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nanoparticlesims/growth_Melting_Silver_ICO_4091/freezeSims/run_66/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_66.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 = 66 ntipo2 = 0
read_input> Finish reading input
main_MD> Allocating global variables
main_MD> Number of outputs that will be created: 1550
main_MD> Size of nv and nvoiz: 66 6600
main_MD> Size of nv and nvoiz: 66 6600
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 = 66
main_MD> Consider changing parameter nsiz in module_parameters.f90 for performance
main_MD> collvar_wanted = F
main_MD> INPUT AND POTENTIAL FILE READING IS DONE
main_MD> THERMALIZATION IS STARTING
init> 0.17314198768608519 5.3061632460242196E-002 -8.8857669345502710E-002 initial drift of cluster / NP1 for coalescence
init> 0.31249212789215997 0.33482669597779885 0.26695723763833079 scaling for velocity /for coalescence NP1
init.f90 > facguy = 3.5544130142234061E-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) 5.53571 -4.26986 -4.76348
force_rgl> df(natom) -2.18774 1.92252 -2.82363
preparo> THERMALIZATION PROCESS AT 1100.2095599950303
preparo> TOTAL ENERGY, KINETIC EN., POT. ENERGY, DELTA
5000 -145.38336269284181 7.5348404335658126 -152.91820312640763 6.4473068489982884E-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 31
FREEZING PROCESS: loop number 1 T-loop= 1071.0000000000000
main_MD> interactions number 1 at Temperature= 1071.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.24415 2.69054 -0.59400
force_rgl> df(natom) 1.42730 -0.51206 -0.14274
5.0000 -155.08935 -145.58022 9.50913 2.97200 -146.16238 1118.50883
10.0000 -153.98719 -143.89952 10.08767 3.08635 -144.29487 1190.88973
15.0000 -157.09046 -147.62807 9.46239 3.01343 -145.48580 1165.88207
20.0000 -156.22684 -148.01253 8.21431 2.90604 -147.23971 1080.97871
25.0000 -155.78085 -145.62190 10.15895 2.93851 -146.70934 1107.25787
30.0000 -154.89749 -144.61531 10.28218 2.94581 -146.59019 1137.84669
35.0000 -155.40153 -146.13162 9.26992 3.05489 -144.80865 1150.89586
40.0000 -156.88254 -147.39007 9.49247 2.92594 -146.91461 1091.37863
45.0000 -155.99840 -146.67900 9.31940 2.94689 -146.57252 1085.97010
50.0000 -156.50668 -148.34449 8.16219 2.94656 -146.57797 1112.87812
55.0000 -157.70948 -149.35249 8.35698 2.79856 -148.99504 1026.09079
60.0000 -157.33174 -147.44915 9.88259 2.79320 -149.08251 1024.04523
65.0000 -156.32398 -148.65703 7.66695 2.84205 -148.28466 1022.74269
70.0000 -157.47484 -147.69809 9.77675 2.84270 -148.27413 1036.64054
75.0000 -157.58704 -148.07429 9.51275 2.95213 -146.48689 1158.90115
80.0000 -156.40856 -146.68016 9.72840 2.90977 -147.17870 1099.16126
85.0000 -156.76128 -148.22533 8.53596 2.82886 -148.50018 1017.69595
90.0000 -156.76454 -146.42585 10.33869 2.90163 -147.31161 1099.47742
95.0000 -154.06953 -144.88414 9.18538 2.97332 -146.14086 1099.36382
100.0000 -156.72250 -145.19124 11.53126 3.05074 -144.87652 1192.37656
105.0000 -154.04061 -144.56043 9.48018 3.02677 -145.26795 1169.54248
110.0000 -157.09401 -147.40699 9.68702 3.01624 -145.43992 1165.50545
115.0000 -157.04489 -148.28023 8.76466 2.91732 -147.05536 1104.17007
120.0000 -157.31272 -148.34417 8.96855 2.83061 -148.47161 1029.72020
125.0000 -156.89080 -147.94842 8.94238 2.87696 -147.71461 1096.55511
130.0000 -159.22181 -149.37992 9.84189 2.82805 -148.51343 1050.11050
135.0000 -156.97598 -148.43361 8.54237 2.82924 -148.49391 1029.32087
140.0000 -155.02757 -146.31209 8.71548 2.94448 -146.61186 1119.14501
145.0000 -156.52741 -147.39274 9.13468 2.91567 -147.08238 1082.32846
150.0000 -155.52240 -145.21209 10.31032 3.01510 -145.45859 1139.10269
155.0000 -156.53276 -146.51000 10.02277 2.97343 -146.13908 1148.29472
160.0000 -157.06143 -146.64651 10.41492 2.94281 -146.63917 1120.86057
165.0000 -156.39290 -146.20068 10.19223 2.93568 -146.75556 1078.17857
170.0000 -156.06020 -146.63228 9.42792 2.89631 -147.39862 1075.80123
175.0000 -159.18153 -150.14172 9.03981 2.75070 -149.77667 991.33326
180.0000 -157.33894 -149.24825 8.09069 2.77712 -149.34505 983.54640
185.0000 -156.74882 -148.34622 8.40260 2.82396 -148.58022 1020.84689
190.0000 -155.96725 -147.57133 8.39591 2.86933 -147.83918 1039.48405
195.0000 -157.29564 -149.43021 7.86544 2.79460 -149.05970 993.19612
200.0000 -157.67808 -149.63704 8.04104 2.75306 -149.73799 992.46769
205.0000 -156.14097 -147.06378 9.07719 2.81039 -148.80183 1018.97275
210.0000 -156.55951 -148.26064 8.29886 2.87342 -147.77235 1052.25189
215.0000 -156.01545 -146.97921 9.03624 2.90878 -147.19485 1094.56258
220.0000 -155.38091 -147.17287 8.20804 2.97642 -146.09016 1101.06237
225.0000 -156.65472 -147.25456 9.40016 2.91955 -147.01906 1054.37150
230.0000 -156.21062 -147.94654 8.26408 2.98538 -145.94390 1162.73487
235.0000 -158.12875 -149.27234 8.85641 2.78956 -149.14201 987.45575
240.0000 -158.98820 -148.05511 10.93309 2.77130 -149.44013 1020.56686
245.0000 -156.65164 -147.75007 8.90158 2.85596 -148.05747 1048.05506
250.0000 -156.38420 -146.71508 9.66912 2.85926 -148.00373 1048.72942
FREEZING PROCESS: loop number 2 T-loop= 1046.0000000000000
main_MD> interactions number 2 at Temperature= 1046.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.21875 0.48931 -7.21294
force_rgl> df(natom) 0.37906 -0.71749 3.19303
255.0000 -156.13245 -145.82233 10.31012 2.97798 -146.06474 1121.84268
260.0000 -156.72010 -147.44992 9.27018 2.96837 -146.22175 1090.58553
265.0000 -156.70394 -147.42316 9.28078 2.92102 -146.99508 1088.15288
270.0000 -157.70649 -147.91322 9.79326 2.84359 -148.25964 1052.01246
275.0000 -156.41390 -147.62212 8.79178 2.82659 -148.53723 1044.12068
280.0000 -157.60785 -149.55922 8.04862 2.81973 -148.64925 1016.18661
285.0000 -154.75028 -147.33753 7.41275 2.82298 -148.59608 1025.74142
290.0000 -156.93470 -146.13350 10.80120 2.90364 -147.27883 1052.52670
295.0000 -157.77440 -147.99364 9.78076 2.88870 -147.52285 1045.13424
300.0000 -157.75050 -149.11644 8.63406 2.86236 -147.95300 1065.83570
305.0000 -156.87490 -146.77123 10.10367 2.89426 -147.43210 1062.19984
310.0000 -157.81348 -150.06633 7.74714 2.83899 -148.33474 1047.69254
315.0000 -157.10262 -148.63443 8.46819 2.76803 -149.49365 981.97475
320.0000 -157.99190 -148.89482 9.09707 2.76827 -149.48969 997.60075
325.0000 -155.88758 -146.44963 9.43796 2.84230 -148.28057 1035.69592
330.0000 -155.63739 -147.75783 7.87956 2.89868 -147.35989 1082.26286
335.0000 -157.14737 -148.54891 8.59846 2.85448 -148.08177 1035.30785
340.0000 -158.01798 -148.94098 9.07700 2.79111 -149.11660 1016.13390
345.0000 -157.42797 -147.23934 10.18863 2.90935 -147.18559 1054.42836
350.0000 -156.99358 -149.89442 7.09917 2.79326 -149.08161 1001.96596
355.0000 -157.46741 -147.84944 9.61798 2.82375 -148.58362 1025.33410
360.0000 -157.63833 -147.82033 9.81801 2.82382 -148.58240 1030.16287
365.0000 -156.13427 -146.81261 9.32167 2.89752 -147.37878 1055.50185
370.0000 -155.72951 -145.84933 9.88018 2.98085 -146.01793 1156.82009
375.0000 -157.63114 -148.16927 9.46187 2.88321 -147.61256 1069.76042
380.0000 -158.26716 -149.62795 8.63921 2.74799 -149.82079 997.37423
385.0000 -157.61095 -147.45061 10.16035 2.82498 -148.56347 1054.40898
390.0000 -156.35256 -148.79770 7.55486 2.80407 -148.90501 1003.75502
395.0000 -157.83594 -147.85619 9.97975 2.84616 -148.21767 1037.24977
400.0000 -153.85922 -145.30738 8.55184 2.91454 -147.10087 1077.96726
405.0000 -155.18068 -145.63466 9.54601 3.01922 -145.39129 1165.40011
410.0000 -155.90991 -147.95513 7.95478 2.95865 -146.38039 1118.66087
415.0000 -158.34045 -147.22823 11.11222 2.88564 -147.57278 1090.48230
420.0000 -157.54002 -147.52951 10.01051 2.94144 -146.66156 1120.64356
425.0000 -159.24960 -150.54790 8.70170 2.79719 -149.01728 1010.23269
430.0000 -156.82301 -148.93547 7.88754 2.72629 -150.17530 962.95313
435.0000 -156.81061 -145.74353 11.06708 2.88728 -147.54597 1062.96091
440.0000 -156.04094 -146.99622 9.04472 2.89688 -147.38923 1077.75545
445.0000 -154.46158 -144.95081 9.51077 2.97506 -146.11237 1117.80499
450.0000 -156.22821 -146.51215 9.71605 2.95991 -146.35983 1101.51551
455.0000 -155.41099 -147.29602 8.11497 2.86572 -147.89813 1037.13951
460.0000 -158.04462 -148.34123 9.70339 2.81502 -148.72613 994.95129
465.0000 -157.12130 -148.17975 8.94155 2.87791 -147.69905 1045.64540
470.0000 -158.98280 -149.18920 9.79360 2.76600 -149.52676 953.90771
475.0000 -156.89599 -147.94760 8.94839 2.83125 -148.46105 1033.53871
480.0000 -155.83127 -146.41810 9.41317 2.85581 -148.05992 1060.17674
485.0000 -157.25493 -149.32020 7.93472 2.85643 -148.04995 1035.92150
490.0000 -157.70253 -148.94043 8.76211 2.76944 -149.47053 986.62568
495.0000 -156.64450 -148.60006 8.04444 2.77957 -149.30506 976.83533
500.0000 -156.59428 -148.65573 7.93855 2.81947 -148.65347 1007.64760
FREEZING PROCESS: loop number 3 T-loop= 1021.0000000000000
main_MD> interactions number 3 at Temperature= 1021.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.30870 1.38230 2.92292
force_rgl> df(natom) -2.50316 -3.15790 5.23558
505.0000 -157.18048 -147.63919 9.54129 2.88343 -147.60888 1055.84862
510.0000 -156.68994 -147.96856 8.72138 2.82355 -148.58679 1033.22270
515.0000 -156.99809 -147.96215 9.03594 2.86590 -147.89513 1057.65108
520.0000 -156.84962 -147.74704 9.10258 2.82786 -148.51641 1035.09573
525.0000 -158.82159 -148.56967 10.25192 2.88040 -147.65833 1059.61224
530.0000 -158.26990 -149.97201 8.29789 2.81034 -148.80253 1009.70017
535.0000 -158.24692 -150.25845 7.98846 2.72265 -150.23464 926.66433
540.0000 -156.72006 -149.32673 7.39333 2.78500 -149.21639 1022.65480
545.0000 -157.10738 -146.82046 10.28692 2.84513 -148.23447 1041.95775
550.0000 -155.71852 -146.86936 8.84915 2.94168 -146.65768 1089.72074
555.0000 -155.73188 -146.45842 9.27346 2.96065 -146.34778 1134.29383
560.0000 -155.98362 -145.33994 10.64369 2.97756 -146.07167 1111.56223
565.0000 -155.73775 -147.74333 7.99441 2.99866 -145.72703 1130.51221
570.0000 -156.34070 -147.29884 9.04186 2.94155 -146.65975 1100.50052
575.0000 -157.06616 -148.24170 8.82447 2.85256 -148.11306 1052.75231
580.0000 -157.56769 -149.14002 8.42768 2.81787 -148.67960 1043.37566
585.0000 -157.74199 -150.23474 7.50725 2.72417 -150.20981 933.48559
590.0000 -158.45589 -149.93511 8.52077 2.76994 -149.46242 960.17799
595.0000 -157.32319 -149.66570 7.65748 2.70685 -150.49273 940.62251
600.0000 -158.12328 -148.17003 9.95325 2.82019 -148.64167 1025.86126
605.0000 -158.68780 -150.31159 8.37621 2.76513 -149.54100 977.92164
610.0000 -158.69663 -150.23838 8.45825 2.74596 -149.85405 960.75190
615.0000 -157.65154 -148.56243 9.08910 2.79469 -149.05821 1002.62861
620.0000 -158.53865 -148.70311 9.83554 2.78812 -149.16553 973.38258
625.0000 -158.57215 -148.79679 9.77536 2.80266 -148.92805 1000.37831
630.0000 -156.05379 -147.63700 8.41679 2.83071 -148.46993 1030.93939
635.0000 -157.78443 -148.58041 9.20402 2.81615 -148.70767 1029.05321
640.0000 -155.90100 -147.12433 8.77667 2.89362 -147.44249 1058.69943
645.0000 -155.64840 -146.17635 9.47204 2.98460 -145.95661 1108.74992
650.0000 -157.06483 -148.12213 8.94270 2.97842 -146.05750 1134.89025
655.0000 -156.34740 -148.15123 8.19617 2.88013 -147.66282 1051.33077
660.0000 -157.93917 -149.31187 8.62730 2.82102 -148.62809 1010.61135
665.0000 -157.85467 -148.32925 9.52542 2.81982 -148.64781 999.26954
670.0000 -158.08609 -149.49095 8.59514 2.77786 -149.33308 1024.32608
675.0000 -156.94373 -148.75335 8.19037 2.74711 -149.83523 957.01247
680.0000 -158.20049 -148.89125 9.30924 2.86232 -147.95361 1058.31453
685.0000 -156.00776 -147.67206 8.33570 2.79817 -149.00137 992.75420
690.0000 -155.29314 -145.51186 9.78128 2.91969 -147.01675 1105.82856
695.0000 -154.45458 -146.24731 8.20726 2.95956 -146.36563 1118.29316
700.0000 -155.84040 -145.58191 10.25849 3.03871 -145.07293 1165.01439
705.0000 -156.72620 -148.42974 8.29646 2.92366 -146.95183 1061.44008
710.0000 -158.31021 -149.13923 9.17098 2.84346 -148.26164 1048.15533
715.0000 -157.95294 -149.90659 8.04635 2.78269 -149.25420 1013.22516
720.0000 -156.54822 -148.37414 8.17408 2.78191 -149.26694 969.38668
725.0000 -158.82466 -149.64149 9.18317 2.76055 -149.61578 996.68628
730.0000 -157.21847 -148.21817 9.00030 2.78043 -149.29099 1013.43376
735.0000 -157.56643 -147.36076 10.20566 2.79880 -148.99099 1007.30260
740.0000 -156.94954 -148.18997 8.75957 2.90173 -147.31001 1086.43297
745.0000 -158.01166 -148.42173 9.58993 2.79656 -149.02766 978.48914
750.0000 -156.70327 -148.30533 8.39794 2.81472 -148.73106 1034.42713
FREEZING PROCESS: loop number 4 T-loop= 996.00000000000000
main_MD> interactions number 4 at Temperature= 996.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 11.76420 -3.16303 -7.41035
force_rgl> df(natom) 1.32098 -0.09598 -1.56479
755.0000 -158.30800 -149.62856 8.67944 2.81192 -148.77671 1023.00461
760.0000 -159.30268 -149.78892 9.51376 2.78423 -149.22894 1000.09111
765.0000 -157.35885 -148.69033 8.66852 2.76676 -149.51425 995.13856
770.0000 -157.71073 -148.92278 8.78795 2.78964 -149.14061 1004.17335
775.0000 -156.34426 -148.09479 8.24947 2.81979 -148.64821 982.78471
780.0000 -156.60479 -148.44466 8.16013 2.86731 -147.87221 1049.32680
785.0000 -158.02753 -148.10343 9.92410 2.75455 -149.71367 996.49817
790.0000 -156.82649 -148.32197 8.50452 2.91146 -147.15114 1068.04569
795.0000 -157.69844 -149.51702 8.18141 2.81668 -148.69906 1022.72408
800.0000 -159.49638 -149.83622 9.66016 2.73740 -149.99381 954.87400
805.0000 -157.32442 -148.63842 8.68601 2.75439 -149.71634 981.68438
810.0000 -157.82327 -150.46859 7.35468 2.78412 -149.23073 977.26731
815.0000 -156.90002 -148.20471 8.69531 2.81843 -148.67051 1011.62069
820.0000 -157.52297 -149.81081 7.71216 2.82275 -148.59992 1040.63911
825.0000 -157.70521 -148.93790 8.76731 2.73916 -149.96514 957.72342
830.0000 -158.97404 -149.59851 9.37553 2.79935 -148.98204 999.86500
835.0000 -157.26018 -148.12798 9.13220 2.78256 -149.25629 1018.89057
840.0000 -158.51856 -150.30972 8.20883 2.77369 -149.40118 998.12241
845.0000 -157.89479 -149.89875 7.99604 2.72857 -150.13798 972.13956
850.0000 -158.69165 -149.87113 8.82051 2.72399 -150.21281 952.31743
855.0000 -158.02329 -149.82018 8.20312 2.80262 -148.92864 1018.96118
860.0000 -156.28690 -147.28998 8.99692 2.83991 -148.31969 997.32209
865.0000 -157.29913 -149.00343 8.29570 2.82281 -148.59899 1043.24044
870.0000 -158.86812 -150.02504 8.84308 2.73271 -150.07041 954.06143
875.0000 -157.19806 -148.76514 8.43293 2.75326 -149.73475 956.80199
880.0000 -157.55777 -149.24900 8.30877 2.82456 -148.57043 1023.40496
885.0000 -156.40132 -148.40225 7.99907 2.81481 -148.72964 996.16708
890.0000 -156.99193 -148.53886 8.45307 2.81869 -148.66628 1008.30816
895.0000 -157.41814 -148.23354 9.18460 2.81872 -148.66567 1009.58154
900.0000 -156.86579 -147.94552 8.92027 2.83548 -148.39194 1056.74036
905.0000 -157.70983 -148.51568 9.19415 2.87811 -147.69587 1086.38714
910.0000 -158.45719 -150.23524 8.22195 2.74049 -149.94339 943.51176
915.0000 -157.03295 -147.97266 9.06029 2.80605 -148.87264 1020.54993
920.0000 -158.21709 -150.04325 8.17384 2.74882 -149.80737 991.96677
925.0000 -157.49899 -149.30100 8.19799 2.74561 -149.85974 932.99726
930.0000 -158.08003 -149.72784 8.35220 2.80008 -148.97018 976.86721
935.0000 -158.12038 -150.30591 7.81447 2.74692 -149.83833 999.86863
940.0000 -156.76020 -148.73862 8.02159 2.75845 -149.64998 966.26540
945.0000 -159.79685 -149.99164 9.80521 2.76411 -149.55760 960.34802
950.0000 -157.86268 -149.04134 8.82134 2.74508 -149.86832 944.95588
955.0000 -158.25608 -149.37351 8.88257 2.78242 -149.25856 972.84291
960.0000 -159.48955 -149.44448 10.04508 2.70528 -150.51840 931.09742
965.0000 -156.39719 -148.17642 8.22077 2.78583 -149.20291 993.05495
970.0000 -154.49542 -146.38090 8.11451 2.90015 -147.33588 1033.87027
975.0000 -157.19116 -148.27394 8.91722 2.86810 -147.85922 1023.47519
980.0000 -155.51224 -146.09291 9.41933 2.90688 -147.22599 1088.23683
985.0000 -156.18502 -147.17328 9.01174 2.93522 -146.76309 1109.30200
990.0000 -155.95635 -146.70861 9.24774 2.84866 -148.17676 1037.23404
995.0000 -155.22470 -146.59551 8.62918 2.96268 -146.31470 1100.85203
1000.0000 -154.73515 -146.35113 8.38402 2.99269 -145.82455 1123.13329
FREEZING PROCESS: loop number 5 T-loop= 971.00000000000000
main_MD> interactions number 5 at Temperature= 971.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -2.49221 3.11263 2.73629
force_rgl> df(natom) 0.03239 0.04300 1.59677
1005.0000 -157.86115 -148.80641 9.05475 2.86205 -147.95802 1055.19628
1010.0000 -155.03812 -148.60890 6.42922 2.78924 -149.14718 999.93684
1015.0000 -156.83556 -148.94973 7.88583 2.85503 -148.07269 1015.02779
1020.0000 -156.53221 -149.37989 7.15232 2.79522 -149.04956 974.89393
1025.0000 -155.89678 -146.82142 9.07536 2.82326 -148.59159 1037.25424
1030.0000 -156.62979 -148.25802 8.37177 2.86036 -147.98572 1059.09124
1035.0000 -158.81652 -150.67778 8.13874 2.79664 -149.02631 1000.35267
1040.0000 -159.00591 -151.23081 7.77510 2.64484 -151.50547 913.19107
1045.0000 -158.03140 -149.91530 8.11610 2.74080 -149.93827 973.11562
1050.0000 -156.93723 -149.10449 7.83275 2.73926 -149.96342 967.86014
1055.0000 -156.96577 -148.00228 8.96349 2.85583 -148.05970 1021.45528
1060.0000 -157.80160 -148.72782 9.07377 2.81857 -148.66813 1033.57327
1065.0000 -158.46289 -150.22309 8.23980 2.76799 -149.49431 1023.88378
1070.0000 -159.64436 -152.31708 7.32728 2.66337 -151.20280 921.54431
1075.0000 -159.64889 -151.56769 8.08120 2.64702 -151.46990 915.01375
1080.0000 -157.07121 -149.76225 7.30896 2.66822 -151.12361 916.72206
1085.0000 -156.02074 -146.19745 9.82329 2.83080 -148.46848 1035.67602
1090.0000 -157.52528 -149.47224 8.05304 2.81875 -148.66523 1002.76135
1095.0000 -158.78061 -150.43107 8.34954 2.73540 -150.02656 920.48173
1100.0000 -159.13921 -150.23003 8.90918 2.73397 -150.04977 967.84198
1105.0000 -156.83619 -149.29707 7.53912 2.72800 -150.14731 929.81436
1110.0000 -156.20825 -145.11629 11.09196 2.92131 -146.99024 1052.82340
1115.0000 -156.36729 -146.26320 10.10409 2.98716 -145.91489 1109.20518
1120.0000 -156.50471 -147.77989 8.72482 2.91083 -147.16141 1017.82876
1125.0000 -157.18279 -148.80232 8.38048 2.88464 -147.58919 1051.13521
1130.0000 -157.20745 -147.69997 9.50748 2.80038 -148.96529 1039.83382
1135.0000 -157.85663 -149.54418 8.31245 2.85746 -148.03303 1069.83274
1140.0000 -159.88190 -151.68531 8.19659 2.63208 -151.71384 902.88970
1145.0000 -158.31778 -150.95617 7.36160 2.66063 -151.24761 928.35321
1150.0000 -159.34580 -151.93123 7.41457 2.65795 -151.29136 914.41624
1155.0000 -160.56207 -153.18911 7.37295 2.55770 -152.92863 863.03707
1160.0000 -160.43813 -152.08052 8.35760 2.58588 -152.46839 890.43576
1165.0000 -158.58442 -151.42212 7.16231 2.66152 -151.23307 902.62230
1170.0000 -158.07392 -150.76066 7.31326 2.65332 -151.36697 902.70951
1175.0000 -159.50886 -150.40511 9.10374 2.70806 -150.47304 947.39235
1180.0000 -158.16890 -149.75675 8.41215 2.69713 -150.65151 932.92154
1185.0000 -157.22399 -148.32283 8.90116 2.80975 -148.81223 1022.78927
1190.0000 -158.29177 -150.01507 8.27670 2.82270 -148.60069 1028.11228
1195.0000 -158.15058 -149.79655 8.35403 2.73530 -150.02806 946.51555
1200.0000 -156.42060 -147.52339 8.89721 2.83821 -148.34748 1026.61162
1205.0000 -158.81346 -149.24424 9.56922 2.85095 -148.13944 1053.32238
1210.0000 -159.31392 -151.00252 8.31141 2.70005 -150.60384 943.62596
1215.0000 -159.58258 -151.69614 7.88645 2.64471 -151.50765 879.93721
1220.0000 -158.18972 -150.08819 8.10153 2.68280 -150.88551 920.40127
1225.0000 -157.78945 -149.19824 8.59120 2.76577 -149.53044 993.41482
1230.0000 -156.64679 -149.55151 7.09528 2.80663 -148.86320 999.23334
1235.0000 -155.88601 -148.47446 7.41156 2.81257 -148.76618 963.27050
1240.0000 -158.25120 -148.85530 9.39590 2.85783 -148.02695 1030.14625
1245.0000 -158.90981 -150.20205 8.70776 2.73114 -150.09598 963.71220
1250.0000 -158.59804 -149.40290 9.19515 2.74663 -149.84309 984.51298
FREEZING PROCESS: loop number 6 T-loop= 946.00000000000000
main_MD> interactions number 6 at Temperature= 946.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.33389 -0.74580 2.21428
force_rgl> df(natom) -2.46413 -1.74569 0.95815
1255.0000 -156.38506 -147.51754 8.86752 2.87909 -147.67986 1028.62376
1260.0000 -158.18837 -148.23656 9.95181 2.83187 -148.45091 1021.15072
1265.0000 -158.15466 -149.52936 8.62529 2.83197 -148.44929 1037.47430
1270.0000 -157.81326 -147.33687 10.47639 2.85852 -148.01571 1043.86281
1275.0000 -156.70542 -148.34626 8.35916 2.85472 -148.07781 1041.96065
1280.0000 -158.59250 -150.27810 8.31440 2.76579 -149.53015 981.20686
1285.0000 -158.60467 -150.09805 8.50662 2.76110 -149.60680 948.25146
1290.0000 -158.51603 -151.79716 6.71888 2.66350 -151.20067 883.80146
1295.0000 -159.33279 -151.21912 8.11367 2.62840 -151.77405 884.81511
1300.0000 -156.79665 -148.58822 8.20843 2.76411 -149.55762 963.47810
1305.0000 -159.80660 -151.25892 8.54768 2.75996 -149.62546 1007.33354
1310.0000 -158.65724 -150.97073 7.68651 2.65857 -151.28117 920.48831
1315.0000 -159.36684 -151.53920 7.82765 2.62812 -151.77861 850.40538
1320.0000 -158.45603 -150.59759 7.85845 2.70764 -150.47981 901.04604
1325.0000 -157.43881 -148.42986 9.00895 2.75101 -149.77147 981.48040
1330.0000 -157.79829 -149.89112 7.90717 2.76195 -149.59292 981.59994
1335.0000 -158.24570 -149.59380 8.65190 2.78581 -149.20323 951.26582
1340.0000 -157.28890 -148.78450 8.50440 2.75176 -149.75936 973.33191
1345.0000 -159.07314 -151.35953 7.71361 2.73455 -150.04039 949.40134
1350.0000 -158.79648 -151.92065 6.87583 2.64733 -151.46476 908.60177
1355.0000 -157.33632 -149.74629 7.59003 2.71742 -150.32020 917.63762
1360.0000 -159.18948 -149.88136 9.30813 2.72318 -150.22602 935.31729
1365.0000 -158.56200 -150.89010 7.67190 2.71136 -150.41911 933.88393
1370.0000 -156.51500 -148.66409 7.85091 2.72035 -150.27230 937.39366
1375.0000 -158.69101 -148.93405 9.75696 2.74651 -149.84500 991.84461
1380.0000 -158.97719 -151.04496 7.93223 2.69818 -150.63436 936.05727
1385.0000 -158.99561 -151.25547 7.74014 2.72493 -150.19743 948.47334
1390.0000 -158.53519 -150.72051 7.81468 2.69730 -150.64876 939.23001
1395.0000 -157.92475 -151.04580 6.87895 2.67968 -150.93650 938.99794
1400.0000 -158.53560 -151.60131 6.93429 2.65496 -151.34024 906.35258
1405.0000 -159.93284 -151.49929 8.43356 2.72294 -150.22994 952.21027
1410.0000 -156.71895 -148.84196 7.87698 2.71480 -150.36296 943.19028
1415.0000 -158.50285 -151.07459 7.42826 2.73186 -150.08423 937.73167
1420.0000 -160.02289 -151.45476 8.56814 2.66704 -151.14287 929.85771
1425.0000 -158.69718 -150.94665 7.75053 2.66487 -151.17833 897.88923
1430.0000 -160.61985 -152.26299 8.35686 2.60042 -152.23100 879.20039
1435.0000 -159.56824 -152.28263 7.28562 2.65073 -151.40935 890.88038
1440.0000 -158.16847 -151.23664 6.93183 2.62336 -151.85633 900.33175
1445.0000 -160.41094 -152.80945 7.60149 2.59657 -152.29378 876.21575
1450.0000 -158.00529 -149.77226 8.23303 2.66551 -151.16791 920.96268
1455.0000 -157.72233 -149.59244 8.12990 2.79641 -149.03002 1016.71951
1460.0000 -159.64580 -150.91491 8.73089 2.75963 -149.63083 953.61209
1465.0000 -159.47305 -150.39437 9.07868 2.73155 -150.08932 962.14304
1470.0000 -157.89253 -149.98624 7.90629 2.74686 -149.83924 966.32711
1475.0000 -159.75286 -151.93820 7.81466 2.61786 -151.94616 842.35774
1480.0000 -157.51045 -148.98763 8.52282 2.66308 -151.20756 906.30105
1485.0000 -159.14955 -151.58506 7.56449 2.77191 -149.43022 974.30589
1490.0000 -156.26942 -148.13392 8.13550 2.72805 -150.14658 969.37757
1495.0000 -157.14754 -147.72687 9.42067 2.90673 -147.22843 1092.29200
1500.0000 -156.56994 -148.24906 8.32088 2.83811 -148.34907 1027.57887
FREEZING PROCESS: loop number 7 T-loop= 921.00000000000000
main_MD> interactions number 7 at Temperature= 921.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.17217 -3.77204 1.07146
force_rgl> df(natom) 0.42686 1.58402 2.01054
1505.0000 -156.30071 -149.81764 6.48306 2.77176 -149.43261 955.84224
1510.0000 -158.05350 -150.52485 7.52865 2.67427 -151.02478 867.63621
1515.0000 -157.68127 -150.99572 6.68555 2.67274 -151.04978 931.97717
1520.0000 -158.28040 -150.91762 7.36278 2.67237 -151.05590 911.14057
1525.0000 -158.48389 -151.93087 6.55301 2.60016 -152.23521 850.92845
1530.0000 -159.38826 -151.10531 8.28294 2.68495 -150.85038 911.51019
1535.0000 -158.63578 -149.50733 9.12845 2.69192 -150.73659 957.30815
1540.0000 -157.82804 -150.06035 7.76768 2.78203 -149.26495 987.60585
1545.0000 -158.83097 -148.85247 9.97850 2.73407 -150.04827 944.49164
1550.0000 -159.14583 -150.54540 8.60043 2.73937 -149.96169 961.70623
1555.0000 -158.64946 -149.57203 9.07743 2.68221 -150.89522 923.25532
1560.0000 -157.03644 -148.17537 8.86106 2.81847 -148.66979 1007.18922
1565.0000 -159.39358 -151.70050 7.69308 2.73819 -149.98090 945.73763
1570.0000 -157.62353 -150.23196 7.39157 2.70346 -150.54814 932.48404
1575.0000 -157.57443 -149.42562 8.14880 2.73093 -150.09947 960.77965
1580.0000 -159.62609 -151.46972 8.15637 2.65239 -151.38225 903.62708
1585.0000 -159.91225 -152.92904 6.98321 2.57201 -152.69488 803.29635
1590.0000 -157.02005 -150.13283 6.88722 2.63138 -151.72522 875.47483
1595.0000 -158.03879 -150.48463 7.55416 2.74401 -149.88590 935.06161
1600.0000 -158.94591 -151.49025 7.45566 2.69530 -150.68134 914.96120
1605.0000 -160.20629 -151.81885 8.38744 2.66053 -151.24931 906.97311
1610.0000 -158.66941 -150.34435 8.32506 2.64820 -151.45056 887.59343
1615.0000 -159.69256 -151.33197 8.36058 2.69062 -150.75785 907.87111
1620.0000 -157.77847 -150.05649 7.72198 2.68301 -150.88217 891.72312
1625.0000 -158.49977 -150.78104 7.71873 2.72338 -150.22280 953.56824
1630.0000 -157.52538 -149.47253 8.05285 2.70232 -150.56680 927.72593
1635.0000 -159.58333 -151.05259 8.53074 2.73204 -150.08139 958.39748
1640.0000 -159.24998 -150.81062 8.43936 2.69445 -150.69525 932.31745
1645.0000 -158.81734 -151.69652 7.12082 2.65045 -151.41393 920.49174
1650.0000 -156.70819 -147.38722 9.32098 2.75593 -149.69120 1008.12774
1655.0000 -157.15022 -148.76648 8.38375 2.88561 -147.57324 1073.14394
1660.0000 -158.63579 -151.15347 7.48231 2.77172 -149.43330 983.18905
1665.0000 -159.19676 -150.92026 8.27650 2.68520 -150.84635 922.20978
1670.0000 -157.70340 -150.62541 7.07799 2.73736 -149.99452 963.56433
1675.0000 -158.81879 -150.46902 8.34977 2.73237 -150.07592 950.16412
1680.0000 -158.29410 -150.40494 7.88916 2.71647 -150.33567 917.17009
1685.0000 -159.15012 -151.01873 8.13139 2.70476 -150.52692 937.52769
1690.0000 -158.62292 -150.70554 7.91738 2.60317 -152.18593 875.24573
1695.0000 -157.75426 -149.49639 8.25787 2.72003 -150.27745 945.19632
1700.0000 -160.07715 -152.40530 7.67185 2.69364 -150.70851 918.10211
1705.0000 -159.34372 -152.04079 7.30294 2.59569 -152.30819 836.08640
1710.0000 -159.70977 -153.08904 6.62073 2.55702 -152.93965 811.17659
1715.0000 -159.43578 -151.88127 7.55450 2.58799 -152.43400 840.19828
1720.0000 -159.86070 -152.55253 7.30817 2.61485 -151.99533 886.76096
1725.0000 -161.00164 -152.88634 8.11531 2.57554 -152.63728 861.11851
1730.0000 -160.39892 -152.85152 7.54741 2.60434 -152.16685 906.95862
1735.0000 -159.33114 -150.68971 8.64143 2.60834 -152.10162 878.32022
1740.0000 -157.39966 -150.44396 6.95570 2.73057 -150.10538 936.73971
1745.0000 -157.64783 -150.61180 7.03603 2.71559 -150.35008 951.25134
1750.0000 -158.99470 -151.30161 7.69309 2.70436 -150.53335 934.88869
FREEZING PROCESS: loop number 8 T-loop= 896.00000000000000
main_MD> interactions number 8 at Temperature= 896.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.88054 0.60611 0.63787
force_rgl> df(natom) 0.95647 3.12819 1.35788
1755.0000 -159.20517 -152.17267 7.03250 2.65786 -151.29290 893.86391
1760.0000 -158.64574 -150.47767 8.16807 2.66961 -151.10100 890.83912
1765.0000 -160.52050 -151.57754 8.94296 2.65855 -151.28152 922.35988
1770.0000 -158.50116 -152.05346 6.44769 2.63808 -151.61590 885.64406
1775.0000 -160.58423 -153.14751 7.43672 2.56488 -152.81133 859.73306
1780.0000 -159.42568 -152.54031 6.88537 2.52330 -153.49039 837.92556
1785.0000 -160.63005 -153.21542 7.41463 2.56379 -152.82908 867.94401
1790.0000 -160.93574 -153.87335 7.06239 2.56542 -152.80250 852.78894
1795.0000 -161.02715 -152.66075 8.36640 2.52157 -153.51863 806.83063
1800.0000 -159.36812 -152.36040 7.00772 2.58642 -152.45949 852.47226
1805.0000 -160.29906 -152.32722 7.97184 2.58649 -152.45847 860.87974
1810.0000 -160.81599 -152.45851 8.35748 2.62588 -151.81515 881.19345
1815.0000 -157.41255 -149.47945 7.93310 2.68246 -150.89102 924.85848
1820.0000 -161.10683 -152.45839 8.64844 2.73012 -150.11279 957.63585
1825.0000 -158.22410 -151.37868 6.84543 2.61838 -151.93766 898.95532
1830.0000 -159.48903 -151.88364 7.60539 2.68172 -150.90310 902.03552
1835.0000 -160.18123 -152.32805 7.85319 2.62425 -151.84180 880.24153
1840.0000 -159.64899 -151.85112 7.79787 2.61239 -152.03539 885.04339
1845.0000 -159.02770 -150.34276 8.68494 2.70089 -150.59014 954.22237
1850.0000 -158.30526 -151.01206 7.29319 2.67219 -151.05888 936.98811
1855.0000 -158.44984 -150.29236 8.15748 2.72739 -150.15731 918.69993
1860.0000 -160.25397 -150.98924 9.26473 2.67567 -151.00195 949.58732
1865.0000 -159.46085 -151.91951 7.54134 2.60615 -152.13739 851.38744
1870.0000 -158.91712 -150.57183 8.34529 2.63514 -151.66381 904.41722
1875.0000 -159.42909 -152.97568 6.45341 2.65372 -151.36040 902.66501
1880.0000 -160.84899 -153.09836 7.75063 2.57177 -152.69883 853.29638
1885.0000 -159.54728 -151.65119 7.89610 2.56180 -152.86160 830.68952
1890.0000 -157.64514 -149.76988 7.87526 2.72567 -150.18534 962.24108
1895.0000 -158.47912 -151.09972 7.37941 2.74350 -149.89427 977.44161
1900.0000 -157.29437 -149.66301 7.63136 2.70695 -150.49119 925.01230
1905.0000 -159.41901 -151.01958 8.39943 2.70236 -150.56600 934.18128
1910.0000 -158.56361 -150.26315 8.30046 2.63543 -151.65921 880.30879
1915.0000 -158.13745 -149.32496 8.81249 2.78331 -149.24396 985.66823
1920.0000 -157.64240 -149.86080 7.78160 2.75320 -149.73584 973.87894
1925.0000 -157.96887 -150.55677 7.41210 2.74434 -149.88044 930.06508
1930.0000 -157.04770 -149.24099 7.80671 2.75660 -149.68026 931.91810
1935.0000 -158.65804 -151.69015 6.96789 2.70727 -150.48582 936.82577
1940.0000 -159.83406 -150.90929 8.92477 2.66566 -151.16552 914.93377
1945.0000 -160.58492 -152.48537 8.09956 2.63750 -151.62542 922.99881
1950.0000 -160.02262 -153.04745 6.97518 2.56785 -152.76291 854.30572
1955.0000 -159.72211 -153.53424 6.18787 2.56162 -152.86467 843.27016
1960.0000 -159.97596 -152.89577 7.08019 2.54649 -153.11167 794.40253
1965.0000 -160.55090 -153.34513 7.20577 2.56331 -152.83699 856.26654
1970.0000 -161.25239 -154.89087 6.36152 2.50544 -153.78207 813.70366
1975.0000 -160.55297 -153.38621 7.16676 2.50290 -153.82356 809.45150
1980.0000 -159.27316 -152.15570 7.11746 2.59080 -152.38797 847.97384
1985.0000 -160.02114 -152.59526 7.42588 2.55410 -152.98744 821.49605
1990.0000 -160.60110 -151.39147 9.20963 2.62593 -151.81436 888.54410
1995.0000 -159.98863 -153.11403 6.87460 2.61031 -152.06936 872.98183
2000.0000 -159.27633 -151.79830 7.47803 2.59795 -152.27120 863.10682
FREEZING PROCESS: loop number 9 T-loop= 871.00000000000000
main_MD> interactions number 9 at Temperature= 871.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 3.61734 5.49141 3.77863
force_rgl> df(natom) 2.41534 -0.73889 2.61325
2005.0000 -160.84880 -151.54738 9.30142 2.63452 -151.67394 905.26861
2010.0000 -159.89486 -153.27172 6.62314 2.62346 -151.85472 864.43346
2015.0000 -159.67482 -152.07169 7.60313 2.54977 -153.05806 850.09692
2020.0000 -158.72196 -150.99546 7.72649 2.62614 -151.81086 878.52188
2025.0000 -159.35731 -152.03902 7.31828 2.60629 -152.13499 840.59732
2030.0000 -159.93383 -154.00619 5.92765 2.55394 -152.98996 823.03570
2035.0000 -160.87394 -154.85182 6.02212 2.43079 -155.00121 752.39514
2040.0000 -160.75195 -152.59300 8.15895 2.55683 -152.94290 830.91513
2045.0000 -159.44234 -152.08081 7.36153 2.55811 -152.92196 851.76531
2050.0000 -160.07269 -152.75039 7.32230 2.56233 -152.85302 853.87210
2055.0000 -159.31070 -151.56027 7.75043 2.60028 -152.23318 890.52955
2060.0000 -157.86801 -149.75391 8.11410 2.71589 -150.34518 974.37804
2065.0000 -159.56183 -152.58227 6.97956 2.68642 -150.82648 922.23472
2070.0000 -159.90649 -151.85176 8.05473 2.62450 -151.83772 867.20279
2075.0000 -159.34594 -152.24292 7.10302 2.60919 -152.08775 853.09275
2080.0000 -159.77421 -152.61562 7.15859 2.54192 -153.18632 811.19630
2085.0000 -160.47944 -151.32520 9.15425 2.59294 -152.35316 864.92047
2090.0000 -161.03836 -153.51909 7.51927 2.54974 -153.05856 843.60695
2095.0000 -159.37130 -151.46189 7.90941 2.60919 -152.08778 867.91121
2100.0000 -159.16614 -152.60523 6.56091 2.62045 -151.90388 861.41132
2105.0000 -160.73651 -152.74553 7.99099 2.57318 -152.67578 837.15998
2110.0000 -160.34326 -154.41284 5.93042 2.52396 -153.47960 798.92129
2115.0000 -159.78127 -152.93675 6.84452 2.57670 -152.61825 859.32952
2120.0000 -159.94626 -152.63261 7.31365 2.56898 -152.74436 845.44592
2125.0000 -160.36322 -152.40191 7.96132 2.60597 -152.14035 871.72650
2130.0000 -159.76039 -151.59244 8.16795 2.60851 -152.09884 872.58538
2135.0000 -160.05338 -152.72233 7.33105 2.58973 -152.40556 837.19072
2140.0000 -159.31430 -152.89925 6.41506 2.53572 -153.28753 822.71452
2145.0000 -159.54238 -152.61484 6.92755 2.57066 -152.71701 864.03790
2150.0000 -160.41121 -152.19125 8.21996 2.58380 -152.50240 859.88351
2155.0000 -160.42731 -151.57474 8.85257 2.64976 -151.42512 898.91580
2160.0000 -159.81841 -152.82530 6.99312 2.58841 -152.42709 854.57926
2165.0000 -159.65515 -153.70342 5.95172 2.50556 -153.78019 794.40293
2170.0000 -159.15397 -152.21775 6.93622 2.52696 -153.43073 790.44237
2175.0000 -158.69905 -151.40181 7.29725 2.64035 -151.57888 880.64879
2180.0000 -160.84004 -153.11710 7.72293 2.58801 -152.43366 857.15877
2185.0000 -160.20144 -153.73360 6.46784 2.54259 -153.17545 839.92844
2190.0000 -159.96943 -153.16928 6.80016 2.51502 -153.62565 843.79563
2195.0000 -161.31907 -154.11359 7.20548 2.50621 -153.76955 840.71576
2200.0000 -160.22034 -153.07313 7.14721 2.47503 -154.27880 792.33073
2205.0000 -158.40727 -151.54961 6.85766 2.64787 -151.45596 912.68881
2210.0000 -160.71157 -153.10430 7.60727 2.61268 -152.03065 863.95071
2215.0000 -160.51582 -153.18541 7.33041 2.52999 -153.38123 836.06058
2220.0000 -160.75139 -153.62225 7.12914 2.52875 -153.40134 828.85950
2225.0000 -160.23531 -153.42010 6.81522 2.53317 -153.32916 827.39562
2230.0000 -160.32353 -153.99484 6.32869 2.54282 -153.17162 853.85759
2235.0000 -159.38049 -152.20284 7.17765 2.48434 -154.12674 781.62687
2240.0000 -158.60595 -150.83425 7.77170 2.63706 -151.63258 884.01891
2245.0000 -158.33761 -149.51287 8.82473 2.72047 -150.27027 944.81327
2250.0000 -158.04500 -149.23651 8.80849 2.76871 -149.48256 998.02093
FREEZING PROCESS: loop number 10 T-loop= 846.00000000000000
main_MD> interactions number 10 at Temperature= 846.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 5.94649 -2.80921 4.68976
force_rgl> df(natom) -1.98841 2.67686 2.22368
2255.0000 -158.64685 -149.63367 9.01318 2.77048 -149.45365 968.56068
2260.0000 -159.71894 -151.49943 8.21951 2.68441 -150.85927 927.91119
2265.0000 -160.19950 -152.71564 7.48385 2.60811 -152.10536 881.60253
2270.0000 -160.22336 -153.23060 6.99276 2.49728 -153.91530 807.72585
2275.0000 -160.43680 -154.19258 6.24422 2.46422 -154.45532 787.58903
2280.0000 -159.74983 -152.58384 7.16599 2.51867 -153.56610 793.13177
2285.0000 -161.12824 -154.13447 6.99377 2.51911 -153.55878 812.47047
2290.0000 -160.87337 -155.08593 5.78743 2.46273 -154.47960 804.98420
2295.0000 -161.80910 -155.16519 6.64391 2.45648 -154.58175 783.35501
2300.0000 -161.16506 -155.23405 5.93101 2.42937 -155.02451 771.61883
2305.0000 -160.70143 -153.25039 7.45104 2.52064 -153.53383 811.75154
2310.0000 -160.02664 -152.57605 7.45059 2.53184 -153.35089 800.20606
2315.0000 -160.36453 -153.43180 6.93273 2.52058 -153.53490 813.46365
2320.0000 -160.11724 -152.39276 7.72448 2.53665 -153.27242 837.63115
2325.0000 -160.23775 -152.22904 8.00871 2.58377 -152.50281 828.01835
2330.0000 -160.60456 -152.11230 8.49226 2.62022 -151.90748 877.91969
2335.0000 -159.37958 -151.93708 7.44251 2.60954 -152.08205 903.52533
2340.0000 -161.94903 -154.78658 7.16245 2.55063 -153.04409 804.05005
2345.0000 -161.17578 -154.18511 6.99067 2.44947 -154.69612 805.51278
2350.0000 -161.96954 -155.52431 6.44523 2.42441 -155.10548 762.58307
2355.0000 -162.34035 -156.41150 5.92885 2.41775 -155.21420 779.36157
2360.0000 -161.69857 -154.90108 6.79749 2.38941 -155.67711 760.49608
2365.0000 -160.00961 -153.10305 6.90656 2.48959 -154.04096 797.95426
2370.0000 -159.84119 -152.52879 7.31239 2.50895 -153.72473 802.77528
2375.0000 -160.71090 -153.03725 7.67365 2.57993 -152.56557 841.96788
2380.0000 -159.87005 -153.07348 6.79658 2.56098 -152.87512 857.19029
2385.0000 -160.01314 -152.43545 7.57769 2.52503 -153.46213 813.38109
2390.0000 -160.46594 -153.14870 7.31724 2.56407 -152.82458 851.07264
2395.0000 -160.58829 -154.10974 6.47854 2.52047 -153.53657 835.92013
2400.0000 -160.95932 -153.38098 7.57833 2.50872 -153.72860 813.17712
2405.0000 -161.52388 -154.61450 6.90939 2.48171 -154.16961 788.35775
2410.0000 -160.55961 -152.79486 7.76474 2.48117 -154.17842 801.38838
2415.0000 -159.78289 -152.67599 7.10690 2.53834 -153.24480 843.96599
2420.0000 -160.79909 -153.56010 7.23899 2.49506 -153.95160 807.91107
2425.0000 -158.34494 -150.73768 7.60726 2.60814 -152.10490 864.98103
2430.0000 -158.40360 -149.78556 8.61804 2.69538 -150.68004 941.03439
2435.0000 -158.87381 -150.16423 8.70958 2.73968 -149.95653 923.68536
2440.0000 -160.27526 -152.91671 7.35854 2.67430 -151.02427 924.59546
2445.0000 -159.72115 -153.09769 6.62346 2.56249 -152.85036 866.29736
2450.0000 -160.46195 -153.72786 6.73409 2.55277 -153.00915 840.45032
2455.0000 -160.76072 -154.42199 6.33873 2.49596 -153.93694 802.70625
2460.0000 -160.31671 -153.66427 6.65244 2.45867 -154.54598 761.59948
2465.0000 -159.56517 -152.64162 6.92355 2.55905 -152.90664 829.86239
2470.0000 -159.68383 -153.08311 6.60072 2.58946 -152.40997 846.34715
2475.0000 -158.44636 -151.32069 7.12567 2.61350 -152.01732 885.52459
2480.0000 -159.94052 -151.99205 7.94847 2.65170 -151.39347 896.52155
2485.0000 -159.11949 -152.01828 7.10121 2.58162 -152.53797 847.26579
2490.0000 -158.88230 -152.11882 6.76349 2.59632 -152.29792 853.31596
2495.0000 -159.45005 -152.08612 7.36393 2.57611 -152.62798 838.13462
2500.0000 -159.51957 -151.31515 8.20443 2.61706 -151.95913 841.10564
FREEZING PROCESS: loop number 11 T-loop= 821.00000000000000
main_MD> interactions number 11 at Temperature= 821.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.63885 1.60242 -1.83267
force_rgl> df(natom) 0.24134 -3.67098 2.43673
2505.0000 -158.74851 -153.19581 5.55270 2.60097 -152.22191 879.93098
2510.0000 -161.39517 -154.64086 6.75431 2.46079 -154.51139 774.66428
2515.0000 -159.00538 -151.75410 7.25128 2.49445 -153.96161 825.04629
2520.0000 -160.35849 -152.72344 7.63505 2.61853 -151.93518 897.31458
2525.0000 -162.40001 -156.01318 6.38683 2.42079 -155.16460 752.22797
2530.0000 -162.21255 -156.03184 6.18071 2.41352 -155.28335 755.02817
2535.0000 -161.42020 -155.67487 5.74533 2.39904 -155.51978 744.16303
2540.0000 -160.85729 -154.54338 6.31391 2.43754 -154.89109 746.90651
2545.0000 -160.59811 -154.05837 6.53973 2.48801 -154.06670 797.82196
2550.0000 -161.40301 -153.83564 7.56737 2.51933 -153.55532 816.61074
2555.0000 -159.72825 -153.37433 6.35392 2.52237 -153.50564 798.81182
2560.0000 -159.70354 -152.49883 7.20471 2.53391 -153.31720 819.55855
2565.0000 -160.05840 -152.93238 7.12602 2.58819 -152.43070 880.23831
2570.0000 -159.93557 -153.52730 6.40827 2.56459 -152.81616 811.64875
2575.0000 -158.13512 -151.48373 6.65139 2.59043 -152.39407 849.25658
2580.0000 -159.42821 -151.09152 8.33669 2.62102 -151.89447 894.68816
2585.0000 -161.14690 -154.32137 6.82553 2.57198 -152.69536 858.77298
2590.0000 -161.07043 -154.08920 6.98122 2.49300 -153.98535 808.90811
2595.0000 -159.84282 -153.77536 6.06746 2.50752 -153.74806 776.19761
2600.0000 -160.71502 -153.92207 6.79294 2.50486 -153.79152 797.47075
2605.0000 -160.55791 -153.50988 7.04804 2.56509 -152.80795 857.54099
2610.0000 -161.08796 -153.33585 7.75211 2.53514 -153.29708 812.38259
2615.0000 -161.67147 -153.97891 7.69256 2.48282 -154.15151 814.92375
2620.0000 -161.73145 -154.91945 6.81200 2.49767 -153.90898 801.73546
2625.0000 -161.39257 -154.74335 6.64923 2.46766 -154.39909 775.87884
2630.0000 -159.27141 -152.79543 6.47598 2.52674 -153.43425 825.06762
2635.0000 -158.44474 -149.97739 8.46736 2.65025 -151.41706 882.28684
2640.0000 -160.39259 -153.61985 6.77274 2.63383 -151.68528 883.41903
2645.0000 -160.59473 -154.50043 6.09430 2.50052 -153.86240 799.77047
2650.0000 -159.95721 -152.39025 7.56696 2.51648 -153.60184 802.39827
2655.0000 -159.35471 -152.97520 6.37951 2.63021 -151.74443 882.09200
2660.0000 -160.36304 -153.58519 6.77785 2.54562 -153.12583 816.78569
2665.0000 -161.54353 -153.91177 7.63175 2.52506 -153.46167 849.59593
2670.0000 -161.82502 -155.34660 6.47841 2.46557 -154.43323 818.60743
2675.0000 -160.38509 -152.95513 7.42996 2.42755 -155.05417 754.12820
2680.0000 -160.53638 -153.99633 6.54005 2.51715 -153.59088 803.06235
2685.0000 -160.19723 -153.08581 7.11142 2.55248 -153.01388 826.20359
2690.0000 -159.71475 -152.99573 6.71902 2.58882 -152.42045 842.63746
2695.0000 -160.18941 -150.71223 9.47718 2.61172 -152.04631 890.81594
2700.0000 -160.74743 -153.78619 6.96124 2.60240 -152.19853 875.44380
2705.0000 -161.49295 -154.48045 7.01250 2.48150 -154.17306 789.38314
2710.0000 -160.96552 -154.02603 6.93949 2.48070 -154.18621 778.95768
2715.0000 -160.29717 -153.38030 6.91687 2.47629 -154.25822 783.50780
2720.0000 -160.85913 -153.22406 7.63506 2.54579 -153.12318 829.88272
2725.0000 -161.29839 -153.37435 7.92404 2.52029 -153.53952 804.96796
2730.0000 -159.30604 -153.73901 5.56703 2.48900 -154.05067 791.88754
2735.0000 -160.53085 -152.59818 7.93267 2.53530 -153.29439 812.69290
2740.0000 -160.10026 -153.34080 6.75947 2.53595 -153.28389 814.98767
2745.0000 -159.76705 -152.28907 7.47798 2.55984 -152.89374 854.68354
2750.0000 -159.74244 -153.45118 6.29126 2.57604 -152.62916 827.13755
FREEZING PROCESS: loop number 12 T-loop= 796.00000000000000
main_MD> interactions number 12 at Temperature= 796.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.61240 0.49281 1.97926
force_rgl> df(natom) -0.64639 3.81176 3.20510
2755.0000 -159.67882 -151.13001 8.54881 2.59580 -152.30644 882.19420
2760.0000 -161.22347 -155.01495 6.20852 2.55289 -153.00722 823.13894
2765.0000 -161.18010 -155.65705 5.52305 2.39651 -155.56109 747.59722
2770.0000 -163.05971 -157.15368 5.90603 2.29096 -157.28488 666.16890
2775.0000 -161.71328 -155.62292 6.09036 2.33565 -156.55501 685.31672
2780.0000 -161.80730 -155.16804 6.63925 2.40530 -155.41757 751.52814
2785.0000 -160.53855 -153.36822 7.17033 2.49377 -153.97271 818.18769
2790.0000 -159.98807 -153.24104 6.74703 2.51095 -153.69215 824.96247
2795.0000 -162.20188 -155.10357 7.09831 2.47624 -154.25896 815.83457
2800.0000 -160.48079 -153.66680 6.81399 2.45031 -154.68247 772.01647
2805.0000 -160.89019 -154.18246 6.70773 2.48957 -154.04127 780.66505
2810.0000 -160.25030 -152.81593 7.43437 2.47235 -154.32249 784.51291
2815.0000 -159.45655 -152.19831 7.25823 2.66253 -151.21657 915.90363
2820.0000 -161.23650 -154.09658 7.13993 2.55367 -152.99438 868.25631
2825.0000 -162.43133 -155.06039 7.37095 2.47238 -154.32211 796.39794
2830.0000 -160.91115 -154.20846 6.70269 2.45464 -154.61173 771.01252
2835.0000 -161.37549 -154.60807 6.76742 2.49782 -153.90649 758.35420
2840.0000 -162.04036 -156.59712 5.44324 2.38623 -155.72895 720.96129
2845.0000 -161.23588 -154.91240 6.32348 2.39971 -155.50879 739.83912
2850.0000 -161.06267 -153.86941 7.19326 2.48117 -154.17840 792.53901
2855.0000 -161.00488 -154.78165 6.22323 2.41927 -155.18948 764.67028
2860.0000 -162.22146 -155.80031 6.42115 2.38431 -155.76035 699.18257
2865.0000 -160.65513 -152.70614 7.94899 2.46070 -154.51274 780.87045
2870.0000 -161.24535 -154.31151 6.93384 2.56640 -152.78645 863.69517
2875.0000 -160.56807 -154.11647 6.45160 2.47272 -154.31652 798.14158
2880.0000 -161.49126 -154.09023 7.40103 2.48101 -154.18110 794.38819
2885.0000 -159.80170 -153.34853 6.45317 2.54594 -153.12062 847.74250
2890.0000 -161.85412 -154.72118 7.13294 2.48084 -154.18388 785.20466
2895.0000 -161.27024 -154.51084 6.75940 2.41340 -155.28525 728.13159
2900.0000 -161.76558 -153.64615 8.11942 2.46137 -154.50176 776.23770
2905.0000 -160.30584 -154.15553 6.15032 2.46602 -154.42593 779.57174
2910.0000 -159.38389 -152.50520 6.87869 2.51355 -153.64961 818.70581
2915.0000 -160.17944 -154.53989 5.63955 2.55498 -152.97304 828.75570
2920.0000 -161.35127 -155.66604 5.68523 2.46438 -154.45270 774.49536
2925.0000 -161.89109 -155.26668 6.62441 2.39752 -155.54465 744.15516
2930.0000 -160.70279 -153.90955 6.79323 2.47379 -154.29896 790.04557
2935.0000 -161.73599 -155.67014 6.06585 2.47302 -154.31163 778.82294
2940.0000 -161.40827 -155.55358 5.85469 2.38867 -155.68914 737.45040
2945.0000 -160.96317 -153.78889 7.17428 2.46451 -154.45057 796.35675
2950.0000 -159.78595 -153.54608 6.23987 2.54598 -153.11995 828.42797
2955.0000 -161.23927 -153.40207 7.83720 2.52837 -153.40756 842.60612
2960.0000 -158.79165 -152.60558 6.18607 2.59623 -152.29930 851.09617
2965.0000 -160.01803 -152.00637 8.01166 2.54331 -153.16369 833.60110
2970.0000 -160.42207 -153.46748 6.95458 2.55232 -153.01644 838.04354
2975.0000 -160.53152 -153.87987 6.65166 2.51324 -153.65471 802.02126
2980.0000 -160.02055 -153.36368 6.65687 2.56041 -152.88436 850.65442
2985.0000 -160.83616 -153.55137 7.28479 2.46618 -154.42326 784.30582
2990.0000 -159.53937 -152.71017 6.82920 2.52414 -153.47665 817.06366
2995.0000 -161.04854 -153.75872 7.28982 2.49310 -153.98362 781.92615
3000.0000 -161.54078 -154.81990 6.72088 2.49664 -153.92588 816.37991
FREEZING PROCESS: loop number 13 T-loop= 771.00000000000000
main_MD> interactions number 13 at Temperature= 771.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.76157 -0.00437 3.35017
force_rgl> df(natom) 3.16167 -3.68244 -4.87545
3005.0000 -161.15703 -155.06354 6.09349 2.44344 -154.79461 750.98294
3010.0000 -161.73787 -155.39806 6.33981 2.46306 -154.47420 786.48601
3015.0000 -161.96874 -156.10750 5.86123 2.35630 -156.21784 689.74777
3020.0000 -161.75000 -155.67508 6.07493 2.41244 -155.30098 770.67384
3025.0000 -161.20409 -154.45512 6.74897 2.43060 -155.00436 776.82711
3030.0000 -161.09353 -154.49423 6.59930 2.47128 -154.34003 797.15337
3035.0000 -161.73288 -155.09286 6.64002 2.50537 -153.78322 786.17764
3040.0000 -162.61281 -155.66115 6.95166 2.41686 -155.22874 760.46156
3045.0000 -161.75910 -155.76677 5.99233 2.36940 -156.00385 711.04353
3050.0000 -161.86838 -155.54400 6.32438 2.43637 -154.91010 758.64556
3055.0000 -161.82706 -155.88267 5.94438 2.37495 -155.91327 714.08704
3060.0000 -160.80385 -155.36088 5.44297 2.44234 -154.81270 771.34214
3065.0000 -161.74150 -155.33642 6.40508 2.40391 -155.44022 729.04754
3070.0000 -161.75828 -155.42606 6.33222 2.43438 -154.94270 756.78814
3075.0000 -162.03988 -154.78244 7.25744 2.46111 -154.50612 804.82468
3080.0000 -161.15389 -154.57520 6.57869 2.44722 -154.73300 761.68639
3085.0000 -160.92095 -155.16612 5.75483 2.45604 -154.58881 770.16865
3090.0000 -161.95673 -154.96851 6.98822 2.40853 -155.36486 755.89328
3095.0000 -163.22708 -156.79534 6.43174 2.39468 -155.59093 733.21755
3100.0000 -162.33952 -156.19439 6.14512 2.34756 -156.36048 669.38839
3105.0000 -162.44110 -156.44180 5.99930 2.32883 -156.66644 698.49378
3110.0000 -161.27575 -155.45722 5.81852 2.40137 -155.48179 716.33427
3115.0000 -162.28262 -155.20266 7.07996 2.44059 -154.84119 760.53477
3120.0000 -160.57341 -154.35669 6.21672 2.45866 -154.54603 750.47455
3125.0000 -161.72028 -156.18122 5.53906 2.46298 -154.47551 739.75483
3130.0000 -161.15399 -155.15902 5.99497 2.39385 -155.60455 702.70247
3135.0000 -160.45436 -153.40035 7.05401 2.46879 -154.38064 766.99742
3140.0000 -160.96650 -154.41040 6.55610 2.49803 -153.90307 807.18380
3145.0000 -161.61903 -154.83941 6.77962 2.46601 -154.42612 763.45900
3150.0000 -161.19837 -152.94140 8.25697 2.50917 -153.72124 814.78650
3155.0000 -160.30544 -154.44053 5.86491 2.53251 -153.33994 821.49767
3160.0000 -161.39858 -153.54030 7.85829 2.47708 -154.24520 772.58540
3165.0000 -160.86387 -153.94512 6.91874 2.50606 -153.77200 817.94238
3170.0000 -161.12819 -154.27559 6.85260 2.45770 -154.56179 777.72281
3175.0000 -162.16508 -155.14812 7.01696 2.46706 -154.40893 808.13899
3180.0000 -160.30625 -154.43236 5.87389 2.42544 -155.08857 758.12799
3185.0000 -159.78948 -152.84927 6.94021 2.53161 -153.35464 849.09867
3190.0000 -160.73518 -152.31441 8.42077 2.53962 -153.22386 827.56362
3195.0000 -161.24115 -155.07575 6.16540 2.49385 -153.97135 762.82560
3200.0000 -161.88197 -155.04505 6.83692 2.44062 -154.84078 755.78027
3205.0000 -161.47384 -155.06895 6.40489 2.40838 -155.36721 732.41572
3210.0000 -162.15226 -155.35225 6.80001 2.43250 -154.97330 779.66170
3215.0000 -161.04187 -156.09778 4.94410 2.39095 -155.65197 720.75865
3220.0000 -160.73690 -154.55612 6.18077 2.41857 -155.20083 747.33700
3225.0000 -161.09687 -154.08724 7.00964 2.48065 -154.18697 793.90232
3230.0000 -161.67519 -155.97814 5.69705 2.45290 -154.64022 781.68301
3235.0000 -160.31172 -153.93132 6.38039 2.41189 -155.30996 720.91929
3240.0000 -161.44510 -155.47669 5.96840 2.49466 -153.95822 800.76683
3245.0000 -161.87311 -154.80680 7.06632 2.42327 -155.12410 765.94866
3250.0000 -160.43824 -154.71037 5.72787 2.43416 -154.94624 743.36071
FREEZING PROCESS: loop number 14 T-loop= 746.00000000000000
main_MD> interactions number 14 at Temperature= 746.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.72527 -1.87452 0.72203
force_rgl> df(natom) 0.31411 0.74398 -0.88847
3255.0000 -159.25928 -152.79811 6.46117 2.56123 -152.87096 812.07975
3260.0000 -160.55097 -152.79056 7.76040 2.54096 -153.20201 837.82345
3265.0000 -160.43087 -154.32664 6.10423 2.50597 -153.77342 798.49311
3270.0000 -161.94133 -155.52203 6.41930 2.43597 -154.91667 746.14248
3275.0000 -160.89582 -155.79503 5.10079 2.41530 -155.25419 739.45995
3280.0000 -161.10322 -155.45393 5.64929 2.43001 -155.01398 720.61450
3285.0000 -162.43543 -156.16084 6.27459 2.39149 -155.64306 727.58035
3290.0000 -161.16749 -155.62564 5.54185 2.39144 -155.64389 727.81355
3295.0000 -161.04212 -155.18322 5.85891 2.41889 -155.19565 755.24937
3300.0000 -159.87400 -153.62249 6.25151 2.45636 -154.58370 773.06908
3305.0000 -162.47306 -156.38714 6.08592 2.44677 -154.74035 760.84824
3310.0000 -162.07788 -157.04138 5.03650 2.33125 -156.62698 691.02494
3315.0000 -162.37485 -156.81441 5.56044 2.30387 -157.07414 676.73779
3320.0000 -162.55985 -156.43192 6.12792 2.34469 -156.40748 695.19057
3325.0000 -162.26768 -156.22569 6.04200 2.34782 -156.35631 694.24952
3330.0000 -162.23940 -155.88565 6.35376 2.34157 -156.45833 704.53368
3335.0000 -161.98396 -156.40539 5.57857 2.37043 -155.98700 732.93133
3340.0000 -161.94366 -154.71319 7.23046 2.32189 -156.77979 713.33026
3345.0000 -161.70440 -155.06696 6.63744 2.42220 -155.14150 743.73147
3350.0000 -160.88766 -155.21236 5.67529 2.40867 -155.36253 749.81192
3355.0000 -162.38568 -155.92154 6.46414 2.39374 -155.60627 740.94266
3360.0000 -163.08974 -155.48047 7.60926 2.42302 -155.12823 763.37932
3365.0000 -162.03481 -155.49997 6.53484 2.41320 -155.28859 767.92838
3370.0000 -161.59229 -154.31532 7.27697 2.42304 -155.12780 751.69686
3375.0000 -161.31672 -153.76288 7.55384 2.52210 -153.51007 827.23396
3380.0000 -159.34971 -153.08882 6.26088 2.54545 -153.12876 812.24261
3385.0000 -160.02274 -154.60690 5.41584 2.52295 -153.49621 781.67230
3390.0000 -161.81514 -156.71294 5.10220 2.39616 -155.56681 683.51082
3395.0000 -161.73432 -155.39684 6.33748 2.34621 -156.38266 678.05792
3400.0000 -161.02374 -154.87677 6.14696 2.42208 -155.14357 758.12693
3405.0000 -162.13556 -156.40529 5.73027 2.40240 -155.46488 741.70266
3410.0000 -160.85702 -154.02407 6.83295 2.44622 -154.74918 757.67443
3415.0000 -162.05220 -155.36448 6.68772 2.42357 -155.11916 730.45244
3420.0000 -161.52405 -155.02345 6.50060 2.39445 -155.59483 721.35499
3425.0000 -161.44339 -155.67168 5.77171 2.40654 -155.39732 723.22322
3430.0000 -162.46549 -156.38351 6.08197 2.38599 -155.73298 744.28218
3435.0000 -162.91904 -157.09823 5.82081 2.30492 -157.05696 682.24263
3440.0000 -163.14716 -155.98198 7.16519 2.36910 -156.00872 739.58495
3445.0000 -161.77579 -156.21193 5.56386 2.37186 -155.96363 715.51012
3450.0000 -161.12172 -154.79540 6.32632 2.41507 -155.25803 739.22493
3455.0000 -160.90729 -154.50404 6.40325 2.41958 -155.18438 728.99068
3460.0000 -161.03411 -154.66683 6.36727 2.45165 -154.66065 748.58386
3465.0000 -161.85294 -155.06573 6.78721 2.42201 -155.14468 765.14425
3470.0000 -162.65386 -155.98849 6.66537 2.41430 -155.27063 735.96024
3475.0000 -160.86498 -154.85735 6.00762 2.47713 -154.24451 782.19649
3480.0000 -163.40489 -156.26417 7.14072 2.43221 -154.97809 740.41190
3485.0000 -161.82324 -156.23028 5.59297 2.37455 -155.91969 699.37655
3490.0000 -160.68429 -155.43895 5.24534 2.34147 -156.46008 659.48570
3495.0000 -160.79449 -154.70439 6.09010 2.45835 -154.55118 777.90448
3500.0000 -161.17223 -155.35544 5.81680 2.43834 -154.87801 755.63738
FREEZING PROCESS: loop number 15 T-loop= 721.00000000000000
main_MD> interactions number 15 at Temperature= 721.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.25354 0.11407 -2.35396
force_rgl> df(natom) -2.89247 2.79498 0.70023
3505.0000 -160.86381 -154.32702 6.53679 2.42592 -155.08085 720.90583
3510.0000 -162.02906 -156.75609 5.27297 2.36850 -156.01860 723.08667
3515.0000 -161.90116 -156.78870 5.11246 2.35318 -156.26876 702.30750
3520.0000 -161.17527 -155.19593 5.97934 2.36999 -155.99423 679.91505
3525.0000 -161.98590 -155.38873 6.59717 2.39069 -155.65610 736.61595
3530.0000 -163.45446 -157.37259 6.08188 2.33409 -156.58045 677.35089
3535.0000 -162.64060 -157.73984 4.90076 2.28036 -157.45804 675.02335
3540.0000 -162.79255 -156.69585 6.09670 2.29163 -157.27395 661.32980
3545.0000 -163.17536 -157.33235 5.84301 2.29664 -157.19221 687.11776
3550.0000 -163.36092 -157.12543 6.23549 2.29639 -157.19624 671.24148
3555.0000 -161.57308 -155.14246 6.43062 2.37738 -155.87356 757.57973
3560.0000 -161.96926 -156.17904 5.79021 2.36297 -156.10888 690.73128
3565.0000 -161.38867 -155.47718 5.91149 2.36624 -156.05543 731.23733
3570.0000 -162.18080 -156.81954 5.36125 2.33597 -156.54975 687.22041
3575.0000 -161.59054 -155.84265 5.74789 2.35408 -156.25400 696.81699
3580.0000 -161.04973 -154.56917 6.48056 2.43363 -154.95492 746.64641
3585.0000 -161.17793 -155.03450 6.14343 2.46550 -154.43443 780.44956
3590.0000 -161.50352 -153.99102 7.51250 2.48355 -154.13968 777.50985
3595.0000 -162.29202 -155.59771 6.69430 2.41433 -155.27003 740.78797
3600.0000 -160.87174 -154.37854 6.49320 2.43907 -154.86605 759.35250
3605.0000 -161.69192 -155.19229 6.49963 2.41116 -155.32184 717.37400
3610.0000 -160.08927 -153.68193 6.40733 2.46924 -154.37337 805.14544
3615.0000 -160.88027 -154.56702 6.31325 2.48978 -154.03780 819.73923
3620.0000 -161.17651 -154.86825 6.30826 2.44109 -154.83305 768.96427
3625.0000 -161.79588 -156.59455 5.20133 2.35255 -156.27904 705.99314
3630.0000 -161.27879 -154.93241 6.34638 2.35102 -156.30403 693.55894
3635.0000 -161.99742 -156.03240 5.96502 2.41864 -155.19964 757.26498
3640.0000 -162.28124 -154.89685 7.38440 2.42045 -155.17017 753.58972
3645.0000 -162.29567 -156.43646 5.85921 2.33959 -156.49073 667.20102
3650.0000 -162.93658 -157.49250 5.44408 2.30483 -157.05834 650.72242
3655.0000 -163.21073 -157.15170 6.05903 2.30800 -157.00656 674.63219
3660.0000 -161.82524 -155.58939 6.23585 2.32447 -156.73757 675.36168
3665.0000 -161.27848 -154.86072 6.41776 2.38282 -155.78473 716.53360
3670.0000 -160.78961 -154.50346 6.28615 2.42936 -155.02465 717.13791
3675.0000 -162.91465 -156.97559 5.93906 2.41141 -155.31776 694.86592
3680.0000 -162.44279 -157.09176 5.35104 2.33124 -156.62712 664.86170
3685.0000 -163.08104 -156.75316 6.32788 2.28118 -157.44468 662.66553
3690.0000 -162.62377 -156.82242 5.80135 2.34757 -156.36040 710.10403
3695.0000 -162.40749 -156.74526 5.66222 2.31795 -156.84406 681.91656
3700.0000 -161.39535 -155.69529 5.70006 2.36031 -156.15233 708.06658
3705.0000 -162.58386 -155.85506 6.72880 2.44323 -154.79803 739.06062
3710.0000 -162.53782 -156.99494 5.54288 2.34893 -156.33818 706.38162
3715.0000 -162.69729 -156.18827 6.50902 2.33538 -156.55943 710.99660
3720.0000 -161.89950 -155.69613 6.20337 2.37978 -155.83431 743.41469
3725.0000 -163.23800 -157.93475 5.30326 2.33585 -156.55186 685.50556
3730.0000 -162.62821 -157.52606 5.10215 2.25091 -157.93895 609.81169
3735.0000 -162.65535 -154.56256 8.09279 2.34733 -156.36428 693.28709
3740.0000 -161.31540 -155.04227 6.27313 2.45159 -154.66162 756.46571
3745.0000 -161.73718 -155.81409 5.92310 2.40596 -155.40681 742.40936
3750.0000 -160.23829 -154.13125 6.10704 2.41558 -155.24974 734.95173
FREEZING PROCESS: loop number 16 T-loop= 696.00000000000000
main_MD> interactions number 16 at Temperature= 696.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.00988 2.53751 1.17625
force_rgl> df(natom) -0.80315 0.47166 3.02565
3755.0000 -159.69529 -153.62690 6.06838 2.47383 -154.29842 758.49684
3760.0000 -161.83543 -155.85377 5.98166 2.46029 -154.51940 749.25363
3765.0000 -162.89782 -156.43490 6.46292 2.36883 -156.01315 718.80135
3770.0000 -162.40514 -156.95011 5.45504 2.30853 -156.99800 677.91864
3775.0000 -163.66927 -158.68576 4.98351 2.23197 -158.24830 632.51962
3780.0000 -163.49342 -158.76471 4.72871 2.19520 -158.84882 619.58209
3785.0000 -162.24836 -156.95362 5.29474 2.24161 -158.09088 642.00313
3790.0000 -163.47163 -157.30354 6.16810 2.32383 -156.74811 682.23794
3795.0000 -162.74862 -157.19490 5.55373 2.30276 -157.09215 663.44928
3800.0000 -161.62743 -155.81590 5.81153 2.34671 -156.37450 685.96644
3805.0000 -162.89053 -157.66653 5.22400 2.31007 -156.97283 679.40871
3810.0000 -162.64390 -157.95194 4.69196 2.26073 -157.77868 635.43377
3815.0000 -163.60491 -157.65400 5.95091 2.25754 -157.83072 659.67786
3820.0000 -163.46585 -158.07820 5.38765 2.23781 -158.15290 649.15907
3825.0000 -162.49822 -157.04516 5.45305 2.25301 -157.90474 653.59766
3830.0000 -161.26228 -155.24387 6.01840 2.38731 -155.71132 736.73496
3835.0000 -162.53164 -157.14901 5.38264 2.34654 -156.37719 719.13091
3840.0000 -163.48048 -157.72965 5.75083 2.28802 -157.33288 653.84853
3845.0000 -162.74804 -156.31000 6.43803 2.33975 -156.48813 702.95148
3850.0000 -163.37081 -157.96712 5.40369 2.28122 -157.44399 675.46179
3855.0000 -164.12126 -157.98011 6.14115 2.24655 -158.01024 654.97718
3860.0000 -163.16011 -157.08937 6.07074 2.28680 -157.35293 653.20610
3865.0000 -163.57192 -157.82133 5.75059 2.29850 -157.16175 665.22681
3870.0000 -163.05690 -157.18978 5.86712 2.27242 -157.58766 646.84392
3875.0000 -162.90843 -156.77411 6.13432 2.27491 -157.54702 667.28918
3880.0000 -163.39365 -157.57908 5.81457 2.25746 -157.83207 656.31679
3885.0000 -164.11968 -156.73761 7.38207 2.28657 -157.35655 679.55098
3890.0000 -162.09776 -156.98317 5.11459 2.30447 -157.06423 681.62890
3895.0000 -161.92465 -154.89110 7.03355 2.41428 -155.27082 755.62112
3900.0000 -161.70575 -155.45667 6.24908 2.41780 -155.21339 746.61772
3905.0000 -161.08515 -156.04697 5.03818 2.39273 -155.62287 747.36827
3910.0000 -161.68897 -155.95433 5.73464 2.38267 -155.78714 720.15292
3915.0000 -162.77917 -156.91552 5.86365 2.34440 -156.41218 704.73572
3920.0000 -162.25795 -156.43900 5.81894 2.34079 -156.47108 699.29017
3925.0000 -162.34628 -156.73195 5.61434 2.31267 -156.93032 683.64012
3930.0000 -161.80430 -156.28370 5.52060 2.36465 -156.08144 709.92280
3935.0000 -163.22932 -156.46734 6.76198 2.31852 -156.83474 689.25994
3940.0000 -161.40657 -155.75781 5.64876 2.32816 -156.67742 707.26220
3945.0000 -163.33423 -156.34546 6.98877 2.36328 -156.10377 727.71432
3950.0000 -162.39125 -156.50757 5.88367 2.35467 -156.24450 680.57044
3955.0000 -162.15950 -156.59430 5.56520 2.37421 -155.92525 730.04008
3960.0000 -162.99939 -156.98396 6.01543 2.29863 -157.15963 668.41148
3965.0000 -162.17895 -156.16427 6.01468 2.30543 -157.04859 679.61759
3970.0000 -163.21318 -158.13246 5.08073 2.29718 -157.18327 664.89955
3975.0000 -163.49802 -156.31933 7.17869 2.28955 -157.30790 672.60001
3980.0000 -161.48798 -155.02493 6.46304 2.38887 -155.68591 720.56306
3985.0000 -162.13841 -156.10390 6.03451 2.37429 -155.92393 735.25812
3990.0000 -164.73941 -158.74016 5.99925 2.27600 -157.52928 694.87933
3995.0000 -162.56020 -156.79918 5.76102 2.26151 -157.76581 645.05513
4000.0000 -163.18996 -156.39547 6.79449 2.33700 -156.53297 720.27515
FREEZING PROCESS: loop number 17 T-loop= 671.00000000000000
main_MD> interactions number 17 at Temperature= 671.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -3.54237 2.44534 -0.50036
force_rgl> df(natom) 2.26314 2.93180 -3.36101
4005.0000 -162.90704 -157.11813 5.78891 2.31304 -156.92425 684.36052
4010.0000 -161.73676 -155.95587 5.78089 2.36381 -156.09510 718.53780
4015.0000 -163.56619 -157.90129 5.66490 2.31118 -156.95469 693.99941
4020.0000 -162.77891 -157.30809 5.47082 2.28558 -157.37280 681.65657
4025.0000 -164.08995 -158.65103 5.43892 2.24455 -158.04281 628.84434
4030.0000 -161.88611 -156.83405 5.05206 2.27752 -157.50449 660.40562
4035.0000 -162.50855 -156.72527 5.78328 2.28640 -157.35941 660.16376
4040.0000 -162.47756 -156.36095 6.11661 2.35414 -156.25305 724.99704
4045.0000 -162.22228 -156.65232 5.56997 2.34694 -156.37064 702.84924
4050.0000 -163.38969 -156.81667 6.57302 2.33374 -156.58623 687.06762
4055.0000 -162.51592 -156.91326 5.60266 2.33076 -156.63486 716.19167
4060.0000 -162.82978 -157.48489 5.34489 2.31090 -156.95923 677.82411
4065.0000 -162.57400 -156.88656 5.68744 2.32381 -156.74837 688.37952
4070.0000 -162.08474 -155.50751 6.57723 2.35343 -156.26469 691.26930
4075.0000 -162.34290 -157.13718 5.20572 2.33833 -156.51131 710.55415
4080.0000 -164.22997 -158.42756 5.80241 2.28503 -157.38169 684.58158
4085.0000 -163.89767 -158.86581 5.03185 2.19915 -158.78425 597.86207
4090.0000 -163.00371 -157.75386 5.24985 2.22520 -158.35883 618.76237
4095.0000 -162.73330 -157.05928 5.67403 2.28844 -157.32610 692.16746
4100.0000 -163.08861 -157.53477 5.55384 2.27209 -157.59302 654.83840
4105.0000 -162.99009 -157.38651 5.60357 2.26327 -157.73719 660.43798
4110.0000 -162.14579 -155.90294 6.24284 2.29026 -157.29633 663.02202
4115.0000 -162.86633 -157.19377 5.67256 2.33049 -156.63932 680.05882
4120.0000 -162.16962 -155.86002 6.30960 2.35034 -156.31512 690.73408
4125.0000 -162.38833 -156.58744 5.80089 2.36218 -156.12177 720.64377
4130.0000 -162.66103 -156.23621 6.42482 2.32583 -156.71537 705.83876
4135.0000 -162.67610 -155.31091 7.36519 2.39661 -155.55941 746.53155
4140.0000 -162.65069 -157.11525 5.53544 2.33701 -156.53283 698.05349
4145.0000 -160.91603 -154.69516 6.22087 2.39040 -155.66091 728.69291
4150.0000 -162.00069 -156.19361 5.80708 2.43360 -154.95536 753.83817
4155.0000 -163.15274 -157.37068 5.78206 2.33028 -156.64281 669.67695
4160.0000 -163.61899 -157.51995 6.09904 2.27834 -157.49102 655.02838
4165.0000 -164.40915 -159.68784 4.72131 2.19991 -158.77183 612.98303
4170.0000 -162.22640 -156.97202 5.25438 2.22986 -158.28271 627.14469
4175.0000 -162.43832 -156.58429 5.85403 2.31220 -156.93806 695.13949
4180.0000 -162.68783 -157.40550 5.28233 2.32870 -156.66848 686.78069
4185.0000 -161.70993 -155.88699 5.82294 2.32931 -156.65865 685.22340
4190.0000 -162.44205 -155.90045 6.54160 2.39652 -155.56090 710.57589
4195.0000 -162.46772 -156.69816 5.76956 2.34524 -156.39849 681.19115
4200.0000 -163.62068 -157.13314 6.48755 2.31157 -156.94833 686.31072
4205.0000 -162.63371 -157.52838 5.10533 2.26928 -157.63905 659.00251
4210.0000 -161.31363 -156.03632 5.27732 2.35323 -156.26799 692.58229
4215.0000 -162.78589 -157.11358 5.67231 2.35011 -156.31888 691.46452
4220.0000 -162.66641 -155.79446 6.87194 2.33996 -156.48462 708.88525
4225.0000 -163.00751 -157.71741 5.29010 2.31297 -156.92538 674.69857
4230.0000 -162.75405 -157.00772 5.74633 2.30329 -157.08352 668.50649
4235.0000 -162.70058 -156.94416 5.75642 2.31841 -156.83655 692.05912
4240.0000 -163.82616 -158.83564 4.99052 2.25402 -157.88826 632.63926
4245.0000 -163.32362 -157.77239 5.55123 2.25634 -157.85031 646.86172
4250.0000 -161.96802 -155.86428 6.10374 2.30562 -157.04556 672.45600
FREEZING PROCESS: loop number 18 T-loop= 646.00000000000000
main_MD> interactions number 18 at Temperature= 646.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.11678 -2.12477 0.42148
force_rgl> df(natom) -4.21880 8.05061 8.18385
4255.0000 -163.52471 -158.57001 4.95470 2.32981 -156.65043 695.84467
4260.0000 -163.03708 -157.67354 5.36354 2.26257 -157.74853 638.77237
4265.0000 -163.84949 -159.11485 4.73464 2.23330 -158.22652 626.43430
4270.0000 -162.82947 -158.28523 4.54424 2.22451 -158.37016 622.69122
4275.0000 -164.64150 -159.27895 5.36254 2.21060 -158.59724 604.22973
4280.0000 -164.00354 -158.91635 5.08719 2.18548 -159.00763 572.95026
4285.0000 -163.93094 -157.94150 5.98944 2.26217 -157.75507 651.86492
4290.0000 -163.68543 -157.90018 5.78526 2.28239 -157.42489 655.23952
4295.0000 -164.55578 -159.87417 4.68162 2.19732 -158.81424 599.69698
4300.0000 -164.97922 -159.38769 5.59153 2.16122 -159.40385 575.12470
4305.0000 -163.61121 -157.78260 5.82860 2.21573 -158.51347 626.21249
4310.0000 -162.75933 -157.19023 5.56910 2.28860 -157.32347 650.25092
4315.0000 -161.55124 -155.35681 6.19443 2.32566 -156.71823 687.29316
4320.0000 -163.42039 -158.27314 5.14725 2.34026 -156.47978 705.18611
4325.0000 -164.57409 -158.78925 5.78485 2.18530 -159.01055 593.67038
4330.0000 -163.55789 -158.02256 5.53533 2.21802 -158.47616 609.10981
4335.0000 -164.40156 -158.03374 6.36782 2.27782 -157.49954 664.27707
4340.0000 -163.43885 -158.59578 4.84308 2.23639 -158.17616 628.69604
4345.0000 -162.64367 -157.75339 4.89029 2.23737 -158.16016 612.52933
4350.0000 -163.02898 -157.76928 5.25970 2.26813 -157.65778 607.13075
4355.0000 -162.25622 -157.57594 4.68028 2.28373 -157.40303 650.06609
4360.0000 -163.08290 -157.29474 5.78816 2.27914 -157.47787 648.32228
4365.0000 -161.98234 -156.86265 5.11969 2.28872 -157.32142 653.30125
4370.0000 -163.54538 -157.84959 5.69579 2.29545 -157.21151 671.69637
4375.0000 -163.10574 -157.93994 5.16580 2.24263 -158.07414 626.52662
4380.0000 -163.87488 -159.60106 4.27382 2.18777 -158.97024 599.87657
4385.0000 -163.31691 -157.31528 6.00163 2.23306 -158.23057 635.14673
4390.0000 -164.24515 -157.13930 7.10585 2.32426 -156.74114 717.63158
4395.0000 -164.19099 -158.06483 6.12616 2.24104 -158.10011 617.00158
4400.0000 -163.54137 -156.97687 6.56450 2.28534 -157.37667 686.40228
4405.0000 -162.36793 -156.39211 5.97581 2.28334 -157.40936 663.18256
4410.0000 -162.06673 -155.60605 6.46068 2.37108 -155.97645 745.77806
4415.0000 -162.70758 -156.89302 5.81457 2.32273 -156.76608 672.55653
4420.0000 -163.69923 -157.98935 5.70988 2.27622 -157.52561 632.74342
4425.0000 -163.71153 -158.25003 5.46150 2.26729 -157.67146 640.94363
4430.0000 -163.79956 -157.99156 5.80799 2.25869 -157.81200 654.06293
4435.0000 -163.51731 -158.00467 5.51265 2.22437 -158.37238 619.58743
4440.0000 -163.05985 -158.02296 5.03689 2.26175 -157.76191 621.73930
4445.0000 -162.65102 -157.62914 5.02188 2.25958 -157.79745 636.98220
4450.0000 -163.89546 -158.27962 5.61584 2.24150 -158.09274 616.53359
4455.0000 -163.07119 -158.17561 4.89558 2.26055 -157.78153 659.54134
4460.0000 -163.37138 -158.20539 5.16598 2.26008 -157.78916 649.79669
4465.0000 -163.64915 -156.83684 6.81231 2.25263 -157.91093 658.04353
4470.0000 -163.54259 -157.49157 6.05102 2.29924 -157.14971 686.31865
4475.0000 -164.30632 -158.85235 5.45396 2.23090 -158.26581 624.42511
4480.0000 -164.41027 -158.69360 5.71667 2.20017 -158.76770 603.88367
4485.0000 -164.17361 -158.29540 5.87821 2.18802 -158.96606 609.06639
4490.0000 -162.74523 -157.44648 5.29875 2.24090 -158.10249 645.38471
4495.0000 -163.54270 -157.91012 5.63258 2.28432 -157.39339 667.86500
4500.0000 -162.81684 -156.86025 5.95659 2.24632 -158.01397 620.29048
FREEZING PROCESS: loop number 19 T-loop= 621.00000000000000
main_MD> interactions number 19 at Temperature= 621.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.68214 1.45606 -2.57432
force_rgl> df(natom) 4.54089 1.85291 -3.87118
4505.0000 -164.16420 -158.68948 5.47472 2.24838 -157.98035 607.86385
4510.0000 -164.05442 -158.38442 5.67001 2.23207 -158.24668 609.86085
4515.0000 -163.60342 -158.09524 5.50818 2.22458 -158.36902 628.75842
4520.0000 -162.97282 -157.22531 5.74752 2.28484 -157.38484 661.09988
4525.0000 -164.78889 -158.96077 5.82812 2.26355 -157.73253 663.68183
4530.0000 -163.29709 -158.34682 4.95027 2.21357 -158.54880 611.00606
4535.0000 -163.26372 -158.34843 4.91529 2.22847 -158.30543 635.76588
4540.0000 -164.01873 -158.66330 5.35542 2.21090 -158.59247 632.96733
4545.0000 -163.70276 -158.65158 5.05118 2.23174 -158.25210 609.24891
4550.0000 -163.91505 -158.59757 5.31747 2.22124 -158.42362 598.95192
4555.0000 -162.86991 -157.12812 5.74179 2.27462 -157.55178 654.77336
4560.0000 -162.84355 -157.63789 5.20566 2.28010 -157.46221 671.23412
4565.0000 -162.64451 -157.76793 4.87659 2.25794 -157.82412 650.18858
4570.0000 -164.33101 -159.45994 4.87107 2.20935 -158.61778 636.48500
4575.0000 -163.36133 -158.26087 5.10045 2.21225 -158.57043 637.41270
4580.0000 -162.14095 -156.61607 5.52489 2.29566 -157.20814 667.10086
4585.0000 -163.44983 -157.85407 5.59575 2.28711 -157.34779 658.54253
4590.0000 -164.50172 -158.45297 6.04875 2.25613 -157.85373 638.96093
4595.0000 -164.47316 -159.65915 4.81400 2.16202 -159.39079 565.85692
4600.0000 -163.49780 -158.22034 5.27746 2.20308 -158.72005 609.25088
4605.0000 -163.40790 -158.10075 5.30715 2.22995 -158.28124 630.45229
4610.0000 -163.10000 -157.52402 5.57598 2.27675 -157.51696 673.61812
4615.0000 -163.49403 -157.21349 6.28054 2.25865 -157.81252 645.06810
4620.0000 -164.31261 -158.74036 5.57225 2.23422 -158.21155 637.93797
4625.0000 -162.97617 -157.39763 5.57854 2.22550 -158.35405 644.72343
4630.0000 -163.46691 -159.21719 4.24973 2.24117 -158.09808 613.52753
4635.0000 -164.53856 -159.72798 4.81058 2.16767 -159.29842 562.33100
4640.0000 -164.44383 -160.22680 4.21703 2.12425 -160.00753 540.28829
4645.0000 -164.24094 -158.96821 5.27272 2.12293 -160.02917 548.63916
4650.0000 -164.10870 -158.89268 5.21602 2.23998 -158.11749 640.72534
4655.0000 -164.22176 -157.32177 6.89999 2.26980 -157.63051 674.88131
4660.0000 -163.94166 -158.80226 5.13939 2.25539 -157.86584 642.42320
4665.0000 -164.56224 -159.38360 5.17864 2.16641 -159.31906 587.12615
4670.0000 -163.10650 -158.29603 4.81048 2.21791 -158.47794 635.67578
4675.0000 -163.85813 -158.91379 4.94435 2.19002 -158.93343 604.16371
4680.0000 -164.60906 -159.92319 4.68586 2.13216 -159.87831 567.01812
4685.0000 -164.19913 -158.82492 5.37421 2.14332 -159.69610 581.44368
4690.0000 -163.66608 -159.25263 4.41345 2.18167 -159.06979 602.11281
4695.0000 -165.33463 -161.01812 4.31651 2.11219 -160.20454 539.83882
4700.0000 -164.22597 -159.76630 4.45967 2.13980 -159.75365 566.78591
4705.0000 -163.78985 -158.50523 5.28462 2.16751 -159.30106 569.33110
4710.0000 -163.57552 -158.39521 5.18031 2.26888 -157.64549 628.76634
4715.0000 -163.48587 -158.34404 5.14183 2.21393 -158.54297 615.84572
4720.0000 -163.95801 -159.25161 4.70640 2.20237 -158.73169 619.87809
4725.0000 -163.39368 -158.90238 4.49130 2.17612 -159.16049 617.15371
4730.0000 -164.65563 -159.82609 4.82954 2.16546 -159.33461 595.98275
4735.0000 -165.07213 -160.11312 4.95901 2.15867 -159.44543 577.86475
4740.0000 -164.21550 -159.41527 4.80022 2.14478 -159.67221 575.64220
4745.0000 -163.97245 -159.13459 4.83785 2.17499 -159.17884 585.75227
4750.0000 -163.91583 -157.77524 6.14059 2.24165 -158.09026 629.09811
FREEZING PROCESS: loop number 20 T-loop= 596.00000000000000
main_MD> interactions number 20 at Temperature= 596.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.51134 -0.26128 -2.78350
force_rgl> df(natom) 1.39411 -0.21395 -1.27643
4755.0000 -163.63350 -158.94154 4.69196 2.20317 -158.71866 587.57985
4760.0000 -163.56572 -158.61510 4.95062 2.24607 -158.01799 619.53519
4765.0000 -164.01496 -159.48795 4.52701 2.22004 -158.44307 582.32439
4770.0000 -164.21375 -159.60838 4.60536 2.15301 -159.53779 549.93969
4775.0000 -163.98648 -159.14784 4.83864 2.16455 -159.34944 561.51117
4780.0000 -163.92571 -157.91116 6.01454 2.20421 -158.70167 620.40304
4785.0000 -163.78053 -158.45666 5.32387 2.20908 -158.62211 621.71730
4790.0000 -163.70263 -158.60687 5.09576 2.19960 -158.77701 603.91945
4795.0000 -164.96503 -159.35502 5.61002 2.21931 -158.45509 659.18409
4800.0000 -166.08541 -160.62944 5.45597 2.14383 -159.68783 601.32943
4805.0000 -165.13002 -159.46597 5.66405 2.12687 -159.96479 608.31801
4810.0000 -163.52488 -158.18048 5.34440 2.17694 -159.14698 593.76351
4815.0000 -164.71049 -159.08617 5.62431 2.23057 -158.27110 611.78957
4820.0000 -164.52230 -159.72557 4.79673 2.15358 -159.52850 576.15893
4825.0000 -163.54796 -158.55396 4.99400 2.18838 -158.96026 620.18276
4830.0000 -163.99786 -158.85088 5.14697 2.17146 -159.23650 576.54121
4835.0000 -164.36399 -159.25894 5.10505 2.18406 -159.03074 585.97965
4840.0000 -165.04884 -160.10268 4.94617 2.13821 -159.77960 559.84375
4845.0000 -164.71266 -159.67555 5.03712 2.15624 -159.48518 566.50957
4850.0000 -162.91959 -157.37126 5.54833 2.19860 -158.79330 612.94575
4855.0000 -163.19426 -157.13619 6.05807 2.31016 -156.97136 668.92883
4860.0000 -163.45833 -157.76360 5.69473 2.25981 -157.79360 619.60988
4865.0000 -164.01567 -158.95997 5.05569 2.22048 -158.43595 623.32369
4870.0000 -163.65483 -158.37502 5.27981 2.17560 -159.16895 589.59801
4875.0000 -163.27266 -158.14035 5.13231 2.21314 -158.55590 591.55326
4880.0000 -162.79441 -157.37469 5.41972 2.23401 -158.21493 609.46704
4885.0000 -163.42940 -157.00426 6.42514 2.29520 -157.21563 659.94847
4890.0000 -162.64466 -157.62671 5.01795 2.29231 -157.26278 644.42959
4895.0000 -164.38491 -159.66286 4.72205 2.22018 -158.44094 625.41002
4900.0000 -165.09739 -160.42729 4.67010 2.16091 -159.40884 590.60372
4905.0000 -163.51203 -158.88354 4.62850 2.13195 -159.88187 558.91233
4910.0000 -163.64046 -158.41673 5.22373 2.23930 -158.12855 642.08484
4915.0000 -164.15403 -159.56664 4.58739 2.22537 -158.35617 621.46134
4920.0000 -163.38265 -158.76292 4.61973 2.16237 -159.38498 561.80322
4925.0000 -165.13795 -158.66746 6.47049 2.21099 -158.59096 620.20383
4930.0000 -163.94861 -159.30602 4.64260 2.16958 -159.26731 587.96029
4935.0000 -164.35917 -160.42972 3.92945 2.14784 -159.62235 571.14677
4940.0000 -164.24651 -159.72171 4.52481 2.12803 -159.94584 570.62885
4945.0000 -163.88879 -159.02426 4.86453 2.15420 -159.51845 571.51228
4950.0000 -163.94724 -158.09313 5.85411 2.19366 -158.87403 613.53996
4955.0000 -163.76916 -158.84731 4.92184 2.19725 -158.81532 598.14842
4960.0000 -164.23439 -159.47037 4.76402 2.21608 -158.50780 594.90196
4965.0000 -163.59494 -158.56625 5.02869 2.19495 -158.85293 576.17412
4970.0000 -163.50032 -158.06872 5.43160 2.22372 -158.38299 633.38579
4975.0000 -164.55546 -159.16286 5.39261 2.21488 -158.52741 610.38181
4980.0000 -164.13896 -159.26175 4.87721 2.16735 -159.30372 592.07136
4985.0000 -163.74437 -158.77221 4.97216 2.18483 -159.01812 608.18918
4990.0000 -163.83478 -158.61784 5.21694 2.23637 -158.17652 633.72301
4995.0000 -162.72016 -158.03614 4.68402 2.22545 -158.35481 610.84651
5000.0000 -164.78364 -159.79386 4.98978 2.19475 -158.85612 597.47153
FREEZING PROCESS: loop number 21 T-loop= 571.00000000000000
main_MD> interactions number 21 at Temperature= 571.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.13243 -3.06580 0.71551
force_rgl> df(natom) -0.26258 1.27877 -1.49633
5005.0000 -163.75299 -159.70390 4.04909 2.11003 -160.23974 547.02073
5010.0000 -165.01461 -159.73185 5.28277 2.17024 -159.25646 579.60883
5015.0000 -164.48684 -160.37027 4.11657 2.10094 -160.38820 554.29493
5020.0000 -165.20877 -159.68857 5.52020 2.11807 -160.10855 547.07404
5025.0000 -164.38877 -160.09399 4.29477 2.15187 -159.55654 576.56752
5030.0000 -165.00915 -160.27170 4.73746 2.13636 -159.80972 556.39444
5035.0000 -165.48252 -160.81014 4.67238 2.08406 -160.66397 539.67873
5040.0000 -164.94690 -161.06930 3.87760 2.08876 -160.58720 510.28919
5045.0000 -164.62121 -159.45217 5.16904 2.08143 -160.70690 525.53655
5050.0000 -164.86521 -159.48898 5.37622 2.12027 -160.07254 563.47221
5055.0000 -164.38569 -159.82551 4.56018 2.14780 -159.62302 556.47308
5060.0000 -164.56303 -159.74970 4.81332 2.13811 -159.78118 564.00880
5065.0000 -163.59122 -158.68019 4.91103 2.15443 -159.51465 578.79954
5070.0000 -164.62755 -159.72891 4.89864 2.18206 -159.06348 610.38791
5075.0000 -164.44987 -160.17597 4.27390 2.14368 -159.69020 551.78812
5080.0000 -165.06800 -159.81330 5.25470 2.13766 -159.78854 574.66154
5085.0000 -163.98258 -159.20662 4.77596 2.14917 -159.60050 590.10829
5090.0000 -164.05403 -159.42899 4.62504 2.12454 -160.00285 558.67761
5095.0000 -165.74327 -161.76418 3.97909 2.11360 -160.18142 561.89615
5100.0000 -164.73203 -160.89329 3.83874 2.05384 -161.15754 508.23169
5105.0000 -166.00186 -161.61954 4.38231 2.04442 -161.31128 524.82054
5110.0000 -164.57938 -159.80288 4.77649 2.09212 -160.53226 555.09546
5115.0000 -164.38715 -160.10506 4.28210 2.09665 -160.45830 538.77572
5120.0000 -165.23336 -160.67187 4.56148 2.10857 -160.26355 567.77263
5125.0000 -165.41940 -161.04505 4.37435 2.05317 -161.16835 529.18391
5130.0000 -165.23447 -160.21092 5.02355 2.07773 -160.76725 520.16309
5135.0000 -164.31282 -159.40075 4.91206 2.14688 -159.63791 576.38926
5140.0000 -164.50995 -160.17083 4.33912 2.14319 -159.69825 554.48686
5145.0000 -165.34691 -159.91718 5.42972 2.12996 -159.91430 554.73863
5150.0000 -165.42582 -160.16623 5.25959 2.13439 -159.84203 572.86617
5155.0000 -165.53164 -161.49083 4.04081 2.08201 -160.69744 542.25707
5160.0000 -165.11351 -160.69889 4.41462 2.01963 -161.71609 471.00633
5165.0000 -165.40016 -160.95100 4.44916 2.07641 -160.78886 534.48243
5170.0000 -165.61239 -161.18038 4.43201 2.08059 -160.72059 511.30786
5175.0000 -165.07427 -160.84295 4.23132 2.09499 -160.48535 542.79572
5180.0000 -165.63280 -161.13483 4.49798 2.06414 -160.98927 521.82341
5185.0000 -165.16459 -161.05956 4.10503 2.07146 -160.86973 530.20290
5190.0000 -165.66918 -161.03784 4.63134 2.07817 -160.76005 518.61349
5195.0000 -165.13967 -160.09484 5.04483 2.09160 -160.54084 536.61666
5200.0000 -164.59550 -159.73988 4.85562 2.09580 -160.47220 547.44904
5205.0000 -165.64214 -160.13896 5.50318 2.13007 -159.91247 550.25602
5210.0000 -164.26181 -158.95130 5.31051 2.15407 -159.52062 573.44450
5215.0000 -164.21070 -159.06314 5.14756 2.18284 -159.05070 584.25574
5220.0000 -163.77456 -157.45226 6.32229 2.21226 -158.57014 630.69354
5225.0000 -164.11385 -158.60625 5.50760 2.22033 -158.43840 638.01629
5230.0000 -165.31951 -159.66180 5.65770 2.16802 -159.29270 612.39437
5235.0000 -165.20954 -160.34828 4.86126 2.12439 -160.00529 580.96572
5240.0000 -164.60415 -160.15678 4.44737 2.08341 -160.67458 559.44308
5245.0000 -164.68977 -159.81975 4.87002 2.12502 -159.99494 574.53138
5250.0000 -164.72777 -160.31175 4.41601 2.09114 -160.54834 536.10132
FREEZING PROCESS: loop number 22 T-loop= 546.00000000000000
main_MD> interactions number 22 at Temperature= 546.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.61613 3.00588 0.24090
force_rgl> df(natom) 0.05312 -0.81741 2.06518
5255.0000 -164.51900 -160.32228 4.19671 2.05666 -161.11147 514.78811
5260.0000 -165.26314 -160.53227 4.73087 2.11321 -160.18778 560.74101
5265.0000 -164.53107 -160.35638 4.17469 2.08953 -160.57457 536.92666
5270.0000 -164.70049 -159.78667 4.91382 2.09290 -160.51960 527.28093
5275.0000 -165.04431 -159.83146 5.21284 2.18072 -159.08530 600.46046
5280.0000 -164.63569 -159.75365 4.88204 2.15914 -159.43776 586.94445
5285.0000 -165.87347 -161.01491 4.85856 2.08518 -160.64566 542.11377
5290.0000 -165.36646 -161.16733 4.19913 2.04520 -161.29861 511.21854
5295.0000 -165.59650 -161.02544 4.57106 2.07836 -160.75702 516.98561
5300.0000 -164.70310 -160.19300 4.51011 2.12564 -159.98482 534.73344
5305.0000 -164.94599 -159.92242 5.02357 2.11189 -160.20936 511.74736
5310.0000 -164.60957 -160.64454 3.96503 2.09213 -160.53206 502.58796
5315.0000 -165.01899 -160.36354 4.65545 2.10628 -160.30096 545.89007
5320.0000 -164.99122 -160.43115 4.56007 2.08264 -160.68712 521.20880
5325.0000 -164.77929 -159.91933 4.85995 2.12878 -159.93365 548.94114
5330.0000 -164.42912 -160.01196 4.41716 2.10876 -160.26061 530.86832
5335.0000 -164.15793 -159.12539 5.03254 2.16996 -159.26111 568.22765
5340.0000 -164.65336 -159.37933 5.27403 2.16849 -159.28507 600.25440
5345.0000 -164.21792 -159.44331 4.77462 2.15580 -159.49235 573.45380
5350.0000 -165.21339 -161.27855 3.93485 2.09508 -160.48391 535.41575
5355.0000 -164.32640 -160.06480 4.26161 2.11341 -160.18455 538.59183
5360.0000 -164.64292 -160.02302 4.61990 2.10926 -160.25237 548.30063
5365.0000 -164.23957 -160.04289 4.19669 2.16838 -159.28687 587.49752
5370.0000 -164.62843 -159.79338 4.83505 2.11647 -160.13455 516.74125
5375.0000 -163.96079 -158.58006 5.38073 2.19804 -158.80247 591.29009
5380.0000 -164.07560 -159.20719 4.86842 2.19565 -158.84141 604.17607
5385.0000 -165.17252 -159.98576 5.18677 2.13063 -159.90330 559.06765
5390.0000 -164.94077 -160.82386 4.11690 2.09984 -160.40624 532.26942
5395.0000 -165.11013 -159.77529 5.33484 2.10068 -160.39248 525.95170
5400.0000 -165.56706 -161.42990 4.13716 2.07310 -160.84287 517.55785
5405.0000 -164.59824 -159.99510 4.60314 2.06836 -160.92029 500.36399
5410.0000 -164.87856 -159.85002 5.02855 2.14144 -159.72678 556.67191
5415.0000 -165.60536 -160.51613 5.08923 2.14836 -159.61374 574.31162
5420.0000 -165.30349 -160.37430 4.92919 2.11094 -160.22486 557.41791
5425.0000 -163.11921 -158.82730 4.29191 2.14606 -159.65129 569.20663
5430.0000 -164.58938 -159.99645 4.59292 2.16199 -159.39117 559.69910
5435.0000 -165.42247 -160.80698 4.61549 2.12017 -160.07423 534.29360
5440.0000 -164.83319 -160.47644 4.35676 2.08741 -160.60920 512.75712
5445.0000 -165.09933 -160.46995 4.62938 2.11027 -160.23586 495.85009
5450.0000 -165.12618 -160.00705 5.11914 2.12502 -159.99504 546.73534
5455.0000 -164.52497 -160.12589 4.39909 2.11432 -160.16977 548.43450
5460.0000 -163.93872 -158.92782 5.01090 2.14168 -159.72291 560.94523
5465.0000 -164.12188 -159.26162 4.86026 2.15043 -159.57999 562.19653
5470.0000 -163.75804 -159.58852 4.16952 2.16608 -159.32442 554.24562
5475.0000 -165.42984 -160.29447 5.13537 2.12130 -160.05571 549.47151
5480.0000 -165.56343 -161.79938 3.76405 2.09045 -160.55960 548.86469
5485.0000 -165.59494 -161.02084 4.57409 2.02700 -161.59588 514.43865
5490.0000 -166.31424 -161.89044 4.42380 2.03814 -161.41380 515.79200
5495.0000 -165.55922 -161.39246 4.16676 2.02471 -161.63321 512.71133
5500.0000 -165.81822 -161.32789 4.49033 2.04512 -161.29993 543.28543
FREEZING PROCESS: loop number 23 T-loop= 521.00000000000000
main_MD> interactions number 23 at Temperature= 521.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.94287 -0.84141 0.81073
force_rgl> df(natom) -0.10792 2.16274 -3.96358
5505.0000 -166.71511 -161.64037 5.07474 2.02484 -161.63114 523.76973
5510.0000 -166.33702 -161.98727 4.34975 1.99597 -162.10262 506.21490
5515.0000 -166.43039 -162.45391 3.97648 1.97732 -162.40721 460.32719
5520.0000 -166.26457 -161.61500 4.64957 2.03643 -161.44178 521.27429
5525.0000 -165.56074 -161.29583 4.26491 2.03541 -161.45843 505.69375
5530.0000 -165.69645 -161.05581 4.64064 2.04146 -161.35965 515.94408
5535.0000 -165.37061 -161.61901 3.75160 2.03590 -161.45039 477.32409
5540.0000 -165.08688 -160.97593 4.11095 2.07437 -160.82221 507.32469
5545.0000 -165.30255 -160.87485 4.42771 2.05368 -161.16001 506.42044
5550.0000 -166.05641 -161.35931 4.69710 2.03221 -161.51066 487.30242
5555.0000 -164.89932 -160.68778 4.21154 2.08207 -160.69637 530.37398
5560.0000 -165.06363 -159.50647 5.55716 2.09689 -160.45443 528.45881
5565.0000 -165.04034 -159.89975 5.14059 2.12020 -160.07371 550.63350
5570.0000 -165.54827 -161.20275 4.34553 2.09162 -160.54044 513.36221
5575.0000 -164.66169 -160.81134 3.85036 2.08016 -160.72757 505.19478
5580.0000 -165.80754 -161.19030 4.61723 2.07758 -160.76971 504.46067
5585.0000 -165.48648 -161.28093 4.20556 2.04893 -161.23769 508.76075
5590.0000 -165.48215 -160.29988 5.18227 2.08015 -160.72773 512.63444
5595.0000 -163.95584 -159.82687 4.12897 2.12178 -160.04793 540.47286
5600.0000 -165.49949 -161.19730 4.30220 2.07531 -160.80684 510.60532
5605.0000 -164.58765 -160.78529 3.80237 2.07458 -160.81880 510.33520
5610.0000 -165.52990 -161.64599 3.88391 2.02858 -161.56999 476.41957
5615.0000 -165.72628 -161.67718 4.04909 2.05412 -161.15286 514.29892
5620.0000 -165.36535 -160.63344 4.73191 2.02405 -161.64390 481.47309
5625.0000 -164.62668 -160.33715 4.28953 2.07698 -160.77952 514.69985
5630.0000 -164.89135 -161.13557 3.75579 2.07832 -160.75759 514.78518
5635.0000 -165.73671 -161.65888 4.07784 2.03672 -161.43705 505.53646
5640.0000 -165.90051 -161.49170 4.40882 2.02226 -161.67324 492.17694
5645.0000 -166.31330 -161.41724 4.89606 2.00432 -161.96622 471.86373
5650.0000 -166.15734 -161.58142 4.57592 2.02596 -161.61276 505.50831
5655.0000 -166.16057 -162.45700 3.70357 2.01140 -161.85058 490.09099
5660.0000 -166.25437 -161.97466 4.27971 2.01427 -161.80377 499.79875
5665.0000 -165.59452 -161.50995 4.08457 2.00930 -161.88490 500.89695
5670.0000 -166.45901 -163.22874 3.23027 1.96026 -162.68570 469.93915
5675.0000 -166.06409 -161.95393 4.11016 1.93017 -163.17713 432.57243
5680.0000 -166.49499 -161.76157 4.73342 2.02299 -161.66128 513.52693
5685.0000 -165.93441 -162.00120 3.93321 2.01404 -161.80753 508.98718
5690.0000 -165.93198 -161.73666 4.19532 1.99612 -162.10016 459.19385
5695.0000 -164.84116 -160.54618 4.29498 2.07311 -160.84272 533.50945
5700.0000 -165.85219 -160.96921 4.88298 2.09314 -160.51556 539.55799
5705.0000 -166.02689 -160.77702 5.24987 2.06721 -160.93918 552.46553
5710.0000 -165.63000 -161.06616 4.56384 2.06749 -160.93447 537.04731
5715.0000 -165.77961 -161.44856 4.33105 2.06161 -161.03057 513.55831
5720.0000 -166.00449 -161.02579 4.97870 2.07239 -160.85449 517.45978
5725.0000 -165.28924 -161.09100 4.19824 2.04038 -161.37737 511.30368
5730.0000 -165.74988 -160.87725 4.87263 2.07879 -160.75002 537.74067
5735.0000 -165.54804 -161.03073 4.51731 2.12030 -160.07209 575.10245
5740.0000 -166.14648 -162.00879 4.13769 2.03103 -161.52995 511.37588
5745.0000 -166.96080 -162.52795 4.43285 1.99869 -162.05815 482.84182
5750.0000 -165.57760 -161.16513 4.41247 1.98116 -162.34448 479.54980
FREEZING PROCESS: loop number 24 T-loop= 496.00000000000000
main_MD> interactions number 24 at Temperature= 496.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.06507 0.92366 0.26374
force_rgl> df(natom) 3.20870 0.48321 -5.03980
5755.0000 -166.17601 -161.89951 4.27650 2.00709 -161.92102 492.00270
5760.0000 -167.01880 -163.14944 3.86936 2.00046 -162.02921 493.55963
5765.0000 -166.31879 -162.25516 4.06363 1.94785 -162.88852 445.47968
5770.0000 -165.70761 -161.56009 4.14752 1.99929 -162.04837 484.40025
5775.0000 -167.05260 -162.47891 4.57368 2.01084 -161.85979 498.62589
5780.0000 -166.35287 -161.96187 4.39100 1.98363 -162.30415 467.03054
5785.0000 -166.70131 -162.29218 4.40913 2.01904 -161.72577 497.58705
5790.0000 -166.50332 -161.79088 4.71245 1.99684 -162.08839 465.07325
5795.0000 -165.79558 -161.28673 4.50885 2.04306 -161.33346 511.11898
5800.0000 -166.10061 -161.54933 4.55127 2.02844 -161.57236 488.56395
5805.0000 -165.99956 -161.24553 4.75402 2.03009 -161.54538 503.05218
5810.0000 -164.37720 -160.21423 4.16297 2.07424 -160.82430 540.99967
5815.0000 -165.26106 -161.05956 4.20151 2.06866 -160.91546 507.39827
5820.0000 -165.75477 -161.68130 4.07347 2.02127 -161.68935 498.86865
5825.0000 -165.74820 -161.47244 4.27576 2.03299 -161.49805 520.57682
5830.0000 -165.89388 -161.26323 4.63065 2.03098 -161.53078 505.50958
5835.0000 -165.80059 -161.69544 4.10514 2.04603 -161.28493 525.68511
5840.0000 -165.02971 -159.34622 5.68348 2.09426 -160.49739 553.24094
5845.0000 -165.41668 -160.88736 4.52933 2.08791 -160.60098 556.89321
5850.0000 -165.71877 -160.85852 4.86026 2.06388 -160.99350 541.08347
5855.0000 -166.14422 -162.11965 4.02457 2.01533 -161.78645 490.78457
5860.0000 -166.69887 -162.50135 4.19752 1.98174 -162.33499 479.03830
5865.0000 -166.39713 -162.19796 4.19917 1.97202 -162.49364 472.82564
5870.0000 -166.56358 -161.85660 4.70698 1.99496 -162.11905 484.43829
5875.0000 -166.84681 -162.89191 3.95490 1.95899 -162.70660 459.07399
5880.0000 -166.45601 -162.38209 4.07392 2.00173 -162.00844 484.62414
5885.0000 -166.98999 -162.76573 4.22426 1.97977 -162.36717 481.02649
5890.0000 -166.25443 -162.17004 4.08440 1.96966 -162.53223 471.27905
5895.0000 -165.97961 -162.16315 3.81646 1.99672 -162.09026 495.16479
5900.0000 -165.70820 -161.32251 4.38569 2.00089 -162.02222 498.90805
5905.0000 -165.16792 -160.44472 4.72320 2.07948 -160.73864 537.74498
5910.0000 -165.69575 -161.40671 4.28904 2.09477 -160.48895 547.04870
5915.0000 -165.40095 -160.98044 4.42052 2.02884 -161.56574 493.96438
5920.0000 -165.71840 -161.45410 4.26430 2.04073 -161.37161 483.10239
5925.0000 -164.83823 -160.28979 4.54844 2.08330 -160.67631 524.87746
5930.0000 -164.76506 -160.26406 4.50100 2.06248 -161.01639 510.81884
5935.0000 -165.71377 -161.21856 4.49521 2.05286 -161.17350 505.21441
5940.0000 -165.57763 -160.95050 4.62713 2.05423 -161.15101 490.70444
5945.0000 -165.53097 -161.33619 4.19478 2.05092 -161.20521 510.55254
5950.0000 -166.13637 -161.90698 4.22938 2.01057 -161.86414 473.93019
5955.0000 -165.29234 -160.45267 4.83967 2.02092 -161.69513 477.41183
5960.0000 -165.46501 -161.15813 4.30688 2.07716 -160.77667 537.05987
5965.0000 -164.93320 -160.73388 4.19933 2.07272 -160.84905 514.34776
5970.0000 -165.33413 -161.29019 4.04394 2.07727 -160.77475 497.76676
5975.0000 -165.19730 -160.88924 4.30806 2.07539 -160.80548 508.57044
5980.0000 -165.38694 -161.31476 4.07218 2.05379 -161.15824 500.85605
5985.0000 -165.82688 -162.52597 3.30091 1.99866 -162.05860 453.72464
5990.0000 -165.09936 -160.62494 4.47442 2.02740 -161.58925 499.11107
5995.0000 -166.21707 -162.34302 3.87405 2.05162 -161.19367 504.49626
6000.0000 -165.63919 -161.86607 3.77312 1.99784 -162.07196 455.98986
FREEZING PROCESS: loop number 25 T-loop= 471.00000000000000
main_MD> interactions number 25 at Temperature= 471.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.94050 1.87661 -0.56411
force_rgl> df(natom) 1.40188 -1.31079 -0.27513
6005.0000 -166.27970 -162.69205 3.58765 1.97572 -162.43332 451.71668
6010.0000 -166.26106 -162.29258 3.96847 1.99528 -162.11390 461.28083
6015.0000 -166.52599 -163.09689 3.42910 1.96247 -162.64970 449.19141
6020.0000 -166.23191 -161.86838 4.36353 1.97046 -162.51917 452.81414
6025.0000 -167.26021 -163.18818 4.07203 1.98496 -162.28244 472.68233
6030.0000 -166.78499 -162.77979 4.00519 1.93696 -163.06632 443.57929
6035.0000 -166.37631 -162.84529 3.53102 1.96220 -162.65414 458.62425
6040.0000 -166.39068 -162.50907 3.88161 1.97482 -162.44807 472.74695
6045.0000 -166.72899 -162.78713 3.94186 1.95898 -162.70666 442.54408
6050.0000 -167.32196 -162.95843 4.36353 1.93623 -163.07818 443.96626
6055.0000 -166.53862 -162.81635 3.72228 1.92838 -163.20645 442.33187
6060.0000 -166.57907 -162.67258 3.90649 1.92082 -163.32994 445.62859
6065.0000 -166.97151 -162.44184 4.52966 1.97366 -162.46701 486.07440
6070.0000 -167.00416 -162.71981 4.28435 1.95875 -162.71046 479.26887
6075.0000 -165.63819 -160.97954 4.65864 1.98683 -162.25179 488.88455
6080.0000 -165.53737 -161.57624 3.96113 2.04981 -161.22327 509.04641
6085.0000 -166.14127 -162.17498 3.96629 2.02151 -161.68551 496.05913
6090.0000 -166.84320 -162.65846 4.18474 1.98536 -162.27586 463.81756
6095.0000 -167.14854 -163.35014 3.79840 1.94141 -162.99362 427.02271
6100.0000 -166.78694 -162.91434 3.87260 1.93963 -163.02264 432.06447
6105.0000 -166.38583 -162.47315 3.91268 1.94891 -162.87118 444.67115
6110.0000 -166.33787 -162.31950 4.01838 1.99488 -162.12043 488.21483
6115.0000 -167.30075 -163.66252 3.63823 1.92427 -163.27348 439.10795
6120.0000 -165.96013 -162.70382 3.25631 1.92636 -163.23950 445.91863
6125.0000 -166.96022 -161.96900 4.99122 1.99165 -162.17312 487.12957
6130.0000 -166.55140 -162.37298 4.17843 2.02847 -161.57175 517.20363
6135.0000 -166.65341 -162.27527 4.37813 1.97121 -162.50693 449.16617
6140.0000 -165.97742 -162.06176 3.91566 1.98507 -162.28055 469.55619
6145.0000 -166.18817 -161.53843 4.64974 2.00140 -162.01389 489.65003
6150.0000 -166.35136 -162.40867 3.94268 2.01100 -161.85716 487.07086
6155.0000 -166.25459 -162.74510 3.50950 1.97286 -162.47995 464.67848
6160.0000 -165.85255 -162.39457 3.45798 1.94849 -162.87806 447.48288
6165.0000 -166.63147 -162.98254 3.64893 1.95631 -162.75031 456.04262
6170.0000 -166.79278 -163.02984 3.76294 1.93507 -163.09713 438.74062
6175.0000 -166.38999 -162.13857 4.25142 1.97243 -162.48694 460.50694
6180.0000 -165.56375 -161.62085 3.94290 2.01455 -161.79913 504.43420
6185.0000 -166.28817 -161.81199 4.47619 2.03170 -161.51900 506.30956
6190.0000 -165.84916 -162.09879 3.75037 1.98497 -162.28224 471.49132
6195.0000 -166.67721 -163.22085 3.45636 1.98674 -162.25335 479.49540
6200.0000 -166.91891 -163.11316 3.80575 1.91595 -163.40947 426.62214
6205.0000 -167.39873 -163.67798 3.72075 1.90292 -163.62227 414.67426
6210.0000 -167.50549 -164.02565 3.47985 1.89087 -163.81904 413.72067
6215.0000 -167.08233 -162.82768 4.25466 1.93958 -163.02350 455.15340
6220.0000 -166.41015 -162.13302 4.27713 1.97437 -162.45527 474.27522
6225.0000 -165.94893 -162.09498 3.85395 1.97398 -162.46170 473.78916
6230.0000 -166.31742 -162.15457 4.16285 1.97233 -162.48862 475.94173
6235.0000 -165.79475 -162.08361 3.71113 1.99540 -162.11188 466.77110
6240.0000 -166.10621 -162.18817 3.91803 1.99482 -162.12141 481.09527
6245.0000 -167.15105 -162.92421 4.22684 1.95860 -162.71294 476.26085
6250.0000 -165.68307 -162.34226 3.34081 1.96172 -162.66196 468.84664
FREEZING PROCESS: loop number 26 T-loop= 446.00000000000000
main_MD> interactions number 26 at Temperature= 446.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.28002 -4.00461 1.32977
force_rgl> df(natom) -0.60622 1.30642 0.10222
6255.0000 -166.04846 -161.61893 4.42953 1.98631 -162.26042 480.43841
6260.0000 -166.19305 -161.95356 4.23948 2.00226 -161.99992 503.73225
6265.0000 -166.45382 -161.98835 4.46547 1.97581 -162.43187 468.76357
6270.0000 -166.60425 -162.99341 3.61085 1.97494 -162.44596 480.24134
6275.0000 -166.62652 -162.32534 4.30118 1.96946 -162.53548 471.79533
6280.0000 -167.15536 -163.33665 3.81871 1.96504 -162.60776 475.42353
6285.0000 -165.95560 -162.19657 3.75903 1.96042 -162.68322 442.87548
6290.0000 -166.03883 -162.54246 3.49637 1.97935 -162.37398 451.87110
6295.0000 -166.96301 -163.00852 3.95449 1.95462 -162.77787 439.94573
6300.0000 -166.32314 -162.96501 3.35813 1.93968 -163.02188 423.46121
6305.0000 -166.16571 -162.53215 3.63356 1.95485 -162.77416 429.68108
6310.0000 -166.74518 -163.62981 3.11537 1.92700 -163.22905 415.12648
6315.0000 -166.80563 -162.39018 4.41545 1.94889 -162.87144 448.56150
6320.0000 -167.45688 -163.63048 3.82640 1.93570 -163.08688 447.24823
6325.0000 -167.08924 -162.24426 4.84498 1.93551 -163.08992 452.35636
6330.0000 -167.18058 -163.52335 3.65723 1.96732 -162.57055 472.03373
6335.0000 -166.67030 -163.33635 3.33396 1.94147 -162.99259 445.93764
6340.0000 -167.10786 -162.99954 4.10832 1.94161 -162.99033 444.45884
6345.0000 -167.29592 -163.36668 3.92924 1.93298 -163.13124 447.17655
6350.0000 -167.21900 -163.42898 3.79001 1.94155 -162.99134 453.03334
6355.0000 -166.99430 -163.52547 3.46883 1.91498 -163.42526 438.19852
6360.0000 -166.23726 -162.70390 3.53336 1.92696 -163.22969 436.37993
6365.0000 -165.84810 -162.00507 3.84303 1.98120 -162.34382 456.82713
6370.0000 -166.59630 -162.56098 4.03532 1.99538 -162.11216 487.63137
6375.0000 -167.06208 -162.94235 4.11973 1.94589 -162.92049 442.45337
6380.0000 -166.37342 -162.59375 3.77967 1.94695 -162.90308 457.99179
6385.0000 -166.49468 -163.14275 3.35192 1.93261 -163.13733 434.95471
6390.0000 -167.08583 -162.87392 4.21191 1.92322 -163.29067 433.86971
6395.0000 -166.46024 -163.04425 3.41599 1.92172 -163.31521 430.81192
6400.0000 -165.94845 -162.27858 3.66988 1.95869 -162.71147 435.45617
6405.0000 -166.14559 -162.14686 3.99873 1.98039 -162.35701 476.52076
6410.0000 -166.66092 -162.59963 4.06129 1.98108 -162.34572 478.26572
6415.0000 -166.61710 -163.48491 3.13218 1.95272 -162.80884 461.84289
6420.0000 -167.79904 -164.39144 3.40760 1.86515 -164.23910 395.35003
6425.0000 -167.22007 -163.25658 3.96349 1.89357 -163.77489 426.50901
6430.0000 -167.13066 -163.82295 3.30770 1.94628 -162.91402 457.18798
6435.0000 -167.02417 -163.01047 4.01370 1.93278 -163.13460 443.99507
6440.0000 -166.65287 -163.11045 3.54242 1.94261 -162.97403 463.79906
6445.0000 -167.10824 -163.80402 3.30422 1.87944 -164.00576 414.84164
6450.0000 -167.13713 -162.94737 4.18976 1.92702 -163.22859 446.19761
6455.0000 -167.55268 -163.86406 3.68862 1.90928 -163.51840 441.13016
6460.0000 -167.69172 -164.12254 3.56918 1.86903 -164.17567 408.05063
6465.0000 -166.89834 -163.88995 3.00839 1.89517 -163.74881 422.39302
6470.0000 -167.43243 -163.71615 3.71628 1.90272 -163.62554 422.58993
6475.0000 -166.92747 -163.56405 3.36342 1.87531 -164.07321 401.70370
6480.0000 -167.62693 -164.03532 3.59161 1.90286 -163.62327 436.49800
6485.0000 -167.19477 -163.00469 4.19008 1.93487 -163.10040 465.20241
6490.0000 -166.38128 -162.50516 3.87612 1.96195 -162.65819 474.82741
6495.0000 -166.44131 -162.23262 4.20869 1.96947 -162.53531 460.47415
6500.0000 -166.54921 -162.75842 3.79079 1.97009 -162.52517 457.47980
FREEZING PROCESS: loop number 27 T-loop= 421.00000000000000
main_MD> interactions number 27 at Temperature= 421.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.54765 0.45727 4.70063
force_rgl> df(natom) 0.24104 -1.48961 -0.66501
6505.0000 -167.22815 -163.34206 3.88609 1.93218 -163.14439 428.62108
6510.0000 -166.52207 -162.94406 3.57800 1.90323 -163.61724 440.79846
6515.0000 -166.68816 -163.25473 3.43342 1.93927 -163.02860 442.89038
6520.0000 -167.45494 -163.43724 4.01770 1.91502 -163.42464 425.35558
6525.0000 -166.82572 -163.00067 3.82505 1.92117 -163.32420 420.42972
6530.0000 -167.06031 -162.99404 4.06627 1.93944 -163.02579 440.12071
6535.0000 -166.96923 -163.22654 3.74269 1.94674 -162.90658 441.63394
6540.0000 -167.07871 -163.70524 3.37347 1.91848 -163.36819 424.92200
6545.0000 -167.52777 -164.24740 3.28037 1.86131 -164.30174 376.05853
6550.0000 -167.50366 -163.61777 3.88589 1.88497 -163.91544 395.19293
6555.0000 -167.25578 -163.49262 3.76316 1.91082 -163.49314 410.36886
6560.0000 -166.15328 -162.71492 3.43836 1.96108 -162.67234 460.55414
6565.0000 -166.43911 -163.26941 3.16970 1.94137 -162.99434 433.99420
6570.0000 -167.42292 -164.00816 3.41476 1.89303 -163.78379 406.72824
6575.0000 -166.65117 -162.95991 3.69125 1.89940 -163.67980 419.09796
6580.0000 -166.75759 -163.62592 3.13167 1.92722 -163.22537 431.95214
6585.0000 -167.42809 -164.14991 3.27817 1.88395 -163.93203 395.03198
6590.0000 -167.50262 -164.14562 3.35700 1.88024 -163.99265 399.88416
6595.0000 -167.25998 -163.09727 4.16271 1.91977 -163.34699 434.95854
6600.0000 -166.56155 -162.48864 4.07291 1.95172 -162.82530 465.50133
6605.0000 -166.46649 -162.87396 3.59253 1.94855 -162.87698 455.83559
6610.0000 -167.52202 -163.87449 3.64753 1.92215 -163.30810 438.50065
6615.0000 -167.42896 -163.71944 3.70952 1.87812 -164.02717 396.12532
6620.0000 -166.72724 -163.01885 3.70839 1.93075 -163.16771 435.61579
6625.0000 -166.59540 -163.32255 3.27285 1.92674 -163.23316 431.03718
6630.0000 -166.89922 -163.21410 3.68512 1.94644 -162.91141 441.68221
6635.0000 -166.72956 -163.74508 2.98448 1.89707 -163.71769 407.43602
6640.0000 -166.99294 -163.53494 3.45800 1.90136 -163.64764 412.71681
6645.0000 -166.90611 -163.11820 3.78791 1.91432 -163.43613 425.72243
6650.0000 -167.20909 -163.84654 3.36255 1.88613 -163.89638 401.51686
6655.0000 -167.15948 -164.11095 3.04853 1.89727 -163.71457 412.44145
6660.0000 -166.91601 -163.50548 3.41052 1.88911 -163.84773 404.92771
6665.0000 -167.67382 -164.54014 3.13368 1.87639 -164.05552 391.90607
6670.0000 -167.70978 -164.35876 3.35102 1.85203 -164.45327 376.32841
6675.0000 -167.34471 -164.11443 3.23028 1.86105 -164.30602 381.17842
6680.0000 -167.34981 -163.63502 3.71479 1.90753 -163.54699 421.34919
6685.0000 -167.44633 -164.12835 3.31798 1.89716 -163.71630 411.54814
6690.0000 -167.69839 -164.45964 3.23875 1.85397 -164.42171 356.97431
6695.0000 -167.12405 -163.20473 3.91932 1.89649 -163.72719 424.95967
6700.0000 -167.17997 -163.73363 3.44634 1.88406 -163.93026 414.13912
6705.0000 -167.24668 -163.44305 3.80362 1.91372 -163.44581 432.19220
6710.0000 -166.67199 -163.22804 3.44396 1.89111 -163.81518 419.97509
6715.0000 -166.80949 -163.14075 3.66874 1.92102 -163.32663 443.81316
6720.0000 -167.48312 -163.90140 3.58172 1.90394 -163.60558 427.09889
6725.0000 -167.81688 -164.06447 3.75241 1.87993 -163.99770 403.73794
6730.0000 -167.50540 -163.74707 3.75833 1.88283 -163.95036 409.50993
6735.0000 -167.50188 -164.76573 2.73615 1.85480 -164.40818 383.03660
6740.0000 -167.51282 -163.89180 3.62102 1.86801 -164.19237 397.34462
6745.0000 -167.58474 -164.12503 3.45971 1.86692 -164.21011 400.27476
6750.0000 -167.92414 -165.17687 2.74728 1.84463 -164.57415 370.11596
FREEZING PROCESS: loop number 28 T-loop= 396.00000000000000
main_MD> interactions number 28 at Temperature= 396.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.07142 0.04022 -0.68626
force_rgl> df(natom) 2.19779 -1.03500 0.80237
6755.0000 -167.31235 -163.69974 3.61261 1.86118 -164.30399 372.68905
6760.0000 -166.93018 -164.00645 2.92373 1.89928 -163.68168 407.75242
6765.0000 -167.23518 -164.20339 3.03179 1.87176 -164.13110 374.13400
6770.0000 -167.12985 -163.59910 3.53075 1.87625 -164.05785 388.42992
6775.0000 -167.63896 -164.48399 3.15497 1.88825 -163.86174 410.02286
6780.0000 -167.54366 -164.59010 2.95356 1.82819 -164.84268 363.56262
6785.0000 -167.97623 -165.28592 2.69031 1.82252 -164.93532 354.18606
6790.0000 -167.43179 -164.19809 3.23370 1.84000 -164.64981 363.12789
6795.0000 -167.63607 -163.98785 3.64821 1.88313 -163.94545 405.15719
6800.0000 -167.73850 -164.04997 3.68853 1.88143 -163.97320 406.49374
6805.0000 -167.90803 -164.77253 3.13550 1.85627 -164.38418 388.78659
6810.0000 -167.70238 -164.64904 3.05333 1.83817 -164.67971 377.00191
6815.0000 -167.78584 -164.57760 3.20824 1.80963 -165.14587 345.37974
6820.0000 -167.48565 -164.33905 3.14660 1.85150 -164.46194 386.00786
6825.0000 -167.30307 -164.01788 3.28519 1.86640 -164.21864 391.31777
6830.0000 -167.85634 -164.75672 3.09962 1.84538 -164.56202 381.58252
6835.0000 -168.01157 -164.82386 3.18772 1.82421 -164.90770 360.63177
6840.0000 -168.05678 -164.62642 3.43036 1.84100 -164.63355 372.21700
6845.0000 -167.08580 -163.98115 3.10466 1.83540 -164.72494 362.83176
6850.0000 -167.79689 -164.22157 3.57532 1.88778 -163.86950 409.39661
6855.0000 -167.76303 -164.59709 3.16593 1.86530 -164.23655 394.29230
6860.0000 -167.60938 -164.63434 2.97504 1.84588 -164.55382 376.63231
6865.0000 -167.54956 -164.46427 3.08530 1.84033 -164.64448 373.57946
6870.0000 -167.80066 -164.38925 3.41141 1.84444 -164.57725 379.69485
6875.0000 -167.18522 -164.22970 2.95552 1.86222 -164.28695 391.83362
6880.0000 -168.15734 -164.71385 3.44349 1.84643 -164.54478 376.59863
6885.0000 -167.51832 -164.39630 3.12202 1.85895 -164.34038 390.70522
6890.0000 -167.68601 -164.22363 3.46238 1.87144 -164.13632 400.68448
6895.0000 -167.68549 -164.66914 3.01636 1.83720 -164.69549 374.93682
6900.0000 -167.58218 -164.56621 3.01597 1.83146 -164.78929 368.57269
6905.0000 -168.16277 -164.91538 3.24739 1.84388 -164.58651 380.70996
6910.0000 -167.41745 -164.05289 3.36457 1.84620 -164.54851 387.78743
6915.0000 -167.86995 -164.12226 3.74769 1.87254 -164.11843 408.52342
6920.0000 -167.21567 -164.17409 3.04158 1.85000 -164.48651 382.25870
6925.0000 -167.87581 -164.19453 3.68128 1.87120 -164.14025 402.63053
6930.0000 -167.37487 -163.90133 3.47354 1.87948 -164.00508 410.24476
6935.0000 -168.01879 -164.70304 3.31575 1.84587 -164.55400 381.14920
6940.0000 -167.28806 -163.92176 3.36631 1.86051 -164.31487 394.81310
6945.0000 -167.55924 -164.63772 2.92151 1.85883 -164.34227 387.17922
6950.0000 -167.02602 -163.09740 3.92862 1.90944 -163.51568 431.54542
6955.0000 -167.08758 -163.88416 3.20342 1.92345 -163.28695 427.14677
6960.0000 -167.98872 -164.72005 3.26867 1.84270 -164.60576 362.41834
6965.0000 -167.78714 -164.71165 3.07549 1.83939 -164.65978 374.47684
6970.0000 -167.38326 -164.04026 3.34300 1.85486 -164.40720 389.12779
6975.0000 -166.86014 -163.55666 3.30348 1.89031 -163.82824 412.58930
6980.0000 -168.13650 -165.03085 3.10565 1.86882 -164.17909 399.71336
6985.0000 -167.83442 -164.38602 3.44840 1.83868 -164.67142 377.64895
6990.0000 -167.27735 -163.83820 3.43915 1.87413 -164.09244 399.70143
6995.0000 -167.12812 -163.31399 3.81413 1.88659 -163.88899 409.13934
7000.0000 -167.44267 -164.52895 2.91372 1.90172 -163.64176 428.29396
FREEZING PROCESS: loop number 29 T-loop= 371.00000000000000
main_MD> interactions number 29 at Temperature= 371.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.18122 0.78686 0.19419
force_rgl> df(natom) -1.97158 0.09111 2.39602
7005.0000 -167.90966 -164.49359 3.41607 1.84250 -164.60899 372.78168
7010.0000 -167.95659 -164.83808 3.11851 1.82610 -164.87675 363.06575
7015.0000 -167.73481 -164.70157 3.03325 1.83547 -164.72384 357.84257
7020.0000 -168.19804 -164.74128 3.45676 1.85410 -164.41950 368.75094
7025.0000 -167.85264 -164.38301 3.46963 1.82911 -164.82765 368.15422
7030.0000 -167.54918 -164.13995 3.40923 1.87342 -164.10407 393.50272
7035.0000 -167.65887 -163.80661 3.85226 1.88513 -163.91272 414.37315
7040.0000 -167.74908 -165.04208 2.70700 1.85630 -164.38357 380.32295
7045.0000 -168.25479 -165.44428 2.81051 1.79676 -165.35605 322.94922
7050.0000 -167.96045 -164.96232 2.99813 1.80303 -165.25353 336.72337
7055.0000 -168.05176 -164.85706 3.19470 1.83206 -164.77947 356.26345
7060.0000 -166.84895 -163.53237 3.31658 1.87450 -164.08640 392.44610
7065.0000 -167.20646 -164.43229 2.77416 1.88680 -163.88558 404.84709
7070.0000 -167.80110 -164.64731 3.15379 1.83464 -164.73729 360.29146
7075.0000 -168.41109 -165.55516 2.85593 1.81821 -165.00561 366.53214
7080.0000 -167.90736 -164.65987 3.24749 1.80712 -165.18673 348.50799
7085.0000 -168.13847 -165.34293 2.79554 1.81857 -164.99982 357.87781
7090.0000 -168.16871 -165.41820 2.75051 1.79300 -165.41745 338.31942
7095.0000 -168.06196 -164.84997 3.21200 1.83663 -164.70489 373.80308
7100.0000 -167.47441 -164.29379 3.18061 1.85152 -164.46163 389.96511
7105.0000 -167.90984 -163.98533 3.92452 1.87873 -164.01728 413.00779
7110.0000 -167.51658 -163.71033 3.80625 1.88080 -163.98345 412.79054
7115.0000 -167.23431 -164.61214 2.62217 1.88337 -163.94145 412.94994
7120.0000 -167.78228 -164.85168 2.93060 1.83546 -164.72389 370.83138
7125.0000 -167.90813 -164.64395 3.26418 1.81634 -165.03622 355.87870
7130.0000 -167.60337 -164.51575 3.08761 1.84986 -164.48881 383.28563
7135.0000 -167.85167 -165.01579 2.83588 1.83487 -164.73364 370.53262
7140.0000 -168.07335 -164.62492 3.44843 1.83504 -164.73085 372.84353
7145.0000 -167.85167 -164.64612 3.20554 1.85907 -164.33830 390.88079
7150.0000 -167.53580 -163.83360 3.70220 1.85670 -164.37713 394.41727
7155.0000 -167.41417 -164.73232 2.68185 1.88663 -163.88834 417.60023
7160.0000 -167.19041 -164.20562 2.98479 1.82941 -164.82278 366.87402
7165.0000 -168.44851 -165.39173 3.05678 1.84133 -164.62813 380.51809
7170.0000 -167.94417 -164.53383 3.41034 1.82622 -164.87488 367.19295
7175.0000 -168.24491 -164.93809 3.30682 1.84026 -164.64556 369.52231
7180.0000 -168.05968 -165.59786 2.46182 1.80504 -165.22073 351.27717
7185.0000 -168.11748 -164.81690 3.30058 1.81098 -165.12383 361.44097
7190.0000 -168.27950 -164.99400 3.28550 1.82522 -164.89116 363.95323
7195.0000 -167.78595 -164.25737 3.52858 1.83560 -164.72169 375.06677
7200.0000 -167.22517 -164.07774 3.14744 1.87276 -164.11484 406.36162
7205.0000 -167.59408 -164.49904 3.09504 1.84114 -164.63124 377.73994
7210.0000 -168.01960 -164.23614 3.78346 1.86760 -164.19915 399.85009
7215.0000 -167.99464 -164.41343 3.58121 1.85208 -164.45254 389.76642
7220.0000 -167.71914 -164.54520 3.17394 1.85217 -164.45098 389.59638
7225.0000 -167.78039 -164.30225 3.47813 1.85013 -164.48431 384.46850
7230.0000 -167.58741 -164.39141 3.19600 1.87092 -164.14492 391.62838
7235.0000 -167.18882 -164.01516 3.17366 1.85305 -164.43662 373.42104
7240.0000 -167.33746 -164.47368 2.86379 1.86445 -164.25045 385.41878
7245.0000 -167.55874 -164.30246 3.25628 1.86988 -164.16181 392.42184
7250.0000 -168.01392 -164.96229 3.05163 1.82693 -164.86332 356.70804
FREEZING PROCESS: loop number 30 T-loop= 346.00000000000000
main_MD> interactions number 30 at Temperature= 346.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.59604 -0.31030 1.61012
force_rgl> df(natom) 0.02635 1.58832 -0.49130
7255.0000 -167.84733 -165.05316 2.79416 1.82309 -164.92598 360.97377
7260.0000 -168.39132 -165.63895 2.75237 1.79616 -165.36586 338.41729
7265.0000 -168.89523 -166.00529 2.88994 1.74631 -166.17995 300.02476
7270.0000 -168.29787 -165.51731 2.78056 1.76441 -165.88441 311.60128
7275.0000 -167.86427 -164.66994 3.19433 1.81857 -164.99985 352.73127
7280.0000 -167.94805 -165.03699 2.91106 1.82631 -164.87340 364.81515
7285.0000 -168.34127 -165.39834 2.94293 1.81201 -165.10688 354.58909
7290.0000 -168.48040 -165.62880 2.85159 1.78101 -165.61321 323.38495
7295.0000 -168.51045 -166.09916 2.41129 1.78096 -165.61406 331.19198
7300.0000 -168.04516 -165.11610 2.92906 1.80398 -165.23813 344.66027
7305.0000 -168.17768 -165.64311 2.53458 1.79968 -165.30824 340.92956
7310.0000 -168.30988 -165.12067 3.18921 1.79532 -165.37956 337.21142
7315.0000 -168.73199 -166.14254 2.58946 1.76791 -165.82715 317.73343
7320.0000 -168.82561 -165.89407 2.93153 1.74522 -166.19773 293.48420
7325.0000 -168.11500 -165.13715 2.97784 1.80244 -165.26325 342.70963
7330.0000 -167.82108 -164.27022 3.55087 1.85136 -164.46435 385.64915
7335.0000 -168.47827 -165.41360 3.06467 1.83337 -164.75812 374.08847
7340.0000 -168.93283 -165.90707 3.02577 1.76382 -165.89400 309.31869
7345.0000 -168.23687 -165.47505 2.76182 1.75971 -165.96114 307.30091
7350.0000 -168.22404 -165.05728 3.16676 1.80901 -165.15588 354.88065
7355.0000 -168.43709 -165.16476 3.27233 1.80257 -165.26117 349.30813
7360.0000 -168.08064 -165.20693 2.87370 1.82000 -164.97653 355.82962
7365.0000 -168.17610 -165.63806 2.53804 1.81148 -165.11552 355.04168
7370.0000 -168.12213 -165.29761 2.82452 1.80283 -165.25685 344.32387
7375.0000 -167.92703 -164.80591 3.12112 1.81186 -165.10942 351.62870
7380.0000 -168.49229 -165.45074 3.04155 1.80466 -165.22692 345.07117
7385.0000 -168.68554 -165.71773 2.96781 1.77155 -165.76775 321.69278
7390.0000 -168.56020 -165.38171 3.17849 1.79244 -165.42647 336.48601
7395.0000 -167.97098 -164.86304 3.10794 1.80826 -165.16821 343.99808
7400.0000 -167.66942 -164.70606 2.96335 1.82145 -164.95278 358.25282
7405.0000 -168.57901 -165.58967 2.98934 1.81295 -165.09158 352.50268
7410.0000 -168.17792 -165.32862 2.84931 1.80417 -165.23504 347.88572
7415.0000 -167.91303 -165.41119 2.50184 1.80009 -165.30163 340.12938
7420.0000 -168.05544 -164.89236 3.16308 1.80610 -165.20354 338.48154
7425.0000 -167.99290 -164.98055 3.01235 1.81924 -164.98882 348.23043
7430.0000 -167.90697 -164.72669 3.18028 1.81009 -165.13831 340.27133
7435.0000 -167.62175 -164.63690 2.98485 1.84763 -164.52513 376.74904
7440.0000 -168.61596 -165.11793 3.49803 1.82792 -164.84710 356.96500
7445.0000 -167.85848 -164.94288 2.91560 1.79679 -165.35550 340.80858
7450.0000 -167.79149 -164.51291 3.27859 1.83016 -164.81056 368.22929
7455.0000 -168.21045 -165.22004 2.99042 1.82353 -164.91885 359.08063
7460.0000 -168.17576 -165.00658 3.16918 1.82271 -164.93221 360.42493
7465.0000 -167.87986 -164.74685 3.13301 1.83670 -164.70372 374.17515
7470.0000 -168.39550 -165.20242 3.19308 1.78441 -165.55773 333.97378
7475.0000 -168.16551 -165.14179 3.02372 1.81533 -165.05277 356.67382
7480.0000 -168.49232 -165.61888 2.87344 1.79835 -165.33008 338.28465
7485.0000 -168.10190 -165.04756 3.05435 1.79751 -165.34380 342.45293
7490.0000 -168.11121 -165.14232 2.96889 1.80114 -165.28446 347.29695
7495.0000 -168.17571 -164.99606 3.17965 1.82337 -164.92142 363.65171
7500.0000 -168.52915 -165.90251 2.62665 1.80170 -165.27532 336.93052
FREEZING PROCESS: loop number 31 T-loop= 321.00000000000000
main_MD> interactions number 31 at Temperature= 321.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.86311 -0.58507 -1.01662
force_rgl> df(natom) -1.92564 -1.47085 1.35356
7505.0000 -168.60212 -165.85682 2.74530 1.77005 -165.79217 317.75117
7510.0000 -168.26106 -165.51511 2.74595 1.77274 -165.74833 317.50787
7515.0000 -168.71075 -165.95470 2.75606 1.77800 -165.66240 322.04853
7520.0000 -168.92047 -165.84646 3.07401 1.78337 -165.57462 329.97017
7525.0000 -168.45509 -165.84722 2.60787 1.76730 -165.83718 314.23757
7530.0000 -168.47146 -165.95304 2.51842 1.76651 -165.85004 311.40333
7535.0000 -168.91838 -165.46897 3.44941 1.77265 -165.74976 316.71712
7540.0000 -168.71325 -166.45727 2.25598 1.75370 -166.05916 302.44103
7545.0000 -168.53433 -166.07495 2.45938 1.74315 -166.23152 292.41009
7550.0000 -168.62587 -166.23529 2.39058 1.78771 -165.50383 330.35039
7555.0000 -168.41620 -165.82353 2.59268 1.75472 -166.04254 300.60771
7560.0000 -168.90174 -166.33120 2.57055 1.74692 -166.16988 293.18709
7565.0000 -168.53391 -166.16065 2.37326 1.73525 -166.36050 285.04756
7570.0000 -168.72152 -165.95727 2.76425 1.76059 -165.94671 306.44957
7575.0000 -168.71377 -165.72153 2.99224 1.77152 -165.76815 313.81163
7580.0000 -168.20102 -165.17451 3.02651 1.78994 -165.46733 332.96716
7585.0000 -167.96739 -165.54876 2.41863 1.79453 -165.39235 337.08069
7590.0000 -168.34956 -165.59597 2.75359 1.77916 -165.64346 325.10162
7595.0000 -168.30093 -165.56798 2.73295 1.78553 -165.53934 330.03977
7600.0000 -168.42184 -165.40838 3.01346 1.78530 -165.54314 326.21634
7605.0000 -167.90923 -165.55526 2.35397 1.78073 -165.61785 323.36693
7610.0000 -168.45251 -166.43735 2.01516 1.75318 -166.06781 304.86479
7615.0000 -167.93380 -165.43420 2.49960 1.77053 -165.78436 316.84042
7620.0000 -168.07870 -165.67442 2.40428 1.77744 -165.67145 320.89047
7625.0000 -167.96237 -165.18915 2.77322 1.80300 -165.25405 339.47020
7630.0000 -168.96479 -166.33655 2.62824 1.77019 -165.78991 317.80282
7635.0000 -169.01418 -166.76436 2.24982 1.74486 -166.20358 294.88957
7640.0000 -167.95495 -165.44045 2.51450 1.77413 -165.72553 324.50109
7645.0000 -168.06454 -165.22416 2.84037 1.79513 -165.38257 340.83734
7650.0000 -168.73927 -165.89945 2.83981 1.78072 -165.61788 329.84317
7655.0000 -168.16277 -165.38918 2.77358 1.76581 -165.86152 312.19709
7660.0000 -168.81095 -165.81589 2.99505 1.79012 -165.46450 335.00924
7665.0000 -168.93129 -165.92910 3.00219 1.77822 -165.65872 325.12542
7670.0000 -168.55007 -165.83051 2.71956 1.77916 -165.64348 320.38514
7675.0000 -168.35830 -165.64556 2.71274 1.76456 -165.88184 313.84107
7680.0000 -168.36678 -165.61654 2.75025 1.76255 -165.91473 310.32647
7685.0000 -168.28215 -164.93105 3.35110 1.78968 -165.47162 337.47873
7690.0000 -167.46756 -164.93623 2.53133 1.81970 -164.98135 359.38288
7695.0000 -168.79422 -165.61014 3.18408 1.78901 -165.48250 329.49995
7700.0000 -168.19847 -165.36215 2.83632 1.75951 -165.96443 308.75808
7705.0000 -168.02563 -165.13874 2.88689 1.79408 -165.39982 337.55951
7710.0000 -168.28042 -165.91096 2.36946 1.78730 -165.51056 326.24144
7715.0000 -168.15091 -165.01521 3.13570 1.80099 -165.28692 343.86956
7720.0000 -168.47137 -165.08507 3.38630 1.80992 -165.14112 354.61827
7725.0000 -168.03996 -165.42255 2.61741 1.79920 -165.31608 338.86797
7730.0000 -168.25036 -165.70356 2.54680 1.78765 -165.50486 328.24276
7735.0000 -168.38397 -165.55917 2.82480 1.77457 -165.71832 321.65240
7740.0000 -168.46160 -166.22693 2.23466 1.77646 -165.68748 321.79258
7745.0000 -168.40184 -165.24080 3.16104 1.77731 -165.67368 319.26602
7750.0000 -168.35119 -165.93750 2.41369 1.77624 -165.69120 320.82056
main_MD> EXECUTION TIME: 0 [day], 0 [hour], 13 [min], 1.9390508 [s].
main_MD> Deallocating global variables
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