122.50731 6.17456 2.54946 -122.87683 876.98638
2155.0000 -130.56466 -123.58972 6.97494 2.53027 -123.15108 885.97591
2160.0000 -128.04335 -122.63388 5.40947 2.50174 -123.55855 893.78687
2165.0000 -128.74041 -122.87500 5.86542 2.56141 -122.70607 860.97026
2170.0000 -129.17237 -122.94877 6.22360 2.48419 -123.80936 829.45223
2175.0000 -130.17337 -123.76825 6.40513 2.52914 -123.16721 899.75259
2180.0000 -130.19730 -124.34337 5.85394 2.44319 -124.39509 831.73355
2185.0000 -129.54833 -123.33682 6.21150 2.47817 -123.89533 846.02488
2190.0000 -128.96440 -121.79631 7.16809 2.52714 -123.19580 901.99693
2195.0000 -130.45171 -124.93500 5.51671 2.51639 -123.34929 860.73323
2200.0000 -130.05363 -123.40416 6.64947 2.46462 -124.08891 837.36791
2205.0000 -129.75489 -123.93412 5.82077 2.50281 -123.54328 864.66400
2210.0000 -129.04322 -122.63243 6.41079 2.53526 -123.07967 883.16450
2215.0000 -128.19930 -122.93868 5.26062 2.56245 -122.69132 907.25955
2220.0000 -129.37802 -122.64809 6.72993 2.53689 -123.05642 890.00013
2225.0000 -130.09603 -123.88696 6.20907 2.49326 -123.67984 866.94497
2230.0000 -128.85494 -122.84325 6.01169 2.50578 -123.50091 854.10152
2235.0000 -128.40557 -120.54282 7.86275 2.64459 -121.51780 957.37565
2240.0000 -129.30056 -122.14292 7.15764 2.63848 -121.60506 971.00914
2245.0000 -127.79688 -119.94206 7.85483 2.64221 -121.55183 968.97701
2250.0000 -127.87001 -121.89855 5.97146 2.69131 -120.85032 964.86565
FREEZING PROCESS: loop number 10 T-loop= 857.00000000000000
main_MD> interactions number 10 at Temperature= 857.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.14972 1.40501 0.00895
force_rgl> df(natom) -6.27346 3.91987 1.47931
2255.0000 -128.56041 -122.15245 6.40796 2.55216 -122.83830 888.61683
2260.0000 -129.04339 -123.66395 5.37943 2.53594 -123.07002 899.27406
2265.0000 -129.85813 -124.57370 5.28442 2.46304 -124.11149 828.90665
2270.0000 -129.84678 -123.94159 5.90519 2.43939 -124.44940 821.97844
2275.0000 -130.55329 -125.20764 5.34565 2.36471 -125.51630 758.60600
2280.0000 -130.81557 -126.56353 4.25203 2.40069 -125.00225 794.00722
2285.0000 -131.57022 -126.41695 5.15327 2.27233 -126.83611 710.14776
2290.0000 -130.46324 -124.85696 5.60628 2.28879 -126.60096 723.26751
2295.0000 -129.14058 -123.15781 5.98277 2.44726 -124.33691 838.76192
2300.0000 -130.38521 -123.75230 6.63291 2.46520 -124.08059 844.08033
2305.0000 -128.65610 -123.96966 4.68645 2.49382 -123.67176 839.41086
2310.0000 -130.69983 -125.86207 4.83777 2.39310 -125.11073 766.98450
2315.0000 -129.09942 -124.18945 4.90997 2.44472 -124.37319 787.17627
2320.0000 -129.85399 -124.21643 5.63756 2.42490 -124.65636 821.66804
2325.0000 -130.59743 -123.77358 6.82385 2.47997 -123.86970 852.92206
2330.0000 -129.77636 -123.70929 6.06707 2.50830 -123.46484 846.24770
2335.0000 -128.76418 -122.60378 6.16040 2.53233 -123.12159 904.53630
2340.0000 -130.58169 -124.03699 6.54471 2.51232 -123.40748 857.82803
2345.0000 -129.99869 -124.12320 5.87549 2.47594 -123.92724 890.02720
2350.0000 -129.53650 -123.84517 5.69132 2.45815 -124.18137 838.66131
2355.0000 -128.75082 -123.46653 5.28429 2.49183 -123.70017 844.54543
2360.0000 -130.60983 -123.89572 6.71412 2.48485 -123.79998 857.52193
2365.0000 -130.58985 -125.17976 5.41010 2.43450 -124.51929 791.17433
2370.0000 -129.94860 -123.11099 6.83761 2.47704 -123.91144 845.87073
2375.0000 -129.46966 -122.45043 7.01923 2.59719 -122.19495 936.74685
2380.0000 -129.28321 -123.25532 6.02789 2.55459 -122.80357 898.88362
2385.0000 -130.18614 -125.48031 4.70583 2.50033 -123.57876 828.14014
2390.0000 -129.77075 -123.98085 5.78990 2.49068 -123.71657 839.50317
2395.0000 -129.89742 -123.31413 6.58329 2.42053 -124.71890 830.24601
2400.0000 -129.10236 -122.77092 6.33144 2.50843 -123.46311 845.04489
2405.0000 -129.15547 -123.83942 5.31605 2.52406 -123.23969 877.47402
2410.0000 -130.99987 -125.42192 5.57795 2.41889 -124.74230 781.48973
2415.0000 -128.97819 -123.26873 5.70945 2.42627 -124.63690 784.58280
2420.0000 -129.75116 -123.06182 6.68934 2.54877 -122.88668 888.88976
2425.0000 -130.02905 -124.88143 5.14763 2.49886 -123.59983 857.02341
2430.0000 -129.54425 -123.60292 5.94133 2.48666 -123.77399 833.43118
2435.0000 -129.42766 -122.99595 6.43171 2.47035 -124.00706 856.18118
2440.0000 -130.02001 -123.77297 6.24704 2.53465 -123.08840 827.80235
2445.0000 -129.41103 -123.56324 5.84780 2.49039 -123.72082 850.56291
2450.0000 -130.80346 -125.08613 5.71733 2.44477 -124.37250 826.29928
2455.0000 -128.55195 -121.66334 6.88861 2.49225 -123.69418 854.47807
2460.0000 -129.43404 -122.93359 6.50045 2.56763 -122.61729 896.74632
2465.0000 -129.28525 -121.28187 8.00338 2.62942 -121.73445 957.71852
2470.0000 -129.35947 -122.96515 6.39432 2.57528 -122.50797 949.06355
2475.0000 -129.62940 -123.83089 5.79851 2.50431 -123.52197 869.10885
2480.0000 -130.41937 -124.42918 5.99020 2.48563 -123.78878 846.60014
2485.0000 -130.31880 -124.44648 5.87233 2.47520 -123.93782 817.97043
2490.0000 -128.26977 -122.58498 5.68478 2.49325 -123.67987 843.43916
2495.0000 -128.49307 -122.11025 6.38282 2.56502 -122.65463 884.53728
2500.0000 -128.75315 -121.54585 7.20730 2.64479 -121.51490 953.62521
FREEZING PROCESS: loop number 11 T-loop= 832.00000000000000
main_MD> interactions number 11 at Temperature= 832.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.23822 -1.20874 0.89143
force_rgl> df(natom) -1.46226 1.51822 -2.40115
2505.0000 -129.07010 -123.64359 5.42651 2.52756 -123.18974 850.77898
2510.0000 -129.78244 -124.02798 5.75446 2.45498 -124.22668 810.62414
2515.0000 -129.98295 -123.33483 6.64811 2.49391 -123.67051 843.62427
2520.0000 -130.93975 -125.29545 5.64430 2.44583 -124.35737 838.80869
2525.0000 -130.60545 -124.69205 5.91339 2.39112 -125.13899 798.26410
2530.0000 -129.95659 -124.53502 5.42157 2.43335 -124.53564 817.28828
2535.0000 -129.46122 -124.10387 5.35735 2.45619 -124.20939 821.32297
2540.0000 -130.16921 -124.38927 5.77993 2.47503 -123.94019 853.18259
2545.0000 -129.31819 -124.52762 4.79057 2.47659 -123.91799 821.59664
2550.0000 -129.63836 -124.13827 5.50009 2.42830 -124.60777 817.69488
2555.0000 -130.78236 -124.81628 5.96608 2.41534 -124.79297 787.80634
2560.0000 -130.85765 -125.17562 5.68202 2.43611 -124.49618 826.23067
2565.0000 -130.69076 -124.94085 5.74991 2.37252 -125.40467 772.81736
2570.0000 -129.64753 -124.09147 5.55607 2.45624 -124.20865 838.00136
2575.0000 -131.20439 -126.22143 4.98296 2.39555 -125.07567 783.08975
2580.0000 -131.45556 -126.50458 4.95097 2.30287 -126.39982 724.93927
2585.0000 -130.25473 -123.71436 6.54037 2.43031 -124.57913 814.46448
2590.0000 -129.98088 -124.73910 5.24178 2.40749 -124.90518 803.70772
2595.0000 -130.26448 -124.26864 5.99585 2.40963 -124.87457 815.75535
2600.0000 -129.37506 -123.90663 5.46843 2.44689 -124.34229 836.20552
2605.0000 -130.06600 -123.84790 6.21809 2.48449 -123.80505 857.73767
2610.0000 -129.45925 -123.77397 5.68528 2.46341 -124.10616 827.34092
2615.0000 -130.50598 -124.20193 6.30404 2.47836 -123.89263 819.28397
2620.0000 -130.45622 -125.31980 5.13642 2.42686 -124.62836 813.41172
2625.0000 -129.81686 -124.42351 5.39335 2.42644 -124.63444 776.54739
2630.0000 -131.68506 -126.04345 5.64161 2.37251 -125.40489 753.93839
2635.0000 -130.92489 -124.45083 6.47406 2.36831 -125.46492 743.81949
2640.0000 -130.00822 -124.20465 5.80357 2.44487 -124.37107 801.58670
2645.0000 -130.77009 -125.03631 5.73377 2.42662 -124.63182 816.81709
2650.0000 -129.93122 -123.80858 6.12263 2.46587 -124.07109 819.56887
2655.0000 -130.36924 -124.67195 5.69729 2.45286 -124.25692 832.32887
2660.0000 -129.39171 -123.72411 5.66760 2.50724 -123.48004 852.08763
2665.0000 -129.18187 -124.38230 4.79957 2.51696 -123.34122 858.47006
2670.0000 -130.80771 -125.43553 5.37217 2.40567 -124.93114 780.55769
2675.0000 -130.30194 -125.21596 5.08598 2.35168 -125.70249 755.07231
2680.0000 -129.81312 -124.85513 4.95799 2.37500 -125.36924 765.01815
2685.0000 -130.02447 -124.86815 5.15632 2.38805 -125.18289 790.71773
2690.0000 -131.08944 -124.75491 6.33453 2.42550 -124.64778 800.97687
2695.0000 -130.41570 -125.26168 5.15403 2.39639 -125.06370 800.07082
2700.0000 -129.54909 -123.44399 6.10510 2.43709 -124.48231 821.59499
2705.0000 -130.22674 -124.17899 6.04775 2.51161 -123.41760 857.86332
2710.0000 -129.45966 -123.38731 6.07234 2.52638 -123.20656 865.74735
2715.0000 -128.58263 -122.23799 6.34464 2.50205 -123.55412 874.32337
2720.0000 -128.26544 -122.48118 5.78426 2.58482 -122.37174 904.39535
2725.0000 -130.00296 -122.82885 7.17411 2.53758 -123.04662 860.80758
2730.0000 -129.52171 -123.22295 6.29877 2.55900 -122.74060 897.16606
2735.0000 -130.33740 -124.54657 5.79082 2.49298 -123.68373 869.56653
2740.0000 -129.92046 -124.32676 5.59370 2.42114 -124.71014 782.57427
2745.0000 -129.09297 -123.33247 5.76050 2.46066 -124.14555 841.39749
2750.0000 -130.38118 -125.08471 5.29648 2.48280 -123.82918 837.99066
FREEZING PROCESS: loop number 12 T-loop= 807.00000000000000
main_MD> interactions number 12 at Temperature= 807.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 3.26426 -2.08985 3.00079
force_rgl> df(natom) 0.36345 1.15841 -0.38637
2755.0000 -129.66532 -124.35683 5.30848 2.44292 -124.39898 790.66519
2760.0000 -128.77594 -122.92217 5.85377 2.49634 -123.63579 863.88551
2765.0000 -127.68224 -122.16639 5.51586 2.55783 -122.75723 890.81341
2770.0000 -130.24959 -123.95612 6.29347 2.54447 -122.94819 878.85856
2775.0000 -129.75702 -122.89296 6.86406 2.49593 -123.64166 866.36470
2780.0000 -129.56816 -123.48016 6.08800 2.50453 -123.51880 855.91787
2785.0000 -131.46042 -125.23577 6.22465 2.44548 -124.36244 793.91835
2790.0000 -129.91479 -124.82271 5.09207 2.41423 -124.80878 763.37832
2795.0000 -130.89315 -124.39494 6.49822 2.39505 -125.08286 779.41152
2800.0000 -129.23593 -124.07989 5.15604 2.49072 -123.71600 881.60976
2805.0000 -130.92298 -124.46935 6.45363 2.46435 -124.09282 826.81166
2810.0000 -130.30488 -123.81702 6.48787 2.44350 -124.39071 798.54500
2815.0000 -131.19222 -124.67853 6.51369 2.46112 -124.13897 837.34266
2820.0000 -131.46313 -125.48844 5.97469 2.37350 -125.39070 785.54368
2825.0000 -131.86495 -126.74118 5.12378 2.33533 -125.93611 771.99046
2830.0000 -129.77555 -124.88657 4.88898 2.35739 -125.62091 739.30556
2835.0000 -130.31859 -124.37291 5.94568 2.43627 -124.49401 794.89899
2840.0000 -130.76763 -123.93841 6.82922 2.48374 -123.81580 850.04802
2845.0000 -130.37558 -122.92228 7.45331 2.48108 -123.85377 830.97900
2850.0000 -129.26483 -123.46439 5.80044 2.54137 -122.99248 873.96108
2855.0000 -129.78541 -124.64441 5.14100 2.51446 -123.37692 849.02472
2860.0000 -130.18258 -124.20564 5.97694 2.44735 -124.33567 802.69411
2865.0000 -130.41903 -124.38993 6.02910 2.45984 -124.15725 837.78594
2870.0000 -130.00454 -125.24356 4.76098 2.43068 -124.57386 805.48833
2875.0000 -131.07633 -125.71442 5.36190 2.32780 -126.04369 726.49880
2880.0000 -130.85589 -125.40474 5.45116 2.37472 -125.37337 781.25960
2885.0000 -130.54580 -125.78943 4.75638 2.47303 -123.96879 867.94437
2890.0000 -131.35254 -127.21975 4.13279 2.31667 -126.20269 751.34571
2895.0000 -129.47285 -125.30177 4.17108 2.36037 -125.57827 745.69504
2900.0000 -129.96021 -125.02602 4.93419 2.41953 -124.73312 803.93944
2905.0000 -130.77605 -124.28720 6.48885 2.44296 -124.39842 836.26883
2910.0000 -129.77706 -124.88257 4.89450 2.47649 -123.91938 857.50137
2915.0000 -130.61741 -125.53857 5.07885 2.39694 -125.05585 767.20685
2920.0000 -129.92455 -124.86346 5.06108 2.35917 -125.59545 710.69839
2925.0000 -130.54626 -125.26850 5.27776 2.37687 -125.34263 765.41462
2930.0000 -130.93557 -125.29595 5.63962 2.36793 -125.47027 763.22403
2935.0000 -129.54950 -123.31880 6.23070 2.45420 -124.23782 850.66802
2940.0000 -129.99955 -124.01805 5.98151 2.50282 -123.54316 841.34119
2945.0000 -130.91629 -125.20851 5.70778 2.40654 -124.91871 813.88327
2950.0000 -130.28644 -123.30512 6.98132 2.44682 -124.34325 800.38268
2955.0000 -130.00116 -124.00986 5.99130 2.55093 -122.85586 913.17865
2960.0000 -129.99471 -124.65708 5.33763 2.44652 -124.34756 813.04856
2965.0000 -131.14502 -124.69004 6.45498 2.43093 -124.57028 775.07507
2970.0000 -131.28681 -126.36990 4.91692 2.37865 -125.31716 764.88322
2975.0000 -129.95480 -124.56117 5.39363 2.38678 -125.20102 759.60412
2980.0000 -130.36250 -124.36722 5.99528 2.45359 -124.24658 840.01378
2985.0000 -131.11754 -124.57820 6.53934 2.44055 -124.43288 831.53623
2990.0000 -129.25231 -124.25783 4.99447 2.46534 -124.07865 820.40841
2995.0000 -128.81120 -123.26596 5.54524 2.54079 -123.00075 829.21515
3000.0000 -130.90527 -124.86040 6.04487 2.50712 -123.48178 880.19753
FREEZING PROCESS: loop number 13 T-loop= 782.00000000000000
main_MD> interactions number 13 at Temperature= 782.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -4.50243 1.94156 2.27652
force_rgl> df(natom) -1.35692 -1.14099 -1.42012
3005.0000 -131.18003 -126.55652 4.62351 2.36429 -125.52226 749.88112
3010.0000 -131.35780 -125.53385 5.82394 2.31768 -126.18818 718.55881
3015.0000 -129.95887 -124.51043 5.44844 2.40167 -124.98824 784.92052
3020.0000 -129.79797 -124.14284 5.65513 2.43518 -124.50955 768.58010
3025.0000 -130.89525 -124.71095 6.18430 2.44636 -124.34986 823.00938
3030.0000 -129.81824 -124.02455 5.79370 2.43639 -124.49220 823.98591
3035.0000 -131.09378 -125.62207 5.47170 2.39772 -125.04470 779.60622
3040.0000 -131.63457 -125.71197 5.92261 2.33584 -125.92882 747.73428
3045.0000 -130.82841 -125.72040 5.10801 2.33465 -125.94579 743.43278
3050.0000 -130.42223 -126.06978 4.35245 2.33268 -125.97387 715.08246
3055.0000 -129.54007 -124.68395 4.85611 2.37457 -125.37538 779.20209
3060.0000 -130.08311 -124.83167 5.25145 2.41415 -124.80997 781.11192
3065.0000 -130.38689 -125.11897 5.26792 2.43912 -124.45326 812.62976
3070.0000 -129.42128 -123.83618 5.58510 2.41169 -124.84508 780.63191
3075.0000 -130.29366 -124.20788 6.08578 2.44644 -124.34870 833.00706
3080.0000 -130.24292 -123.98035 6.26257 2.43291 -124.54198 801.75306
3085.0000 -130.47529 -125.19702 5.27826 2.44557 -124.36105 815.99322
3090.0000 -129.88570 -125.03321 4.85250 2.38362 -125.24614 766.07589
3095.0000 -130.42290 -124.29723 6.12567 2.44056 -124.43263 779.80535
3100.0000 -131.43106 -125.61855 5.81251 2.38327 -125.25122 786.76561
3105.0000 -131.33073 -126.17504 5.15570 2.37527 -125.36547 743.65696
3110.0000 -130.74726 -124.89421 5.85305 2.34398 -125.81244 731.08803
3115.0000 -130.22695 -125.19343 5.03352 2.41273 -124.83029 787.86758
3120.0000 -130.72437 -124.77907 5.94530 2.42709 -124.62511 788.35530
3125.0000 -130.99116 -125.80728 5.18388 2.35628 -125.63677 735.62100
3130.0000 -130.82802 -125.95133 4.87668 2.39299 -125.11227 776.67558
3135.0000 -130.75825 -124.62903 6.12922 2.40610 -124.92496 791.68509
3140.0000 -130.40809 -125.39261 5.01548 2.36397 -125.52685 765.80541
3145.0000 -132.16813 -127.75320 4.41493 2.30333 -126.39322 721.81095
3150.0000 -131.36160 -126.54249 4.81912 2.27346 -126.81998 698.29457
3155.0000 -130.33939 -124.88168 5.45771 2.34580 -125.78648 739.59849
3160.0000 -131.60234 -126.81439 4.78794 2.38851 -125.17633 742.33498
3165.0000 -131.26556 -124.94716 6.31840 2.34374 -125.81583 770.32321
3170.0000 -129.59834 -124.24420 5.35414 2.41892 -124.74184 805.16179
3175.0000 -130.37012 -124.05707 6.31305 2.50925 -123.45126 858.69888
3180.0000 -129.47408 -122.94079 6.53329 2.48701 -123.76906 820.08491
3185.0000 -129.70373 -123.17074 6.53299 2.53672 -123.05881 887.01924
3190.0000 -130.37467 -125.20541 5.16925 2.43060 -124.57496 824.98163
3195.0000 -131.22149 -126.51915 4.70234 2.39311 -125.11053 762.38451
3200.0000 -130.54838 -126.61692 3.93147 2.29670 -126.48799 701.77524
3205.0000 -131.15745 -125.33657 5.82088 2.35550 -125.64796 779.38037
3210.0000 -130.85384 -125.32483 5.52901 2.42752 -124.61897 798.92211
3215.0000 -131.42549 -126.50617 4.91932 2.33439 -125.94951 730.98436
3220.0000 -130.50020 -125.41153 5.08867 2.31819 -126.18086 718.53445
3225.0000 -131.40126 -126.37841 5.02285 2.36366 -125.53136 768.52177
3230.0000 -130.43512 -125.13153 5.30359 2.35569 -125.64522 723.70553
3235.0000 -129.43840 -125.08981 4.34859 2.42860 -124.60360 809.39622
3240.0000 -130.59840 -125.03140 5.56700 2.36162 -125.56045 724.26415
3245.0000 -129.75137 -123.70479 6.04658 2.45050 -124.29062 851.07328
3250.0000 -129.32569 -124.37780 4.94789 2.42961 -124.58916 843.58304
FREEZING PROCESS: loop number 14 T-loop= 757.00000000000000
main_MD> interactions number 14 at Temperature= 757.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 4.04938 1.10851 -0.14637
force_rgl> df(natom) -5.85926 2.73895 0.51900
3255.0000 -130.39242 -124.37064 6.02178 2.49750 -123.61915 895.72430
3260.0000 -130.39192 -124.88223 5.50970 2.41906 -124.73985 804.50057
3265.0000 -131.39241 -125.51382 5.87859 2.40284 -124.97160 834.23030
3270.0000 -131.82162 -125.92280 5.89882 2.34466 -125.80277 779.83935
3275.0000 -131.59732 -126.89428 4.70305 2.30031 -126.43631 738.37819
3280.0000 -132.15398 -126.45577 5.69820 2.27002 -126.86915 702.41664
3285.0000 -131.46117 -126.25995 5.20122 2.33743 -125.90603 749.71475
3290.0000 -130.16001 -125.21424 4.94577 2.36429 -125.52231 729.73043
3295.0000 -130.80963 -124.66049 6.14914 2.40098 -124.99807 792.48234
3300.0000 -130.72720 -125.67374 5.05347 2.39734 -125.05014 769.89987
3305.0000 -131.75126 -126.70215 5.04911 2.27671 -126.77355 704.20736
3310.0000 -131.44180 -126.26455 5.17725 2.29726 -126.47989 716.19385
3315.0000 -130.77623 -125.32100 5.45523 2.34696 -125.76987 771.10107
3320.0000 -131.38730 -127.37259 4.01471 2.34092 -125.85622 730.49925
3325.0000 -132.25894 -127.50276 4.75617 2.24781 -127.18643 697.88532
3330.0000 -131.13981 -125.65554 5.48426 2.27355 -126.81866 702.52653
3335.0000 -131.45268 -125.58478 5.86790 2.32127 -126.13694 740.65704
3340.0000 -130.62758 -125.58052 5.04706 2.34656 -125.77563 752.78268
3345.0000 -130.14849 -125.41909 4.72940 2.34617 -125.78118 734.98697
3350.0000 -130.89100 -125.53604 5.35496 2.35430 -125.66502 746.99178
3355.0000 -131.21238 -126.30796 4.90442 2.32990 -126.01369 709.72063
3360.0000 -131.13769 -125.00606 6.13164 2.33281 -125.97202 733.37789
3365.0000 -130.20688 -124.38244 5.82444 2.47031 -124.00761 846.42340
3370.0000 -130.38533 -124.26489 6.12044 2.45721 -124.19477 812.21901
3375.0000 -130.05602 -124.82779 5.22822 2.43643 -124.49172 813.46338
3380.0000 -130.23557 -124.55907 5.67650 2.47215 -123.98131 846.05866
3385.0000 -129.66003 -123.19085 6.46918 2.52451 -123.23331 863.19918
3390.0000 -131.43231 -125.81998 5.61233 2.41261 -124.83202 823.04757
3395.0000 -130.62231 -124.60126 6.02105 2.38617 -125.20973 768.95599
3400.0000 -130.47941 -125.52194 4.95747 2.40629 -124.92227 811.53491
3405.0000 -131.08527 -124.47029 6.61498 2.43578 -124.50090 819.74349
3410.0000 -132.10610 -127.52382 4.58228 2.34667 -125.77407 729.97407
3415.0000 -133.03981 -127.69037 5.34944 2.19696 -127.91291 619.95445
3420.0000 -132.06113 -126.86265 5.19848 2.23851 -127.31934 679.56253
3425.0000 -130.85311 -125.51741 5.33569 2.32153 -126.13327 742.50627
3430.0000 -130.90627 -125.89445 5.01183 2.38786 -125.18563 769.25612
3435.0000 -131.73254 -126.54677 5.18578 2.31881 -126.17200 728.14459
3440.0000 -131.78628 -125.76120 6.02508 2.32336 -126.10709 739.94824
3445.0000 -130.49700 -124.76604 5.73097 2.36145 -125.56295 763.31288
3450.0000 -130.31812 -125.41783 4.90030 2.40462 -124.94616 791.85202
3455.0000 -131.70787 -126.17247 5.53540 2.37510 -125.36784 752.10240
3460.0000 -132.43314 -127.03747 5.39567 2.31335 -126.25006 760.75808
3465.0000 -131.70870 -127.16235 4.54636 2.26113 -126.99616 707.66417
3470.0000 -130.94869 -125.92086 5.02782 2.28055 -126.71873 693.81257
3475.0000 -130.49966 -125.73806 4.76161 2.33339 -125.96370 738.98307
3480.0000 -129.64718 -124.54692 5.10026 2.42114 -124.71018 807.04577
3485.0000 -131.11098 -126.31926 4.79172 2.37018 -125.43814 771.54747
3490.0000 -131.22908 -125.81300 5.41608 2.28358 -126.67535 712.69717
3495.0000 -131.33880 -126.35535 4.98345 2.30594 -126.35596 706.33182
3500.0000 -130.16649 -125.23321 4.93328 2.34821 -125.75197 736.58686
FREEZING PROCESS: loop number 15 T-loop= 732.00000000000000
main_MD> interactions number 15 at Temperature= 732.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.74074 0.92720 0.67168
force_rgl> df(natom) -1.91620 -0.49257 1.57158
3505.0000 -131.92508 -125.86668 6.05839 2.34189 -125.84229 740.01280
3510.0000 -130.72501 -125.45658 5.26843 2.30831 -126.32204 737.20112
3515.0000 -130.70482 -125.09411 5.61071 2.38087 -125.28551 764.31534
3520.0000 -130.74067 -125.35504 5.38563 2.36019 -125.58092 738.80405
3525.0000 -131.63094 -126.75179 4.87915 2.31825 -126.18011 732.98589
3530.0000 -131.50172 -126.70948 4.79223 2.29313 -126.53888 716.39983
3535.0000 -130.80709 -125.57451 5.23258 2.32815 -126.03862 770.17823
3540.0000 -130.66765 -125.73219 4.93547 2.31915 -126.16724 717.07153
3545.0000 -130.87956 -125.74323 5.13633 2.34727 -125.76550 755.11722
3550.0000 -131.53070 -126.57483 4.95587 2.30741 -126.33495 720.86818
3555.0000 -131.94835 -127.13994 4.80840 2.26236 -126.97861 679.78310
3560.0000 -130.83782 -125.26975 5.56807 2.32705 -126.05437 746.23554
3565.0000 -130.09820 -125.66766 4.43054 2.37732 -125.33617 753.68629
3570.0000 -131.29554 -126.29531 5.00023 2.34166 -125.84569 750.56724
3575.0000 -129.66047 -124.90368 4.75679 2.37249 -125.40514 790.48455
3580.0000 -130.50045 -124.62394 5.87651 2.39650 -125.06214 797.42114
3585.0000 -130.65815 -124.16351 6.49464 2.43645 -124.49143 806.12656
3590.0000 -131.28218 -126.65201 4.63017 2.35856 -125.60424 766.58012
3595.0000 -129.95144 -125.28269 4.66875 2.36250 -125.54788 752.36961
3600.0000 -132.35622 -127.90843 4.44779 2.30886 -126.31422 726.39521
3605.0000 -131.70380 -127.23075 4.47305 2.21865 -127.60296 677.82872
3610.0000 -131.66627 -126.69008 4.97619 2.24597 -127.21269 674.92589
3615.0000 -131.37918 -126.34166 5.03752 2.29879 -126.45811 732.32229
3620.0000 -131.43136 -126.04377 5.38759 2.32017 -126.15260 717.44378
3625.0000 -132.07715 -127.40702 4.67012 2.31631 -126.20781 723.12292
3630.0000 -131.65530 -126.52607 5.12924 2.26504 -126.94020 676.88361
3635.0000 -131.17322 -125.71927 5.45396 2.36302 -125.54041 787.45640
3640.0000 -130.97131 -125.20367 5.76763 2.37580 -125.35790 775.63029
3645.0000 -131.45091 -126.72951 4.72140 2.29188 -126.55686 681.05345
3650.0000 -132.50278 -126.40774 6.09504 2.31228 -126.26540 743.92170
3655.0000 -130.81967 -126.28730 4.53238 2.28616 -126.63852 719.88909
3660.0000 -131.44225 -126.27280 5.16945 2.31960 -126.16080 729.26596
3665.0000 -131.03666 -126.17508 4.86158 2.29820 -126.46650 704.92572
3670.0000 -131.61317 -127.04070 4.57247 2.27285 -126.82865 661.93334
3675.0000 -130.51772 -124.21685 6.30086 2.36540 -125.50647 759.28516
3680.0000 -131.08616 -125.39629 5.68987 2.40683 -124.91459 787.49234
3685.0000 -131.05822 -126.13287 4.92534 2.35043 -125.72040 763.68437
3690.0000 -131.01596 -125.87619 5.13978 2.30849 -126.31954 690.95985
3695.0000 -132.17883 -126.72904 5.44979 2.27784 -126.75743 690.96900
3700.0000 -131.97156 -126.95420 5.01736 2.25297 -127.11264 698.01663
3705.0000 -132.81792 -127.83165 4.98627 2.26656 -126.91849 686.98624
3710.0000 -130.82996 -126.16026 4.66970 2.26132 -126.99337 710.91755
3715.0000 -130.42570 -125.50287 4.92283 2.35784 -125.61443 746.25026
3720.0000 -131.95716 -127.72588 4.23128 2.28981 -126.58645 733.08958
3725.0000 -131.40542 -127.23205 4.17336 2.25487 -127.08549 690.92256
3730.0000 -132.16058 -126.92391 5.23666 2.20712 -127.76771 624.37328
3735.0000 -132.14149 -127.21621 4.92528 2.23727 -127.33702 661.22033
3740.0000 -129.99332 -125.46625 4.52707 2.32587 -126.07126 729.25414
3745.0000 -131.75042 -126.84641 4.90402 2.32791 -126.04203 735.36409
3750.0000 -130.85461 -125.43913 5.41548 2.28649 -126.63381 714.33736
FREEZING PROCESS: loop number 16 T-loop= 707.00000000000000
main_MD> interactions number 16 at Temperature= 707.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.10887 2.76504 -0.23376
force_rgl> df(natom) -1.57680 1.48164 -0.71411
3755.0000 -131.18611 -124.95490 6.23121 2.36291 -125.54201 757.18309
3760.0000 -132.42168 -126.80720 5.61448 2.32699 -126.05527 753.27102
3765.0000 -131.67252 -126.70958 4.96294 2.29513 -126.51032 687.41881
3770.0000 -131.84591 -126.70708 5.13883 2.26152 -126.99048 687.94043
3775.0000 -131.46310 -126.51493 4.94817 2.31672 -126.20189 736.81766
3780.0000 -131.64038 -126.94772 4.69266 2.31091 -126.28493 708.80013
3785.0000 -131.37686 -126.65406 4.72280 2.22998 -127.44112 630.48319
3790.0000 -130.90948 -125.57824 5.33124 2.34487 -125.79974 733.96923
3795.0000 -131.12617 -125.12214 6.00404 2.40513 -124.93892 796.07246
3800.0000 -132.31167 -126.28921 6.02246 2.34870 -125.74503 739.05970
3805.0000 -131.94448 -126.98319 4.96130 2.29802 -126.46912 702.28857
3810.0000 -131.82581 -126.61510 5.21072 2.31972 -126.15913 736.64105
3815.0000 -133.09279 -128.40455 4.68824 2.26538 -126.93536 720.89454
3820.0000 -131.99096 -127.24513 4.74582 2.17759 -128.18962 627.99429
3825.0000 -131.43320 -127.09213 4.34107 2.23063 -127.43186 665.66649
3830.0000 -131.73469 -126.52748 5.20721 2.26501 -126.94067 714.01498
3835.0000 -131.40285 -127.50205 3.90080 2.22030 -127.57939 658.65359
3840.0000 -130.91256 -126.07665 4.83591 2.30527 -126.36554 720.23149
3845.0000 -131.42166 -126.68030 4.74135 2.34238 -125.83527 724.44898
3850.0000 -130.62736 -126.32481 4.30255 2.24377 -127.24417 661.27140
3855.0000 -131.80916 -126.79927 5.00989 2.30250 -126.40514 697.31707
3860.0000 -131.44405 -125.76048 5.68357 2.32219 -126.12377 744.47723
3865.0000 -131.99455 -126.89064 5.10391 2.29838 -126.46401 713.46050
3870.0000 -130.86682 -126.66646 4.20036 2.28451 -126.66207 699.61342
3875.0000 -131.27186 -126.15503 5.11683 2.29046 -126.57703 679.11351
3880.0000 -131.44050 -126.43956 5.00094 2.32669 -126.05945 705.72198
3885.0000 -131.88011 -126.84052 5.03959 2.24958 -127.16114 691.58605
3890.0000 -132.01028 -126.97243 5.03785 2.30448 -126.37675 718.80248
3895.0000 -132.21550 -127.45222 4.76327 2.25956 -127.01859 682.62296
3900.0000 -131.73998 -127.91231 3.82766 2.23060 -127.43226 661.26272
3905.0000 -131.98115 -126.68805 5.29310 2.30160 -126.41787 740.87971
3910.0000 -132.37887 -127.26873 5.11014 2.27709 -126.76809 702.17052
3915.0000 -132.29159 -127.95690 4.33470 2.20342 -127.82059 651.18632
3920.0000 -131.30484 -126.72980 4.57504 2.25038 -127.14963 680.68345
3925.0000 -131.96228 -126.11897 5.84331 2.32516 -126.08133 750.73121
3930.0000 -131.18549 -125.97609 5.20940 2.35971 -125.58768 772.68780
3935.0000 -131.77924 -126.73834 5.04090 2.30144 -126.42021 724.69194
3940.0000 -132.15933 -126.64128 5.51806 2.31695 -126.19869 730.35120
3945.0000 -131.06863 -125.83151 5.23712 2.35251 -125.69056 776.93631
3950.0000 -131.33615 -126.51430 4.82185 2.34610 -125.78226 744.95496
3955.0000 -130.72688 -125.65302 5.07386 2.30328 -126.39398 720.77598
3960.0000 -131.50022 -126.48444 5.01578 2.30690 -126.34226 724.03664
3965.0000 -131.04911 -125.72555 5.32356 2.30890 -126.31367 740.38463
3970.0000 -130.47682 -125.42288 5.05394 2.36937 -125.44977 767.60242
3975.0000 -131.81075 -127.06876 4.74199 2.34999 -125.72664 738.50727
3980.0000 -131.44166 -127.18197 4.25969 2.26914 -126.88171 668.03926
3985.0000 -131.63788 -126.66166 4.97623 2.28371 -126.67348 680.80632
3990.0000 -131.12126 -126.53310 4.58815 2.29205 -126.55437 684.96422
3995.0000 -132.21615 -126.72490 5.49124 2.29165 -126.56003 733.49187
4000.0000 -130.61484 -125.47779 5.13705 2.29769 -126.47381 708.81500
FREEZING PROCESS: loop number 17 T-loop= 682.00000000000000
main_MD> interactions number 17 at Temperature= 682.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.55590 -2.16662 -1.67090
force_rgl> df(natom) -1.43354 2.19661 -4.62298
4005.0000 -131.43589 -126.56774 4.86815 2.35730 -125.62221 770.80011
4010.0000 -131.07642 -127.06895 4.00747 2.27873 -126.74462 682.01983
4015.0000 -132.15826 -127.30522 4.85304 2.23825 -127.32303 676.31726
4020.0000 -130.82702 -125.98815 4.83887 2.28979 -126.58667 732.93775
4025.0000 -130.13632 -126.03135 4.10497 2.33570 -125.93079 720.66778
4030.0000 -131.75675 -126.98610 4.77065 2.31409 -126.23953 710.40309
4035.0000 -131.19519 -126.65917 4.53601 2.26506 -126.93995 681.34263
4040.0000 -132.34550 -126.74682 5.59868 2.25484 -127.08595 668.30690
4045.0000 -132.19668 -126.39739 5.79929 2.26343 -126.96333 703.87098
4050.0000 -131.41040 -126.66698 4.74342 2.26795 -126.89864 676.21162
4055.0000 -131.12425 -126.06028 5.06398 2.28959 -126.58955 700.38089
4060.0000 -131.69041 -126.72769 4.96273 2.31566 -126.21703 723.97081
4065.0000 -130.16482 -125.66320 4.50161 2.28016 -126.72426 707.18830
4070.0000 -131.76302 -127.32931 4.43371 2.30561 -126.36060 691.71730
4075.0000 -131.70594 -126.31782 5.38811 2.23988 -127.29972 639.15683
4080.0000 -132.17355 -126.21575 5.95780 2.30087 -126.42843 718.80176
4085.0000 -131.88101 -127.13489 4.74612 2.27013 -126.86751 708.57408
4090.0000 -130.63891 -126.48008 4.15884 2.31251 -126.26208 748.86738
4095.0000 -129.89566 -124.92659 4.96908 2.30329 -126.39384 708.64105
4100.0000 -130.60488 -124.57990 6.02498 2.39211 -125.12485 754.78015
4105.0000 -131.87571 -127.48152 4.39420 2.31697 -126.19833 733.33084
4110.0000 -133.35235 -129.45622 3.89613 2.16034 -128.43613 603.18189
4115.0000 -130.98749 -126.47332 4.51417 2.18789 -128.04242 631.83669
4120.0000 -131.11838 -126.84838 4.27000 2.30277 -126.40118 685.06590
4125.0000 -131.64470 -127.13652 4.50818 2.30534 -126.36452 688.77060
4130.0000 -130.72031 -125.38204 5.33828 2.29109 -126.56807 694.03433
4135.0000 -131.31646 -126.03221 5.28426 2.33905 -125.88292 751.69377
4140.0000 -133.18977 -128.35834 4.83143 2.23040 -127.43513 716.22162
4145.0000 -132.00179 -127.66284 4.33895 2.21400 -127.66947 661.98592
4150.0000 -133.42650 -128.31274 5.11376 2.20199 -127.84100 665.69239
4155.0000 -131.90259 -127.34708 4.55551 2.21589 -127.64251 655.20245
4160.0000 -130.76394 -125.96721 4.79673 2.31346 -126.24846 720.84322
4165.0000 -131.12014 -125.71163 5.40851 2.35525 -125.65149 737.26186
4170.0000 -131.61853 -125.73399 5.88454 2.34037 -125.86408 736.30935
4175.0000 -130.51186 -125.71006 4.80180 2.36545 -125.50575 736.76695
4180.0000 -132.08787 -127.59226 4.49561 2.31505 -126.22580 721.58644
4185.0000 -131.10241 -125.81724 5.28517 2.27190 -126.84227 725.57302
4190.0000 -131.56839 -127.18779 4.38060 2.28413 -126.66756 724.46638
4195.0000 -133.03009 -128.14361 4.88648 2.19258 -127.97543 651.83947
4200.0000 -132.51213 -127.60271 4.90942 2.23646 -127.34862 681.21960
4205.0000 -132.73153 -128.54963 4.18190 2.15984 -128.44324 652.99718
4210.0000 -132.25291 -127.45819 4.79471 2.19384 -127.95743 654.08192
4215.0000 -131.77416 -127.20694 4.56722 2.25184 -127.12880 683.53445
4220.0000 -133.47277 -129.10278 4.36999 2.15270 -128.54525 621.87237
4225.0000 -132.67461 -127.53953 5.13507 2.14540 -128.64951 594.31578
4230.0000 -132.49438 -127.63902 4.85537 2.21163 -127.70336 635.62660
4235.0000 -131.07458 -126.22428 4.85030 2.24052 -127.29062 677.43587
4240.0000 -130.32505 -126.12509 4.19996 2.28346 -126.67706 669.09991
4245.0000 -132.06225 -126.94812 5.11413 2.29250 -126.54792 692.91552
4250.0000 -131.55761 -126.18984 5.36776 2.22102 -127.56914 693.21553
FREEZING PROCESS: loop number 18 T-loop= 657.00000000000000
main_MD> interactions number 18 at Temperature= 657.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -2.78860 3.87706 -2.64600
force_rgl> df(natom) 1.76079 -0.75398 5.51466
4255.0000 -131.12046 -125.95993 5.16053 2.30726 -126.33712 736.34555
4260.0000 -132.39410 -126.90913 5.48497 2.32257 -126.11829 725.84855
4265.0000 -131.44348 -127.02658 4.41690 2.28473 -126.65894 694.37994
4270.0000 -130.75066 -126.84512 3.90554 2.27571 -126.78777 672.73200
4275.0000 -131.69378 -126.89841 4.79537 2.24866 -127.17427 667.64103
4280.0000 -132.41354 -126.88401 5.52953 2.25349 -127.10530 676.53226
4285.0000 -131.25735 -127.24346 4.01389 2.25651 -127.06215 687.62520
4290.0000 -131.30066 -126.89497 4.40569 2.28390 -126.67087 685.46275
4295.0000 -131.58601 -126.64482 4.94119 2.27661 -126.77501 697.89190
4300.0000 -131.32999 -125.96951 5.36048 2.32588 -126.07099 724.25467
4305.0000 -132.60103 -128.19545 4.40558 2.23452 -127.37627 646.92202
4310.0000 -132.27814 -127.55103 4.72711 2.20640 -127.77798 621.27130
4315.0000 -132.34077 -128.43896 3.90181 2.22341 -127.53498 643.10223
4320.0000 -133.17588 -128.32015 4.85574 2.14540 -128.64958 600.49415
4325.0000 -132.01715 -127.59325 4.42390 2.16706 -128.34009 615.18071
4330.0000 -132.35854 -128.40107 3.95748 2.20657 -127.77562 637.15945
4335.0000 -132.66342 -127.72962 4.93381 2.17181 -128.27215 620.64366
4340.0000 -131.87752 -127.86362 4.01390 2.23047 -127.43420 654.20874
4345.0000 -132.34132 -127.24502 5.09630 2.21621 -127.63786 670.13465
4350.0000 -131.56508 -126.51440 5.05069 2.24562 -127.21776 698.10904
4355.0000 -131.85601 -127.46422 4.39178 2.27328 -126.82247 670.20211
4360.0000 -131.45792 -127.76341 3.69451 2.22853 -127.46192 660.16011
4365.0000 -132.82567 -127.94653 4.87914 2.22330 -127.53653 655.32143
4370.0000 -132.07193 -127.90142 4.17051 2.21174 -127.70167 644.05072
4375.0000 -133.35259 -128.24205 5.11054 2.16765 -128.33166 631.28246
4380.0000 -131.78360 -128.10714 3.67646 2.17731 -128.19360 621.46017
4385.0000 -131.62374 -128.02544 3.59830 2.18726 -128.05147 615.41845
4390.0000 -131.70271 -127.46594 4.23677 2.22351 -127.53353 645.93846
4395.0000 -131.39362 -126.58347 4.81015 2.23687 -127.34274 654.76520
4400.0000 -132.72495 -128.56722 4.15773 2.24904 -127.16887 685.60681
4405.0000 -131.82026 -127.34980 4.47046 2.19237 -127.97853 628.71096
4410.0000 -132.09927 -127.57553 4.52374 2.23788 -127.32829 650.53181
4415.0000 -132.13277 -128.35801 3.77475 2.20934 -127.73595 649.60392
4420.0000 -132.75692 -127.53606 5.22087 2.24466 -127.23140 666.07297
4425.0000 -132.17899 -128.07810 4.10089 2.19372 -127.95924 620.15437
4430.0000 -132.41695 -128.54004 3.87691 2.17183 -128.27194 641.61351
4435.0000 -134.02833 -129.38741 4.64092 2.15191 -128.55651 595.77051
4440.0000 -133.01554 -128.62933 4.38620 2.17710 -128.19661 610.24622
4445.0000 -132.46586 -128.30018 4.16568 2.17075 -128.28738 611.64660
4450.0000 -132.77237 -127.57103 5.20135 2.18131 -128.13643 612.98692
4455.0000 -131.48091 -127.19661 4.28430 2.23953 -127.30465 650.31088
4460.0000 -131.23942 -126.50922 4.73020 2.25734 -127.05029 665.34852
4465.0000 -132.68746 -128.83374 3.85372 2.21395 -127.67012 627.86477
4470.0000 -131.42802 -127.50885 3.91916 2.16837 -128.32141 596.46763
4475.0000 -132.25769 -128.01225 4.24544 2.16823 -128.32328 606.57044
4480.0000 -132.78987 -127.78036 5.00951 2.18394 -128.09887 615.86658
4485.0000 -131.85969 -126.95540 4.90429 2.22264 -127.54604 656.04254
4490.0000 -131.84637 -126.65696 5.18941 2.30621 -126.35202 700.79269
4495.0000 -131.05307 -126.65467 4.39841 2.28782 -126.61478 673.48672
4500.0000 -133.03660 -128.25597 4.78063 2.23809 -127.32531 661.35763
FREEZING PROCESS: loop number 19 T-loop= 632.00000000000000
main_MD> interactions number 19 at Temperature= 632.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 3.99400 -2.56855 -1.00692
force_rgl> df(natom) 0.04570 -0.70803 -0.83993
4505.0000 -133.13281 -128.16004 4.97277 2.16818 -128.32402 612.80200
4510.0000 -132.34951 -128.56790 3.78161 2.17929 -128.16536 640.44463
4515.0000 -132.82476 -128.65370 4.17106 2.19333 -127.96472 654.55411
4520.0000 -132.24976 -127.58920 4.66056 2.18992 -128.01345 644.79589
4525.0000 -132.34894 -127.57552 4.77342 2.22719 -127.48106 651.63686
4530.0000 -131.88042 -127.87161 4.00881 2.20785 -127.75728 648.91579
4535.0000 -132.62044 -128.26474 4.35570 2.15303 -128.54049 632.77995
4540.0000 -132.36875 -127.83552 4.53322 2.17384 -128.24319 652.47899
4545.0000 -130.96458 -126.52523 4.43935 2.23130 -127.42223 645.40940
4550.0000 -131.58574 -127.13566 4.45007 2.27226 -126.83707 687.13518
4555.0000 -133.11714 -128.07416 5.04298 2.18775 -128.04450 625.19926
4560.0000 -132.84042 -127.84288 4.99755 2.20554 -127.79035 636.32758
4565.0000 -132.19431 -128.26452 3.92979 2.18081 -128.14366 604.95866
4570.0000 -132.59258 -128.27746 4.31512 2.16692 -128.34202 627.53425
4575.0000 -132.13184 -127.42124 4.71060 2.26212 -126.98198 683.68567
4580.0000 -131.27952 -126.33245 4.94706 2.23388 -127.38549 685.51162
4585.0000 -131.10001 -126.46711 4.63290 2.32856 -126.03277 723.95244
4590.0000 -132.92055 -128.80533 4.11522 2.27289 -126.82809 693.13909
4595.0000 -132.45868 -128.14892 4.30976 2.16907 -128.31141 636.29672
4600.0000 -131.57809 -127.95895 3.61914 2.19046 -128.00575 630.31288
4605.0000 -132.99156 -128.08921 4.90235 2.21364 -127.67464 639.11876
4610.0000 -133.03543 -128.50389 4.53155 2.16776 -128.33000 604.70909
4615.0000 -132.02115 -128.79354 3.22761 2.17306 -128.25430 593.16155
4620.0000 -132.41435 -128.64595 3.76840 2.15194 -128.55606 595.70058
4625.0000 -132.70452 -129.16465 3.53987 2.11862 -129.03213 572.11529
4630.0000 -132.43349 -127.60854 4.82495 2.18058 -128.14697 624.64166
4635.0000 -132.31448 -127.66385 4.65063 2.23132 -127.42202 672.56335
4640.0000 -130.42053 -125.96355 4.45697 2.28499 -126.65522 677.51282
4645.0000 -131.89135 -127.02064 4.87071 2.25689 -127.05670 694.33503
4650.0000 -132.82735 -127.61930 5.20804 2.24875 -127.17299 698.96780
4655.0000 -132.79819 -128.28956 4.50863 2.19928 -127.87978 634.43515
4660.0000 -132.08796 -127.99278 4.09518 2.22119 -127.56680 636.92553
4665.0000 -132.25493 -128.60988 3.64505 2.17340 -128.24947 613.81795
4670.0000 -132.85796 -128.40990 4.44805 2.17155 -128.27584 617.69148
4675.0000 -131.99701 -127.72339 4.27362 2.18562 -128.07494 627.51272
4680.0000 -132.72683 -127.63657 5.09026 2.22550 -127.50520 668.43371
4685.0000 -132.72337 -127.95754 4.76583 2.17065 -128.28881 631.82769
4690.0000 -132.89710 -128.47970 4.41741 2.18952 -128.01920 634.71948
4695.0000 -132.00233 -126.77045 5.23188 2.17984 -128.15741 602.42125
4700.0000 -132.36312 -127.47663 4.88649 2.24647 -127.20558 674.98240
4705.0000 -131.79458 -127.22716 4.56742 2.23075 -127.43015 657.29172
4710.0000 -132.39059 -127.73546 4.65513 2.23116 -127.42431 672.18743
4715.0000 -132.61013 -127.98549 4.62464 2.22470 -127.51663 697.44103
4720.0000 -132.80293 -128.17613 4.62681 2.18789 -128.04246 626.97742
4725.0000 -132.93382 -128.47345 4.46037 2.17928 -128.16545 616.71167
4730.0000 -132.66173 -127.43202 5.22971 2.17306 -128.25436 641.47493
4735.0000 -133.96386 -129.59503 4.36883 2.12940 -128.87809 581.21865
4740.0000 -133.63364 -130.15241 3.48122 2.08501 -129.51228 568.47712
4745.0000 -132.09882 -128.18320 3.91563 2.13561 -128.78943 575.69482
4750.0000 -132.45921 -127.86724 4.59197 2.20287 -127.82849 644.53167
FREEZING PROCESS: loop number 20 T-loop= 607.00000000000000
main_MD> interactions number 20 at Temperature= 607.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -2.77198 -1.69719 -3.92409
force_rgl> df(natom) -0.22507 0.70663 2.02774
4755.0000 -132.33161 -128.47426 3.85736 2.17297 -128.25556 621.87532
4760.0000 -133.55044 -129.25882 4.29162 2.14950 -128.59089 588.69519
4765.0000 -132.92097 -128.87052 4.05045 2.13895 -128.74171 585.99594
4770.0000 -133.21382 -129.43678 3.77704 2.15162 -128.56065 605.44697
4775.0000 -133.22246 -129.18498 4.03748 2.10074 -129.28748 571.69804
4780.0000 -132.63069 -128.52436 4.10633 2.10775 -129.18737 559.94940
4785.0000 -133.09844 -129.23465 3.86379 2.13153 -128.84762 579.06076
4790.0000 -133.70241 -129.87821 3.82419 2.11407 -129.09709 574.29416
4795.0000 -132.59886 -127.32478 5.27408 2.14623 -128.63766 598.30003
4800.0000 -131.80434 -127.43774 4.36660 2.25247 -127.11988 662.41080
4805.0000 -132.83201 -127.93521 4.89681 2.22694 -127.48460 658.10471
4810.0000 -133.14819 -129.47051 3.67768 2.12260 -128.97526 581.18584
4815.0000 -133.60841 -128.78251 4.82590 2.07838 -129.60702 544.18103
4820.0000 -132.40277 -128.18313 4.21964 2.12415 -128.95313 610.00177
4825.0000 -133.12250 -128.75813 4.36437 2.18107 -128.13986 639.94823
4830.0000 -132.47567 -128.75562 3.72005 2.11671 -129.05932 588.99149
4835.0000 -132.29897 -127.62173 4.67724 2.18208 -128.12545 584.43767
4840.0000 -131.82124 -126.63581 5.18543 2.23968 -127.30255 643.44938
4845.0000 -132.66720 -128.49612 4.17108 2.22500 -127.51228 643.81287
4850.0000 -132.11228 -127.78247 4.32981 2.18885 -128.02874 627.75234
4855.0000 -132.53338 -127.47999 5.05339 2.18773 -128.04474 625.52600
4860.0000 -132.38613 -128.61118 3.77495 2.17506 -128.22572 609.93407
4865.0000 -133.34707 -129.81790 3.52918 2.11639 -129.06389 567.83788
4870.0000 -131.75650 -128.06555 3.69094 2.10847 -129.17711 587.58913
4875.0000 -133.07453 -128.92882 4.14571 2.12406 -128.95440 585.64555
4880.0000 -133.19047 -128.51716 4.67331 2.13627 -128.77992 626.87465
4885.0000 -133.15404 -129.38901 3.76503 2.10606 -129.21151 578.55771
4890.0000 -132.94691 -128.60259 4.34432 2.11120 -129.13808 591.20036
4895.0000 -133.36483 -129.10254 4.26229 2.10835 -129.17884 580.48456
4900.0000 -132.54688 -128.19886 4.34802 2.16543 -128.36337 611.43477
4905.0000 -131.97734 -128.41661 3.56073 2.19276 -127.97289 623.27908
4910.0000 -132.80580 -129.29913 3.50667 2.14434 -128.66462 593.63272
4915.0000 -131.77366 -127.39190 4.38176 2.18984 -128.01468 630.57602
4920.0000 -131.70407 -128.15502 3.54905 2.20879 -127.74385 610.42265
4925.0000 -132.83703 -128.04798 4.78904 2.16105 -128.42599 606.21549
4930.0000 -132.86377 -128.39821 4.46556 2.17733 -128.19330 625.89707
4935.0000 -131.92021 -127.59289 4.32731 2.18839 -128.03531 612.26722
4940.0000 -132.35483 -128.87877 3.47606 2.17857 -128.17568 616.65815
4945.0000 -132.73326 -128.34208 4.39118 2.12274 -128.97320 580.48402
4950.0000 -133.43508 -129.95413 3.48095 2.12479 -128.94399 545.91874
4955.0000 -134.05661 -129.66712 4.38950 2.06466 -129.80304 543.60121
4960.0000 -133.86330 -129.73775 4.12555 2.06749 -129.76260 541.64891
4965.0000 -133.25500 -129.04934 4.20566 2.07921 -129.59519 538.43622
4970.0000 -132.85183 -129.01010 3.84173 2.11941 -129.02076 590.34309
4975.0000 -133.27356 -129.25336 4.02020 2.18025 -128.15162 651.41847
4980.0000 -132.74090 -128.41657 4.32433 2.15094 -128.57034 612.44944
4985.0000 -132.65807 -127.47589 5.18219 2.22841 -127.46352 675.54562
4990.0000 -131.30919 -127.26290 4.04630 2.22288 -127.54264 643.46929
4995.0000 -131.79827 -127.52753 4.27074 2.25687 -127.05701 651.93110
5000.0000 -132.04398 -127.53198 4.51200 2.21650 -127.63371 639.84668
FREEZING PROCESS: loop number 21 T-loop= 582.00000000000000
main_MD> interactions number 21 at Temperature= 582.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.11730 2.28837 -1.43322
force_rgl> df(natom) -0.60408 0.78048 4.02585
5005.0000 -132.91302 -128.48142 4.43160 2.18479 -128.08669 649.65498
5010.0000 -132.43853 -128.06526 4.37328 2.16828 -128.32259 603.42543
5015.0000 -132.56840 -127.89092 4.67748 2.15601 -128.49793 607.41401
5020.0000 -132.74907 -127.71374 5.03532 2.19379 -127.95819 616.28607
5025.0000 -132.34581 -128.05359 4.29222 2.18117 -128.13854 604.39882
5030.0000 -132.39393 -127.67102 4.72290 2.17404 -128.24036 593.03748
5035.0000 -131.74986 -126.82497 4.92489 2.21764 -127.61748 636.77041
5040.0000 -132.85793 -128.08364 4.77429 2.24896 -127.16993 690.05415
5045.0000 -133.09787 -128.84529 4.25257 2.12956 -128.87578 597.26572
5050.0000 -132.49342 -128.75520 3.73822 2.12984 -128.87176 599.86223
5055.0000 -133.33762 -129.80371 3.53391 2.11241 -129.12086 570.58422
5060.0000 -133.57408 -128.52670 5.04738 2.10820 -129.18097 563.13554
5065.0000 -133.22495 -129.47712 3.74783 2.13754 -128.76175 603.56519
5070.0000 -133.60136 -129.53282 4.06855 2.07785 -129.61457 556.83330
5075.0000 -133.22210 -129.27688 3.94522 2.06675 -129.77321 538.42020
5080.0000 -133.06133 -129.16320 3.89813 2.11373 -129.10200 585.78649
5085.0000 -132.85755 -128.48472 4.37283 2.14734 -128.62174 598.82514
5090.0000 -132.11576 -128.43549 3.68026 2.14672 -128.63070 591.69764
5095.0000 -132.90683 -128.71925 4.18758 2.14448 -128.66258 601.17617
5100.0000 -132.70938 -129.18366 3.52572 2.11901 -129.02649 577.99597
5105.0000 -133.30318 -129.04015 4.26302 2.11253 -129.11908 598.95168
5110.0000 -133.01951 -128.99512 4.02439 2.10183 -129.27192 581.31808
5115.0000 -133.82281 -129.42714 4.39567 2.11710 -129.05387 602.48208
5120.0000 -133.39126 -128.47922 4.91204 2.15297 -128.54142 618.07143
5125.0000 -132.71269 -128.76751 3.94518 2.13424 -128.80899 602.48030
5130.0000 -132.45928 -128.06001 4.39927 2.15586 -128.50005 614.02997
5135.0000 -133.74811 -128.66104 5.08708 2.16119 -128.42397 645.28504
5140.0000 -132.92845 -128.93776 3.99069 2.14878 -128.60122 607.80338
5145.0000 -133.46541 -128.74117 4.72424 2.13425 -128.80885 593.07002
5150.0000 -132.26344 -128.47666 3.78677 2.15355 -128.53312 599.54932
5155.0000 -132.92055 -128.74170 4.17885 2.12395 -128.95595 574.25673
5160.0000 -133.95712 -129.95162 4.00551 2.08407 -129.52574 561.42038
5165.0000 -133.47751 -129.03029 4.44721 2.05964 -129.87478 529.38632
5170.0000 -132.37922 -128.58240 3.79682 2.16248 -128.40546 624.15624
5175.0000 -133.68968 -129.96404 3.72564 2.10506 -129.22580 563.70499
5180.0000 -134.27649 -130.44394 3.83254 2.04206 -130.12594 507.71866
5185.0000 -134.29275 -130.76866 3.52409 2.01235 -130.55036 521.55873
5190.0000 -134.13025 -130.74027 3.38998 2.00934 -130.59338 524.86532
5195.0000 -133.70075 -129.67772 4.02302 2.04288 -130.11423 542.21412
5200.0000 -132.46816 -128.58049 3.88768 2.12552 -128.93349 580.96164
5205.0000 -133.02115 -128.75589 4.26526 2.14098 -128.71262 581.96248
5210.0000 -133.18343 -128.90433 4.27910 2.13512 -128.79640 574.28383
5215.0000 -133.13317 -128.88819 4.24498 2.13385 -128.81452 573.19528
5220.0000 -132.50308 -128.38613 4.11694 2.15605 -128.49742 596.42478
5225.0000 -133.06210 -128.38758 4.67451 2.15018 -128.58122 617.46949
5230.0000 -133.35550 -128.99423 4.36126 2.14938 -128.59263 610.85175
5235.0000 -131.59336 -127.60293 3.99044 2.22096 -127.57008 649.16463
5240.0000 -133.22849 -128.78078 4.44772 2.17953 -128.16197 602.95005
5245.0000 -132.41218 -128.14483 4.26735 2.16752 -128.33351 611.91604
5250.0000 -132.48248 -129.03853 3.44395 2.15213 -128.55331 595.02429
FREEZING PROCESS: loop number 22 T-loop= 557.00000000000000
main_MD> interactions number 22 at Temperature= 557.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.06260 -1.03051 -5.03645
force_rgl> df(natom) 1.85809 0.12438 1.92090
5255.0000 -133.94653 -129.94786 3.99867 2.08607 -129.49712 523.59305
5260.0000 -133.61760 -129.60121 4.01639 2.06048 -129.86275 534.85531
5265.0000 -133.57843 -130.33485 3.24358 2.05334 -129.96469 540.94652
5270.0000 -133.28156 -129.10679 4.17477 2.06372 -129.81650 572.43906
5275.0000 -134.04080 -128.58481 5.45599 2.10561 -129.21803 612.37723
5280.0000 -134.07415 -129.33409 4.74006 2.10330 -129.25094 619.20756
5285.0000 -134.10930 -129.49557 4.61373 2.10706 -129.19733 606.04485
5290.0000 -133.65250 -129.53554 4.11696 2.11728 -129.05123 599.20872
5295.0000 -133.15322 -129.70947 3.44375 2.06096 -129.85594 524.50015
5300.0000 -133.56383 -129.20563 4.35821 2.10824 -129.18044 577.20589
5305.0000 -133.24209 -129.07089 4.17120 2.11280 -129.11529 585.45135
5310.0000 -133.15664 -128.48822 4.66842 2.16734 -128.33604 624.17553
5315.0000 -133.20731 -129.19653 4.01078 2.09869 -129.31677 567.48871
5320.0000 -132.32342 -128.83013 3.49329 2.14132 -128.70782 602.06602
5325.0000 -133.14614 -128.77037 4.37577 2.14432 -128.66500 572.83773
5330.0000 -132.92752 -129.81445 3.11307 2.07321 -129.68083 505.27608
5335.0000 -133.71368 -130.65383 3.05985 2.02426 -130.38025 484.57979
5340.0000 -133.86153 -129.52736 4.33417 2.07340 -129.67820 521.65730
5345.0000 -133.20200 -129.20470 3.99730 2.09841 -129.32082 563.85604
5350.0000 -133.17293 -129.21234 3.96059 2.08507 -129.51145 533.29471
5355.0000 -133.22123 -128.71115 4.51007 2.08166 -129.56012 548.67030
5360.0000 -132.46423 -128.21470 4.24952 2.20173 -127.84470 633.12713
5365.0000 -132.22474 -128.23062 3.99412 2.16414 -128.38180 595.53575
5370.0000 -132.71115 -128.73502 3.97612 2.15342 -128.53499 582.64880
5375.0000 -133.24269 -128.92541 4.31728 2.14487 -128.65705 604.95335
5380.0000 -133.86977 -129.45251 4.41726 2.13680 -128.77238 574.49701
5385.0000 -133.93239 -129.99659 3.93580 2.07365 -129.67453 559.44030
5390.0000 -134.26893 -130.99413 3.27480 2.01714 -130.48197 509.97356
5395.0000 -133.32255 -129.80125 3.52129 1.99834 -130.75053 495.38238
5400.0000 -132.93436 -128.92473 4.00963 2.08560 -129.50388 550.40515
5405.0000 -132.48974 -128.37515 4.11459 2.15994 -128.44180 617.39864
5410.0000 -133.75956 -129.16613 4.59344 2.12845 -128.89160 565.81000
5415.0000 -133.64013 -129.23084 4.40929 2.12097 -128.99850 579.11640
5420.0000 -132.94811 -128.75846 4.18966 2.11762 -129.04638 567.40793
5425.0000 -133.72468 -129.93177 3.79291 2.06900 -129.74102 523.71218
5430.0000 -133.20868 -129.15531 4.05336 2.04867 -130.03149 541.54528
5435.0000 -133.30561 -129.28719 4.01842 2.13644 -128.77748 609.67210
5440.0000 -133.88917 -129.75273 4.13644 2.08923 -129.45196 562.09211
5445.0000 -134.08508 -129.87076 4.21432 2.07264 -129.68894 554.36989
5450.0000 -132.50886 -128.62840 3.88047 2.12877 -128.88712 580.71360
5455.0000 -133.06818 -128.98389 4.08429 2.12619 -128.92402 558.90538
5460.0000 -132.99222 -129.09784 3.89438 2.10306 -129.25440 559.49942
5465.0000 -132.98559 -129.54906 3.43653 2.11144 -129.13465 569.73317
5470.0000 -133.24131 -128.67670 4.56461 2.10285 -129.25738 571.67719
5475.0000 -133.47726 -129.28423 4.19303 2.15718 -128.48125 606.23420
5480.0000 -133.58267 -129.55453 4.02814 2.08772 -129.47351 542.54047
5485.0000 -132.95315 -128.81469 4.13846 2.13117 -128.85284 581.96930
5490.0000 -133.51657 -129.99129 3.52528 2.09441 -129.37802 572.07091
5495.0000 -133.03329 -129.26699 3.76631 2.09047 -129.43433 556.87695
5500.0000 -133.77710 -130.10878 3.66833 2.02966 -130.30306 533.05318
FREEZING PROCESS: loop number 23 T-loop= 532.00000000000000
main_MD> interactions number 23 at Temperature= 532.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -4.20222 3.30402 -1.70347
force_rgl> df(natom) -2.06078 -0.19442 2.99990
5505.0000 -133.64991 -129.82162 3.82829 2.05591 -129.92801 554.62081
5510.0000 -134.57980 -130.90394 3.67585 2.04199 -130.12684 534.89612
5515.0000 -134.56440 -131.05051 3.51389 1.96832 -131.17939 485.51257
5520.0000 -133.77993 -130.37344 3.40649 2.02531 -130.36525 531.69740
5525.0000 -134.15288 -130.50569 3.64719 2.01300 -130.54101 525.34165
5530.0000 -134.48073 -131.08440 3.39634 2.02424 -130.38041 535.41174
5535.0000 -133.98561 -130.79433 3.19127 2.00236 -130.69309 505.11473
5540.0000 -133.75326 -130.38534 3.36792 2.02758 -130.33282 522.22845
5545.0000 -133.81263 -129.98707 3.82556 2.07079 -129.71549 540.98124
5550.0000 -133.76840 -129.51109 4.25731 2.07887 -129.59998 539.78182
5555.0000 -133.31130 -129.97890 3.33241 2.05273 -129.97348 520.95817
5560.0000 -134.55464 -131.48763 3.06701 2.01212 -130.55363 479.24993
5565.0000 -134.31142 -130.43554 3.87587 2.01766 -130.47452 497.20181
5570.0000 -133.75658 -129.94243 3.81415 2.04704 -130.05471 523.29987
5575.0000 -134.39062 -129.96917 4.42145 2.07252 -129.69077 550.17557
5580.0000 -134.22441 -130.39721 3.82720 2.02887 -130.31427 521.26187
5585.0000 -134.16881 -130.63689 3.53192 2.03547 -130.22006 534.57460
5590.0000 -133.91435 -130.25096 3.66339 2.02484 -130.37189 533.07766
5595.0000 -134.20362 -130.69143 3.51219 2.00902 -130.59790 523.08809
5600.0000 -134.03293 -130.34353 3.68941 2.02417 -130.38145 555.01302
5605.0000 -134.55641 -131.26292 3.29349 2.02375 -130.38751 547.96648
5610.0000 -134.70720 -131.33627 3.37093 1.98125 -130.99472 514.15239
5615.0000 -134.38709 -130.13367 4.25341 1.99508 -130.79713 518.11668
5620.0000 -133.17435 -129.56979 3.60456 2.06221 -129.83794 567.60866
5625.0000 -133.65731 -129.85130 3.80602 2.04377 -130.10145 508.35463
5630.0000 -133.20876 -129.65175 3.55701 2.08861 -129.46080 550.92446
5635.0000 -133.79097 -130.25658 3.53438 2.04224 -130.12334 509.03204
5640.0000 -133.83074 -130.19358 3.63717 2.02998 -130.29846 510.59839
5645.0000 -133.82282 -129.80467 4.01815 2.04936 -130.02165 523.33050
5650.0000 -133.58604 -129.23705 4.34899 2.07377 -129.67286 556.93275
5655.0000 -133.33671 -129.75961 3.57711 2.05144 -129.99193 505.86383
5660.0000 -133.85562 -129.26609 4.58954 2.08136 -129.56443 553.21686
5665.0000 -133.85164 -129.76615 4.08549 2.08276 -129.54442 560.96932
5670.0000 -133.05640 -129.54129 3.51512 2.04637 -130.06426 520.63137
5675.0000 -133.33913 -129.69618 3.64295 2.08014 -129.58185 526.91682
5680.0000 -134.22338 -129.84031 4.38307 2.05897 -129.88423 521.32973
5685.0000 -134.63891 -130.63817 4.00074 2.03134 -130.27897 529.70247
5690.0000 -134.37375 -130.91673 3.45702 2.00238 -130.69278 526.88997
5695.0000 -134.33096 -131.12471 3.20625 1.99215 -130.83898 508.94456
5700.0000 -134.26715 -130.87684 3.39031 1.99557 -130.79000 513.28552
5705.0000 -134.06882 -130.86930 3.19952 1.98296 -130.97026 495.93292
5710.0000 -133.25213 -130.08252 3.16961 2.03909 -130.16825 530.17764
5715.0000 -133.34471 -129.24888 4.09583 2.06950 -129.73392 535.14117
5720.0000 -132.20593 -128.78978 3.41616 2.12816 -128.89587 572.44964
5725.0000 -133.29427 -130.15384 3.14043 2.09768 -129.33126 571.39948
5730.0000 -132.87849 -128.63496 4.24353 2.10820 -129.18092 572.26600
5735.0000 -134.16032 -130.65267 3.50765 2.08282 -129.54359 554.52667
5740.0000 -134.16917 -130.68796 3.48121 2.03049 -130.29113 515.60835
5745.0000 -134.16470 -131.04551 3.11919 1.97314 -131.11056 469.27125
5750.0000 -134.39973 -130.97170 3.42803 1.95128 -131.42281 458.76200
FREEZING PROCESS: loop number 24 T-loop= 507.00000000000000
main_MD> interactions number 24 at Temperature= 507.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.97761 0.83475 -0.40692
force_rgl> df(natom) -1.22511 -2.78828 2.29138
5755.0000 -134.46906 -130.40666 4.06240 1.97898 -131.02703 481.20921
5760.0000 -134.19617 -131.15017 3.04600 2.01519 -130.50982 504.68316
5765.0000 -134.76921 -131.30721 3.46200 1.97437 -131.09291 485.67155
5770.0000 -134.56880 -130.52393 4.04487 1.98101 -130.99813 487.25239
5775.0000 -134.51739 -130.73493 3.78246 1.97639 -131.06413 488.46978
5780.0000 -134.21344 -130.72118 3.49225 1.97904 -131.02619 482.25723
5785.0000 -134.36142 -130.94396 3.41746 2.00944 -130.59186 522.84232
5790.0000 -133.78380 -130.87641 2.90739 1.99323 -130.82350 501.22944
5795.0000 -133.34956 -130.35780 2.99176 2.02358 -130.38990 523.92035
5800.0000 -134.37664 -130.51429 3.86235 2.02891 -130.31374 526.32797
5805.0000 -133.91401 -130.25705 3.65696 2.01714 -130.48189 500.05141
5810.0000 -133.51730 -129.85204 3.66526 2.07360 -129.67523 525.76889
5815.0000 -133.94828 -129.86313 4.08516 2.04921 -130.02368 516.80494
5820.0000 -133.65166 -130.03724 3.61442 2.06923 -129.73778 537.26378
5825.0000 -133.85177 -130.54866 3.30311 2.04348 -130.10564 515.33608
5830.0000 -134.12198 -130.99383 3.12815 1.98598 -130.92704 492.59753
5835.0000 -133.50255 -129.93051 3.57204 2.00568 -130.64566 484.38944
5840.0000 -133.89389 -129.96421 3.92968 2.04335 -130.10742 512.56083
5845.0000 -133.93792 -130.75226 3.18567 2.01743 -130.47781 530.37795
5850.0000 -133.41632 -130.65282 2.76350 2.02451 -130.37664 512.69862
5855.0000 -134.08254 -130.45512 3.62742 2.02580 -130.35812 526.91922
5860.0000 -134.27931 -130.73702 3.54229 2.01203 -130.55497 533.18821
5865.0000 -134.41666 -130.08912 4.32754 1.99737 -130.76438 487.85533
5870.0000 -134.04302 -130.49256 3.55046 2.02855 -130.31895 513.01948
5875.0000 -134.08261 -129.96553 4.11708 2.05273 -129.97347 509.81379
5880.0000 -133.89746 -130.14501 3.75245 2.02788 -130.32847 548.46165
5885.0000 -134.03965 -130.77279 3.26686 2.03651 -130.20513 516.94952
5890.0000 -134.13437 -129.94101 4.19336 1.99173 -130.84495 500.78430
5895.0000 -133.66444 -129.97705 3.68740 2.03353 -130.24776 536.40804
5900.0000 -134.03782 -130.44803 3.58979 2.01295 -130.54176 495.00969
5905.0000 -134.65251 -130.72921 3.92331 2.00900 -130.59823 518.96255
5910.0000 -133.18252 -130.04720 3.13532 1.99540 -130.79248 489.71494
5915.0000 -133.47872 -130.08320 3.39552 2.03394 -130.24194 507.53660
5920.0000 -133.90724 -130.17273 3.73452 2.05803 -129.89771 525.07158
5925.0000 -134.80954 -130.62102 4.18851 2.00278 -130.68701 507.94826
5930.0000 -133.93619 -130.49720 3.43899 1.99178 -130.84420 496.95387
5935.0000 -133.80448 -130.72739 3.07709 2.00554 -130.64770 498.56891
5940.0000 -134.72073 -130.81005 3.91068 2.00302 -130.68367 483.78162
5945.0000 -134.73854 -131.11850 3.62004 2.01459 -130.51838 510.11627
5950.0000 -134.68294 -130.92550 3.75743 2.01093 -130.57066 524.27162
5955.0000 -134.49806 -131.53557 2.96249 1.95715 -131.33892 485.18139
5960.0000 -134.26724 -131.28901 2.97823 1.95893 -131.31358 470.93976
5965.0000 -134.26787 -131.62533 2.64255 1.95639 -131.34985 464.36291
5970.0000 -134.30824 -131.49649 2.81175 1.94621 -131.49530 458.86350
5975.0000 -134.55707 -131.72847 2.82860 1.94052 -131.57659 457.00230
5980.0000 -134.99169 -131.55727 3.43442 1.93376 -131.67315 456.28872
5985.0000 -134.29868 -130.69193 3.60675 1.94835 -131.46464 446.70882
5990.0000 -133.88237 -131.02500 2.85737 1.99695 -130.77036 493.18780
5995.0000 -133.59056 -130.02607 3.56449 2.02765 -130.33174 511.21526
6000.0000 -134.71840 -130.59291 4.12550 2.02137 -130.42143 509.89846
FREEZING PROCESS: loop number 25 T-loop= 482.00000000000000
main_MD> interactions number 25 at Temperature= 482.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.67249 1.24168 -0.65798
force_rgl> df(natom) -1.66271 -1.86969 -0.13570
6005.0000 -134.28998 -130.35475 3.93523 2.00146 -130.70598 496.94983
6010.0000 -134.25731 -130.73864 3.51866 2.01728 -130.47994 519.38139
6015.0000 -134.19242 -130.24243 3.94999 2.02365 -130.38888 524.76696
6020.0000 -134.31304 -130.93525 3.37779 2.01200 -130.55541 494.75143
6025.0000 -134.02711 -131.11712 2.90999 2.00486 -130.65736 481.55460
6030.0000 -134.10785 -130.57249 3.53536 1.98050 -131.00537 458.85366
6035.0000 -133.58659 -130.69028 2.89632 1.99161 -130.84668 472.49042
6040.0000 -134.19178 -131.01926 3.17253 1.98705 -130.91175 476.25300
6045.0000 -133.71175 -130.47049 3.24126 1.97606 -131.06873 454.66472
6050.0000 -133.69744 -130.03668 3.66076 2.05217 -129.98139 518.50507
6055.0000 -134.60443 -131.29314 3.31129 2.02116 -130.42442 510.04283
6060.0000 -134.48510 -131.31447 3.17062 1.95599 -131.35553 468.11176
6065.0000 -134.51674 -130.92734 3.58941 1.96480 -131.22971 483.92875
6070.0000 -134.63972 -131.42838 3.21135 1.97606 -131.06884 491.60205
6075.0000 -134.75776 -131.32514 3.43262 1.95609 -131.35412 463.73951
6080.0000 -134.73404 -131.75208 2.98196 1.94088 -131.57145 448.98967
6085.0000 -135.29275 -131.47972 3.81304 1.95037 -131.43584 492.79733
6090.0000 -135.24558 -130.82217 4.42341 1.96415 -131.23891 527.63294
6095.0000 -134.83122 -131.24888 3.58234 1.95449 -131.37689 509.09037
6100.0000 -135.14949 -131.41598 3.73351 1.95188 -131.41419 516.66669
6105.0000 -135.80460 -132.68434 3.12026 1.92383 -131.81496 489.46979
6110.0000 -135.17404 -132.09929 3.07475 1.88671 -132.34538 451.88810
6115.0000 -135.27608 -132.14350 3.13258 1.91461 -131.94673 484.56572
6120.0000 -134.89064 -131.73206 3.15858 1.90882 -132.02944 477.44738
6125.0000 -135.08518 -132.15372 2.93146 1.91157 -131.99012 483.45283
6130.0000 -135.85344 -132.73167 3.12177 1.91194 -131.98491 473.42750
6135.0000 -135.96371 -132.87364 3.09006 1.85949 -132.73425 435.69092
6140.0000 -135.53381 -132.46524 3.06857 1.86566 -132.64607 435.81629
6145.0000 -135.27458 -131.72916 3.54541 1.89662 -132.20367 466.68939
6150.0000 -134.60530 -131.18147 3.42383 1.94219 -131.55274 501.04475
6155.0000 -134.98365 -130.92762 4.05603 1.93628 -131.63715 499.20061
6160.0000 -134.59326 -131.47343 3.11983 1.96161 -131.27531 514.12893
6165.0000 -134.76235 -131.58973 3.17261 1.94064 -131.57479 501.26534
6170.0000 -135.43967 -132.37217 3.06749 1.88286 -132.40034 446.04703
6175.0000 -135.48314 -132.39197 3.09117 1.87079 -132.57275 441.13163
6180.0000 -135.32722 -131.95279 3.37443 1.89657 -132.20439 461.41679
6185.0000 -135.00272 -131.41875 3.58396 1.94870 -131.45974 511.65550
6190.0000 -135.83861 -131.95019 3.88843 1.92752 -131.76234 523.28180
6195.0000 -136.08106 -132.31512 3.76595 1.88475 -132.37334 482.90396
6200.0000 -136.37765 -132.70184 3.67581 1.87278 -132.54433 482.50584
6205.0000 -135.55575 -132.46424 3.09151 1.87867 -132.46011 484.05524
6210.0000 -136.37377 -133.04539 3.32838 1.83564 -133.07487 447.10085
6215.0000 -136.26679 -132.75506 3.51173 1.85074 -132.85919 459.73970
6220.0000 -135.92043 -133.25058 2.66984 1.84096 -132.99892 451.42944
6225.0000 -136.11348 -132.92202 3.19146 1.83944 -133.02066 450.45587
6230.0000 -135.36183 -132.12643 3.23539 1.89537 -132.22152 495.15473
6235.0000 -135.87311 -132.21293 3.66018 1.88626 -132.35179 490.11823
6240.0000 -135.95235 -132.32972 3.62263 1.89491 -132.22811 497.47762
6245.0000 -135.40495 -131.92664 3.47831 1.90216 -132.12457 509.44589
6250.0000 -135.38114 -132.14471 3.23643 1.87812 -132.46808 487.70726
FREEZING PROCESS: loop number 26 T-loop= 457.00000000000000
main_MD> interactions number 26 at Temperature= 457.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.50669 2.04752 0.49013
force_rgl> df(natom) -0.85431 -2.89431 -0.40553
6255.0000 -136.33430 -132.62974 3.70456 1.86338 -132.67858 469.34183
6260.0000 -135.59992 -131.95954 3.64038 1.87041 -132.57818 479.67715
6265.0000 -135.80558 -132.60266 3.20292 1.87571 -132.50239 476.22797
6270.0000 -136.00853 -132.78713 3.22141 1.86122 -132.70942 466.36365
6275.0000 -136.02066 -133.45340 2.56726 1.83888 -133.02871 446.14161
6280.0000 -135.99235 -132.68571 3.30665 1.83164 -133.13202 444.57193
6285.0000 -136.70285 -133.94399 2.75886 1.82046 -133.29179 432.52566
6290.0000 -136.17955 -133.20523 2.97432 1.80609 -133.49714 423.56116
6295.0000 -136.27408 -133.22135 3.05273 1.82967 -133.16026 440.55242
6300.0000 -136.10395 -133.03562 3.06833 1.83015 -133.15339 440.64461
6305.0000 -136.53379 -133.00175 3.53203 1.84730 -132.90840 455.22791
6310.0000 -135.76765 -132.25429 3.51336 1.86724 -132.62347 469.60020
6315.0000 -135.62933 -132.36640 3.26293 1.88007 -132.44018 485.76077
6320.0000 -134.53305 -131.26976 3.26329 1.92782 -131.75806 522.75962
6325.0000 -136.35530 -132.18240 4.17290 1.89374 -132.24482 497.08342
6330.0000 -135.77492 -132.37812 3.39680 1.88219 -132.40984 484.00936
6335.0000 -135.78164 -132.66492 3.11672 1.89529 -132.22271 494.11889
6340.0000 -135.34105 -132.79628 2.54478 1.88847 -132.32012 487.68190
6345.0000 -136.54401 -132.92246 3.62155 1.85652 -132.77660 472.71703
6350.0000 -135.37223 -132.38806 2.98417 1.87046 -132.57753 471.11701
6355.0000 -135.79972 -132.55063 3.24909 1.86045 -132.72050 468.94354
6360.0000 -135.60867 -132.32631 3.28235 1.90918 -132.02434 507.62671
6365.0000 -136.27372 -133.52857 2.74516 1.81133 -133.42230 421.61952
6370.0000 -136.15950 -133.44926 2.71025 1.81594 -133.35636 428.26183
6375.0000 -135.83932 -131.50619 4.33313 1.88152 -132.41944 485.62605
6380.0000 -135.94630 -132.91387 3.03243 1.92229 -131.83702 521.77124
6385.0000 -136.05507 -132.50837 3.54670 1.87805 -132.46907 484.76716
6390.0000 -136.17016 -132.50597 3.66418 1.88142 -132.42090 487.10167
6395.0000 -136.30415 -133.12509 3.17905 1.83950 -133.01984 443.03250
6400.0000 -136.13409 -132.91341 3.22067 1.85573 -132.78786 455.18452
6405.0000 -135.98776 -132.84716 3.14061 1.85369 -132.81698 460.01106
6410.0000 -135.86476 -132.63005 3.23471 1.84576 -132.93033 455.92490
6415.0000 -135.57995 -132.41032 3.16963 1.86493 -132.65641 471.87923
6420.0000 -136.32416 -132.67813 3.64603 1.87648 -132.49149 485.64803
6425.0000 -135.63626 -132.63904 2.99723 1.87906 -132.45454 483.47998
6430.0000 -135.76088 -131.92856 3.83232 1.89904 -132.16922 500.20567
6435.0000 -135.59105 -131.81616 3.77489 1.93212 -131.69657 525.51845
6440.0000 -136.42041 -132.96271 3.45770 1.89016 -132.29595 492.23468
6445.0000 -136.37281 -133.76338 2.60943 1.82449 -133.23422 433.72670
6450.0000 -136.42220 -132.94937 3.47283 1.81157 -133.41885 424.93845
6455.0000 -136.61847 -133.37903 3.23944 1.82653 -133.20501 437.58003
6460.0000 -136.39135 -133.73753 2.65382 1.80814 -133.46783 424.67608
6465.0000 -136.58166 -133.10506 3.47661 1.81557 -133.36162 426.70617
6470.0000 -136.12505 -133.28438 2.84067 1.84176 -132.98747 449.91624
6475.0000 -136.41248 -133.11383 3.29865 1.83160 -133.13264 442.01269
6480.0000 -136.40318 -133.14957 3.25361 1.84017 -133.01022 456.32593
6485.0000 -136.01838 -132.81912 3.19926 1.84790 -132.89979 458.11980
6490.0000 -135.86868 -132.87408 2.99460 1.83282 -133.11520 445.81031
6495.0000 -135.68505 -132.98348 2.70156 1.83525 -133.08045 444.90478
6500.0000 -136.27277 -132.45159 3.82119 1.86212 -132.69669 465.55554
FREEZING PROCESS: loop number 27 T-loop= 432.00000000000000
main_MD> interactions number 27 at Temperature= 432.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.40246 1.11652 1.11149
force_rgl> df(natom) -1.79674 0.82599 0.22010
6505.0000 -136.42975 -132.99748 3.43227 1.85818 -132.75285 464.08492
6510.0000 -136.23632 -133.76539 2.47093 1.80577 -133.50164 414.39854
6515.0000 -136.84940 -134.04123 2.80817 1.78778 -133.75865 398.62911
6520.0000 -136.03453 -133.46952 2.56501 1.78996 -133.72757 401.52693
6525.0000 -136.60438 -133.62176 2.98262 1.79781 -133.61539 411.02384
6530.0000 -135.78075 -133.89900 1.88175 1.77608 -133.92580 396.06353
6535.0000 -136.26741 -132.64306 3.62435 1.82589 -133.21416 433.45926
6540.0000 -136.43006 -133.70283 2.72723 1.85033 -132.86511 458.50790
6545.0000 -136.40929 -133.31308 3.09622 1.80578 -133.50148 417.47766
6550.0000 -136.35169 -133.19660 3.15508 1.80829 -133.46563 422.13661
6555.0000 -135.82977 -132.52713 3.30263 1.84968 -132.87440 455.51842
6560.0000 -136.25458 -133.11526 3.13932 1.84844 -132.89201 456.61421
6565.0000 -136.26218 -132.96193 3.30025 1.81983 -133.30073 430.96114
6570.0000 -136.13111 -132.97419 3.15692 1.86749 -132.61989 473.32603
6575.0000 -136.44133 -132.78360 3.65773 1.85272 -132.83086 461.88276
6580.0000 -135.96371 -133.33979 2.62392 1.82378 -133.24439 436.99544
6585.0000 -136.60493 -133.49161 3.11332 1.81590 -133.35697 423.76528
6590.0000 -136.00867 -132.62576 3.38291 1.83746 -133.04888 445.36084
6595.0000 -135.91163 -132.79876 3.11287 1.85735 -132.76480 467.10672
6600.0000 -136.42161 -133.34697 3.07464 1.83834 -133.03631 442.46116
6605.0000 -136.29591 -133.73274 2.56317 1.78917 -133.73890 404.12915
6610.0000 -136.63003 -133.59216 3.03787 1.78877 -133.74457 400.38197
6615.0000 -136.83721 -134.32624 2.51096 1.77518 -133.93867 391.42527
6620.0000 -136.78912 -134.43108 2.35803 1.76301 -134.11250 376.27902
6625.0000 -136.23077 -133.51308 2.71769 1.78563 -133.78936 394.66361
6630.0000 -136.69966 -133.31083 3.38883 1.84761 -132.90397 456.40308
6635.0000 -135.93609 -132.59615 3.33994 1.84219 -132.98142 451.85602
6640.0000 -136.53675 -133.79594 2.74081 1.83079 -133.14417 438.57626
6645.0000 -136.40057 -134.09758 2.30299 1.78288 -133.82864 394.51512
6650.0000 -136.06425 -133.16937 2.89488 1.80204 -133.55499 421.27161
6655.0000 -136.75000 -133.25144 3.49856 1.80243 -133.54934 413.47347
6660.0000 -135.85396 -133.06186 2.79210 1.83467 -133.08872 442.87825
6665.0000 -135.87795 -132.42331 3.45463 1.83798 -133.04151 450.23127
6670.0000 -136.18614 -133.12042 3.06572 1.83102 -133.14097 444.50484
6675.0000 -136.01612 -133.26397 2.75215 1.82111 -133.28249 430.65071
6680.0000 -136.12366 -133.09855 3.02511 1.81992 -133.29946 438.07861
6685.0000 -136.21855 -133.20452 3.01403 1.85181 -132.84386 458.16750
6690.0000 -136.43999 -133.59249 2.84750 1.81101 -133.42679 425.03319
6695.0000 -136.98375 -133.77908 3.20467 1.80809 -133.46848 418.90474
6700.0000 -136.38419 -133.73239 2.65180 1.77361 -133.96110 391.53762
6705.0000 -136.11807 -133.27033 2.84773 1.80326 -133.53755 417.61383
6710.0000 -136.49673 -133.45249 3.04425 1.80208 -133.55433 419.28602
6715.0000 -137.00438 -133.55539 3.44899 1.81230 -133.40841 419.80740
6720.0000 -136.15527 -132.91377 3.24150 1.81042 -133.43525 424.23952
6725.0000 -136.66628 -133.90042 2.76586 1.81851 -133.31969 431.54577
6730.0000 -136.65054 -134.06913 2.58141 1.77737 -133.90746 390.08051
6735.0000 -136.71145 -133.21577 3.49569 1.77654 -133.91928 394.28818
6740.0000 -135.63770 -133.02394 2.61376 1.80414 -133.52501 415.05394
6745.0000 -136.05291 -132.73590 3.31702 1.85656 -132.77612 463.86120
6750.0000 -136.25814 -133.49608 2.76206 1.83253 -133.11935 441.80657
FREEZING PROCESS: loop number 28 T-loop= 407.00000000000000
main_MD> interactions number 28 at Temperature= 407.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.16686 1.27870 -0.80060
force_rgl> df(natom) -0.54234 -0.15793 -0.53817
6755.0000 -136.52562 -134.07721 2.44840 1.82054 -133.29073 429.14353
6760.0000 -136.48880 -133.87668 2.61211 1.79149 -133.70563 400.38049
6765.0000 -136.42042 -132.81422 3.60619 1.82742 -133.19231 435.03522
6770.0000 -136.48066 -133.89355 2.58711 1.81807 -133.32591 429.89490
6775.0000 -136.73910 -134.32817 2.41093 1.78391 -133.81394 396.83196
6780.0000 -136.75137 -133.58434 3.16704 1.75819 -134.18138 369.15828
6785.0000 -136.67783 -133.61876 3.05907 1.80234 -133.55066 415.73862
6790.0000 -136.25127 -133.49549 2.75577 1.77292 -133.97093 386.17723
6795.0000 -136.37181 -133.86727 2.50455 1.80458 -133.51865 420.98596
6800.0000 -136.32304 -133.26469 3.05835 1.78275 -133.83052 394.42333
6805.0000 -136.54579 -133.52750 3.01829 1.82105 -133.28330 438.88348
6810.0000 -136.66397 -133.77867 2.88530 1.77338 -133.96445 396.54018
6815.0000 -136.67234 -134.30384 2.36850 1.77233 -133.97943 395.89844
6820.0000 -137.24998 -134.55850 2.69148 1.76650 -134.06273 381.19126
6825.0000 -136.42873 -134.01442 2.41431 1.74881 -134.31543 365.92580
6830.0000 -136.20802 -133.75144 2.45658 1.79197 -133.69887 404.85239
6835.0000 -136.74730 -133.99249 2.75481 1.79176 -133.70181 406.67035
6840.0000 -136.25187 -133.70905 2.54282 1.78437 -133.80743 393.30541
6845.0000 -135.98056 -133.40422 2.57634 1.78971 -133.73106 404.44633
6850.0000 -136.50536 -133.53518 2.97018 1.83747 -133.04879 448.34076
6855.0000 -136.17921 -133.51067 2.66855 1.81430 -133.37983 430.91240
6860.0000 -136.78449 -133.59936 3.18513 1.78919 -133.73853 402.34609
6865.0000 -136.36195 -133.91211 2.44984 1.77791 -133.89965 397.30032
6870.0000 -136.54425 -133.75460 2.78966 1.77903 -133.88373 402.04263
6875.0000 -136.14968 -133.43029 2.71938 1.79106 -133.71177 410.57767
6880.0000 -136.57854 -133.18045 3.39809 1.80359 -133.53277 430.07664
6885.0000 -136.15424 -133.39955 2.75469 1.78747 -133.76312 400.42538
6890.0000 -136.49733 -133.43298 3.06435 1.82194 -133.27070 431.74429
6895.0000 -136.30667 -133.49576 2.81091 1.82057 -133.29026 431.05178
6900.0000 -136.22538 -133.46389 2.76149 1.79162 -133.70380 410.86699
6905.0000 -136.55186 -132.95879 3.59307 1.81815 -133.32475 430.01835
6910.0000 -136.83828 -134.44086 2.39741 1.76928 -134.02302 384.59118
6915.0000 -136.61157 -134.27865 2.33292 1.75745 -134.19204 371.06608
6920.0000 -136.50955 -134.10855 2.40101 1.73828 -134.46584 354.41975
6925.0000 -136.54403 -133.95213 2.59189 1.80350 -133.53417 411.16767
6930.0000 -136.38272 -133.70376 2.67896 1.78291 -133.82828 393.20531
6935.0000 -137.12307 -134.10360 3.01947 1.76513 -134.08232 382.60638
6940.0000 -136.73149 -133.80351 2.92799 1.78881 -133.74390 399.53942
6945.0000 -137.13157 -134.45327 2.67831 1.77985 -133.87192 392.07588
6950.0000 -136.27415 -133.82349 2.45066 1.76553 -134.07650 381.20609
6955.0000 -136.79527 -134.42563 2.36964 1.75970 -134.15985 373.10035
6960.0000 -136.81935 -134.11934 2.70000 1.75957 -134.16175 377.88045
6965.0000 -136.30813 -133.51412 2.79401 1.77649 -133.91996 389.93191
6970.0000 -136.58225 -134.13431 2.44794 1.78928 -133.73730 401.77120
6975.0000 -136.61570 -133.32517 3.29053 1.77460 -133.94698 385.75121
6980.0000 -136.99685 -133.36492 3.63193 1.82466 -133.23176 436.05759
6985.0000 -136.84964 -134.05739 2.79225 1.77279 -133.97291 385.19087
6990.0000 -136.34092 -133.11533 3.22559 1.81720 -133.33838 424.22427
6995.0000 -137.21203 -133.97172 3.24032 1.81303 -133.39794 431.13033
7000.0000 -136.79420 -134.15182 2.64238 1.74938 -134.30727 364.11680
FREEZING PROCESS: loop number 29 T-loop= 382.00000000000000
main_MD> interactions number 29 at Temperature= 382.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.02938 -3.00489 0.38195
force_rgl> df(natom) 0.25395 -1.93182 -0.79544
7005.0000 -136.60088 -134.24788 2.35299 1.73901 -134.45546 353.20301
7010.0000 -136.80262 -134.41581 2.38681 1.76437 -134.09313 380.40758
7015.0000 -137.29837 -135.17077 2.12760 1.73111 -134.56828 345.61524
7020.0000 -136.62409 -133.53966 3.08443 1.74955 -134.30481 361.39116
7025.0000 -136.81834 -133.63506 3.18329 1.78610 -133.78262 407.11462
7030.0000 -136.70570 -134.31218 2.39352 1.75748 -134.19163 378.87502
7035.0000 -136.60669 -133.90318 2.70351 1.77719 -133.91002 393.06126
7040.0000 -136.41527 -134.01259 2.40268 1.77044 -134.00644 387.57542
7045.0000 -136.42054 -133.54533 2.87521 1.78262 -133.83233 393.11118
7050.0000 -136.87102 -134.38548 2.48554 1.77184 -133.98635 385.71681
7055.0000 -136.65915 -134.10790 2.55125 1.75989 -134.15712 372.51109
7060.0000 -136.50547 -134.25084 2.25462 1.75313 -134.25369 368.66640
7065.0000 -136.52586 -133.67265 2.85321 1.77504 -133.94069 394.68732
7070.0000 -136.74158 -133.78242 2.95916 1.78199 -133.84136 394.16702
7075.0000 -137.07375 -134.33130 2.74244 1.76927 -134.02318 384.53203
7080.0000 -136.61105 -133.91841 2.69264 1.74742 -134.33524 364.13361
7085.0000 -136.77806 -133.74102 3.03704 1.76681 -134.05828 381.24998
7090.0000 -136.26648 -133.19694 3.06954 1.80171 -133.55967 409.56875
7095.0000 -137.22851 -134.44695 2.78156 1.78247 -133.83448 399.47675
7100.0000 -136.40573 -133.83424 2.57149 1.76713 -134.05371 389.83128
7105.0000 -136.15129 -133.75608 2.39520 1.75037 -134.29313 365.28347
7110.0000 -136.76817 -133.50889 3.25928 1.78767 -133.76026 403.78782
7115.0000 -137.34516 -134.55808 2.78708 1.76869 -134.03145 384.46361
7120.0000 -136.58166 -134.38909 2.19257 1.74295 -134.39910 358.35933
7125.0000 -136.85471 -134.24184 2.61287 1.73784 -134.47216 351.33771
7130.0000 -136.42298 -133.66858 2.75440 1.77882 -133.88666 394.46711
7135.0000 -137.08104 -134.23298 2.84807 1.77218 -133.98157 388.65090
7140.0000 -136.71771 -133.96664 2.75106 1.75038 -134.29307 362.20245
7145.0000 -136.51842 -133.80424 2.71419 1.76394 -134.09930 379.12576
7150.0000 -137.04614 -134.43903 2.60711 1.76090 -134.14272 377.67672
7155.0000 -137.10154 -134.66196 2.43957 1.75372 -134.24525 373.05609
7160.0000 -136.84516 -134.53956 2.30559 1.73683 -134.48666 351.79222
7165.0000 -137.00951 -133.85419 3.15531 1.75488 -134.22879 370.22218
7170.0000 -136.61996 -133.88369 2.73627 1.79322 -133.68090 396.65505
7175.0000 -136.72010 -134.27420 2.44590 1.75671 -134.20264 371.70715
7180.0000 -136.81299 -133.90706 2.90593 1.76762 -134.04666 386.88374
7185.0000 -136.29732 -134.07843 2.21889 1.73828 -134.46590 354.39787
7190.0000 -136.44222 -133.93524 2.50698 1.75205 -134.26916 367.27088
7195.0000 -137.13278 -134.80907 2.32370 1.73681 -134.48687 352.35407
7200.0000 -137.31925 -135.11932 2.19993 1.71167 -134.84611 328.13687
7205.0000 -136.80592 -134.18948 2.61644 1.73186 -134.55763 349.63438
7210.0000 -136.76307 -134.42689 2.33618 1.74946 -134.30618 364.20048
7215.0000 -136.23847 -133.43881 2.79966 1.77166 -133.98901 390.71369
7220.0000 -136.77085 -133.66155 3.10930 1.80630 -133.49406 420.97313
7225.0000 -136.70607 -133.92236 2.78371 1.79067 -133.71734 409.33678
7230.0000 -136.62133 -133.88108 2.74025 1.76648 -134.06305 383.50666
7235.0000 -136.66074 -133.91381 2.74694 1.77778 -133.90159 393.00998
7240.0000 -136.64317 -134.08911 2.55407 1.76447 -134.09176 379.48762
7245.0000 -136.96231 -134.13166 2.83065 1.77103 -133.99794 382.96530
7250.0000 -137.22077 -135.11578 2.10499 1.73466 -134.51758 351.42603
FREEZING PROCESS: loop number 30 T-loop= 357.00000000000000
main_MD> interactions number 30 at Temperature= 357.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.10526 0.06840 1.70098
force_rgl> df(natom) -2.33230 0.97192 -1.06823
7255.0000 -137.23550 -134.58614 2.64936 1.70450 -134.94841 320.73214
7260.0000 -137.09257 -134.69294 2.39964 1.72453 -134.66225 348.83583
7265.0000 -137.08115 -134.98342 2.09774 1.72385 -134.67199 339.01275
7270.0000 -137.55733 -135.16710 2.39023 1.69560 -135.07564 311.22316
7275.0000 -136.71824 -134.50651 2.21173 1.71444 -134.80644 331.39595
7280.0000 -136.94771 -135.07191 1.87580 1.72035 -134.72208 336.15280
7285.0000 -136.71100 -134.11676 2.59424 1.72095 -134.71347 335.93060
7290.0000 -137.10868 -134.73963 2.36905 1.73780 -134.47272 350.51927
7295.0000 -137.01682 -134.40731 2.60951 1.74396 -134.38467 359.31924
7300.0000 -137.32226 -134.55965 2.76261 1.73430 -134.52270 347.35413
7305.0000 -137.10200 -134.73463 2.36737 1.73650 -134.49137 353.16508
7310.0000 -137.17945 -133.77378 3.40566 1.74586 -134.35756 362.63997
7315.0000 -136.59091 -134.26759 2.32332 1.76730 -134.05123 379.66478
7320.0000 -136.98802 -134.83576 2.15226 1.75042 -134.29247 365.60576
7325.0000 -137.34755 -134.66106 2.68649 1.72097 -134.71318 341.61677
7330.0000 -136.71095 -134.14605 2.56490 1.74269 -134.40287 356.63328
7335.0000 -136.46151 -134.11036 2.35115 1.75675 -134.20205 372.45727
7340.0000 -137.00432 -134.62522 2.37910 1.72780 -134.61554 342.20365
7345.0000 -137.24625 -134.46863 2.77762 1.73223 -134.55225 345.89486
7350.0000 -136.83627 -134.27807 2.55820 1.73858 -134.46162 356.38703
7355.0000 -136.81127 -133.76091 3.05036 1.77401 -133.95548 383.46339
7360.0000 -137.43029 -134.82825 2.60204 1.75076 -134.28758 364.34081
7365.0000 -137.33276 -134.88640 2.44637 1.71701 -134.76969 329.63852
7370.0000 -137.26400 -134.59263 2.67138 1.70738 -134.90735 324.49274
7375.0000 -136.55166 -134.08643 2.46523 1.74675 -134.34493 363.64437
7380.0000 -136.80866 -134.14413 2.66453 1.76401 -134.09826 377.69391
7385.0000 -136.70351 -134.43834 2.26517 1.76275 -134.11623 379.67211
7390.0000 -136.90146 -134.62742 2.27404 1.74625 -134.35207 362.87346
7395.0000 -137.25808 -134.45092 2.80716 1.74249 -134.40567 356.99591
7400.0000 -137.01222 -134.01221 3.00001 1.74352 -134.39100 361.83182
7405.0000 -136.86953 -134.07947 2.79006 1.76018 -134.15301 375.07256
7410.0000 -136.44914 -133.46656 2.98258 1.79682 -133.62952 410.09854
7415.0000 -136.25797 -133.55698 2.70099 1.80536 -133.50759 419.70742
7420.0000 -137.11923 -134.05371 3.06551 1.76995 -134.01340 381.69052
7425.0000 -136.62431 -134.18486 2.43945 1.76272 -134.11669 376.45786
7430.0000 -136.56122 -134.26098 2.30024 1.75279 -134.25864 371.23322
7435.0000 -136.87778 -134.11607 2.76171 1.73348 -134.53446 348.25268
7440.0000 -136.52691 -134.28773 2.23918 1.75147 -134.27744 365.01531
7445.0000 -137.21112 -134.61736 2.59376 1.74186 -134.41478 360.73097
7450.0000 -136.77060 -134.59161 2.17899 1.74797 -134.32745 364.29438
7455.0000 -136.72395 -134.33876 2.38519 1.73017 -134.58170 344.56442
7460.0000 -137.43259 -134.97422 2.45836 1.70560 -134.93274 319.85123
7465.0000 -137.18357 -134.49130 2.69227 1.72870 -134.60274 347.63727
7470.0000 -137.00582 -134.49382 2.51200 1.74475 -134.37341 363.80646
7475.0000 -137.07847 -134.50121 2.57725 1.74148 -134.42012 356.88145
7480.0000 -136.82972 -134.32915 2.50057 1.75911 -134.16825 374.42504
7485.0000 -136.63224 -134.10960 2.52265 1.75811 -134.18264 374.76846
7490.0000 -137.12765 -134.72533 2.40232 1.73921 -134.45252 355.47895
7495.0000 -136.50341 -134.40061 2.10280 1.70905 -134.88340 326.66056
7500.0000 -136.33454 -133.89215 2.44239 1.76146 -134.13472 374.83843
FREEZING PROCESS: loop number 31 T-loop= 332.00000000000000
main_MD> interactions number 31 at Temperature= 332.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.39395 -0.59180 0.89225
force_rgl> df(natom) -0.28042 -1.28832 -0.85766
7505.0000 -137.03933 -134.27311 2.76622 1.77344 -133.96354 389.94645
7510.0000 -137.03417 -134.60263 2.43153 1.73911 -134.45404 354.94644
7515.0000 -137.18813 -134.80315 2.38498 1.70335 -134.96494 319.95221
7520.0000 -137.38589 -135.10172 2.28417 1.72250 -134.69135 336.60818
7525.0000 -137.32647 -134.86656 2.45991 1.70100 -134.99841 317.14036
7530.0000 -137.29971 -135.04502 2.25470 1.71323 -134.82379 329.13240
7535.0000 -136.93158 -134.41217 2.51942 1.70855 -134.89067 326.72624
7540.0000 -136.51026 -134.18287 2.32739 1.74865 -134.31778 363.00282
7545.0000 -137.13320 -134.83524 2.29797 1.72350 -134.67704 340.22883
7550.0000 -137.26965 -134.60966 2.65999 1.71199 -134.84147 329.61635
7555.0000 -137.42649 -135.52015 1.90634 1.69594 -135.07075 313.70350
7560.0000 -137.28043 -135.11011 2.17032 1.66957 -135.44751 287.76476
7565.0000 -136.86552 -134.50716 2.35835 1.71180 -134.84413 331.14242
7570.0000 -137.02396 -134.50542 2.51854 1.73355 -134.53352 348.61722
7575.0000 -137.49587 -135.10846 2.38741 1.70923 -134.88090 328.97199
7580.0000 -137.00028 -134.71196 2.28832 1.71109 -134.85432 326.98342
7585.0000 -137.26233 -134.89569 2.36664 1.71745 -134.76342 332.85059
7590.0000 -136.75875 -134.62938 2.12936 1.70558 -134.93300 320.79014
7595.0000 -137.02166 -134.62565 2.39601 1.73746 -134.47760 359.65058
7600.0000 -137.50187 -134.84319 2.65868 1.71048 -134.86306 327.88594
7605.0000 -137.20932 -134.76769 2.44163 1.72540 -134.64985 346.22622
7610.0000 -137.13050 -135.09508 2.03542 1.72561 -134.64695 340.58967
7615.0000 -137.02497 -134.78397 2.24100 1.70367 -134.96037 318.19919
7620.0000 -137.13798 -134.56895 2.56903 1.73816 -134.46752 357.66934
7625.0000 -137.07676 -134.95720 2.11956 1.71538 -134.79299 333.49334
7630.0000 -136.97878 -135.10833 1.87045 1.70399 -134.95577 317.86867
7635.0000 -136.91643 -134.37907 2.53736 1.73327 -134.53740 344.24566
7640.0000 -136.81967 -134.28214 2.53753 1.75052 -134.29107 365.09165
7645.0000 -137.14178 -134.74914 2.39264 1.71267 -134.83176 329.27983
7650.0000 -136.61934 -134.53935 2.08000 1.72872 -134.60252 347.35352
7655.0000 -137.02016 -134.51779 2.50236 1.73284 -134.54358 352.44031
7660.0000 -136.91156 -134.82927 2.08229 1.73152 -134.56251 349.25979
7665.0000 -136.62606 -134.49152 2.13454 1.73572 -134.50239 352.91388
7670.0000 -136.67543 -134.05810 2.61733 1.73684 -134.48641 355.66379
7675.0000 -137.16078 -134.76915 2.39164 1.73416 -134.52473 350.06294
7680.0000 -136.76521 -134.32794 2.43727 1.73992 -134.44250 356.05726
7685.0000 -137.19735 -134.88832 2.30902 1.73449 -134.52003 351.16217
7690.0000 -137.39237 -134.89610 2.49627 1.70591 -134.92836 324.88712
7695.0000 -137.56707 -135.23847 2.32859 1.70717 -134.91036 325.20131
7700.0000 -137.20293 -135.08261 2.12032 1.69551 -135.07688 312.23743
7705.0000 -136.93893 -134.42871 2.51022 1.69469 -135.08857 311.56193
7710.0000 -137.24602 -134.79541 2.45061 1.74028 -134.43725 355.25893
7715.0000 -136.48087 -133.94679 2.53408 1.74648 -134.34877 361.84721
7720.0000 -136.83349 -134.28958 2.54391 1.74920 -134.30993 365.77813
7725.0000 -137.10601 -134.96170 2.14431 1.72763 -134.61801 342.40878
7730.0000 -137.19290 -135.11950 2.07339 1.70237 -134.97888 320.03386
7735.0000 -137.48872 -134.69536 2.79336 1.69553 -135.07661 315.41977
7740.0000 -136.86574 -134.79316 2.07258 1.72445 -134.66349 345.16885
7745.0000 -137.44957 -135.08966 2.35991 1.72041 -134.72112 336.00026
7750.0000 -137.33360 -135.22341 2.11019 1.68828 -135.18027 307.81815
FREEZING PROCESS: loop number 32 T-loop= 307.00000000000000
main_MD> interactions number 32 at Temperature= 307.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.16010 -2.14988 -2.07631
force_rgl> df(natom) 0.90014 -1.27602 -0.00236
7755.0000 -137.37679 -135.78386 1.59294 1.66951 -135.44843 289.25805
7760.0000 -137.56626 -135.81133 1.75493 1.64423 -135.80949 264.98311
7765.0000 -137.73799 -135.89198 1.84601 1.63768 -135.90310 254.93189
7770.0000 -137.22371 -135.33646 1.88725 1.66757 -135.47612 284.82567
7775.0000 -137.33691 -135.29901 2.03790 1.67785 -135.32927 295.34682
7780.0000 -137.20078 -135.01346 2.18732 1.68912 -135.16816 304.01606
7785.0000 -137.22516 -134.70368 2.52148 1.69914 -135.02507 315.78788
7790.0000 -137.48950 -135.52373 1.96577 1.67702 -135.34108 293.75185
7795.0000 -137.52059 -134.87960 2.64099 1.69264 -135.11791 310.86996
7800.0000 -136.86017 -134.97844 1.88173 1.69703 -135.05513 312.81169
7805.0000 -137.24883 -135.04250 2.20634 1.69360 -135.10418 309.12478
7810.0000 -136.89379 -134.72895 2.16484 1.71109 -134.85435 329.61938
7815.0000 -137.16261 -135.37604 1.78656 1.67915 -135.31059 294.61606
7820.0000 -137.06690 -135.08940 1.97750 1.67970 -135.30284 295.96354
7825.0000 -136.95533 -134.90688 2.04844 1.70063 -135.00383 317.14750
7830.0000 -137.51981 -135.49573 2.02408 1.71056 -134.86195 326.40205
7835.0000 -137.30925 -134.97882 2.33043 1.68379 -135.24428 302.59970
7840.0000 -137.32700 -135.15115 2.17585 1.69308 -135.11156 309.53317
7845.0000 -137.01255 -134.88247 2.13008 1.70030 -135.00851 318.69894
7850.0000 -137.28981 -135.30068 1.98913 1.68265 -135.26067 297.47787
7855.0000 -137.28886 -135.46768 1.82118 1.67130 -135.42279 289.92648
7860.0000 -137.64318 -135.37969 2.26350 1.66252 -135.54823 281.20261
7865.0000 -137.24987 -135.20032 2.04956 1.69182 -135.12960 311.21129
7870.0000 -137.39174 -135.07922 2.31251 1.70873 -134.88799 324.11237
7875.0000 -137.25219 -135.04656 2.20563 1.70544 -134.93499 323.60836
7880.0000 -137.37507 -135.23278 2.14230 1.68453 -135.23381 300.92550
7885.0000 -137.56079 -135.37280 2.18800 1.68327 -135.25182 304.46937
7890.0000 -137.18703 -135.19884 1.98818 1.67898 -135.31311 297.64113
7895.0000 -137.42314 -135.26864 2.15451 1.68563 -135.21812 305.84327
7900.0000 -137.08749 -135.06364 2.02385 1.69597 -135.07028 313.73162
7905.0000 -137.61385 -135.40267 2.21118 1.69639 -135.06435 317.54032
7910.0000 -137.06810 -134.93520 2.13291 1.67793 -135.32814 295.71903
7915.0000 -137.20321 -134.69411 2.50909 1.70543 -134.93523 321.05205
7920.0000 -136.99450 -134.89772 2.09678 1.71259 -134.83293 327.30940
7925.0000 -137.37739 -135.04230 2.33508 1.70113 -134.99666 316.84690
7930.0000 -137.37374 -135.28468 2.08907 1.69851 -135.03410 314.08795
7935.0000 -137.35605 -135.11119 2.24486 1.67056 -135.43336 289.88953
7940.0000 -137.33579 -134.88106 2.45473 1.69915 -135.02496 318.67365
7945.0000 -137.31958 -135.22233 2.09725 1.69499 -135.08440 312.21701
7950.0000 -137.01118 -135.13415 1.87704 1.69817 -135.03897 318.37192
7955.0000 -137.09068 -135.22043 1.87024 1.68446 -135.23482 301.59706
7960.0000 -136.95416 -134.63558 2.31858 1.68839 -135.17862 305.06055
7965.0000 -137.02535 -135.05071 1.97463 1.71030 -134.86568 327.09249
7970.0000 -137.39033 -135.48036 1.90997 1.68206 -135.26902 298.99951
7975.0000 -137.58469 -135.46355 2.12114 1.66934 -135.45073 286.46353
7980.0000 -137.47278 -135.40878 2.06400 1.68494 -135.22787 304.86048
7985.0000 -137.08147 -134.57317 2.50829 1.69837 -135.03610 314.40019
7990.0000 -137.12671 -135.11659 2.01012 1.70998 -134.87014 326.20728
7995.0000 -137.58480 -135.36099 2.22381 1.68732 -135.19398 307.43988
8000.0000 -136.90153 -134.88463 2.01690 1.68963 -135.16097 308.16826
main_MD> EXECUTION TIME: 0 [day], 0 [hour], 9 [min], 12.7137786 [s].
main_MD> Deallocating global variables
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