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nanoparticlesims/growth_Melting_Silver_ICO_2451/freezeSims/run_87/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_87.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 = 87 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: 87 8700
main_MD> Size of nv and nvoiz: 87 8700
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 = 87
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> 9.8403104448687453E-002 -4.8793592097571614E-002 -0.13502755593238297 initial drift of cluster / NP1 for coalescence
init> 0.33546954725269157 0.35291501888896903 0.32952706456621927 scaling for velocity /for coalescence NP1
init.f90 > facguy = 3.5414169450628009E-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) -0.90540 -1.75437 0.60514
force_rgl> df(natom) 2.09619 1.74153 -0.19058
preparo> THERMALIZATION PROCESS AT 1086.6465021337378
preparo> TOTAL ENERGY, KINETIC EN., POT. ENERGY, DELTA
5000 -195.43493396304945 12.915762779138257 -208.35069674218769 6.5639543560064230E-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= 1063.0000000000000
main_MD> interactions number 1 at Temperature= 1063.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.30677 -2.52367 -0.01248
force_rgl> df(natom) 1.38176 -3.14074 -2.02949
5.0000 -208.25148 -194.94602 13.30546 3.11948 -195.40156 1115.02367
10.0000 -210.85404 -196.34889 14.50515 3.05649 -196.63836 1045.43691
15.0000 -206.57269 -191.31262 15.26007 3.19328 -193.95260 1141.58162
20.0000 -210.05755 -194.65382 15.40374 3.21294 -193.56661 1163.86937
25.0000 -207.10128 -193.48434 13.61694 3.12068 -195.37801 1125.01193
30.0000 -210.82071 -197.56880 13.25191 3.09919 -195.79985 1088.88064
35.0000 -209.14958 -196.59828 12.55129 3.00947 -197.56152 1049.06660
40.0000 -208.80740 -199.22922 9.57818 3.00358 -197.67714 1067.48043
45.0000 -208.24665 -194.58876 13.65789 3.05764 -196.61569 1086.94571
50.0000 -208.20461 -196.13771 12.06689 3.10683 -195.64992 1103.18020
55.0000 -208.45993 -198.12808 10.33186 3.01109 -197.52973 1037.94124
60.0000 -210.78769 -200.24859 10.53910 2.99478 -197.85001 1027.33993
65.0000 -209.77047 -199.22392 10.54655 2.88099 -200.08416 966.04072
70.0000 -205.69496 -192.82750 12.86746 3.15288 -194.74573 1140.71136
75.0000 -208.74222 -197.17540 11.56682 3.13900 -195.01837 1105.55407
80.0000 -207.04030 -194.94052 12.09978 3.08518 -196.07504 1071.64570
85.0000 -206.60465 -192.76945 13.83520 3.20047 -193.81135 1146.85797
90.0000 -208.61241 -196.74890 11.86351 3.16000 -194.60605 1152.50292
95.0000 -207.03309 -195.20594 11.82715 3.09466 -195.88878 1083.83468
100.0000 -209.41907 -196.72116 12.69791 3.14203 -194.95882 1125.15090
105.0000 -206.94819 -195.02653 11.92166 3.10935 -195.60054 1103.27802
110.0000 -209.98957 -198.47536 11.51422 3.04853 -196.79460 1060.11844
115.0000 -208.52962 -196.00282 12.52680 3.08424 -196.09343 1094.68189
120.0000 -209.54568 -197.16732 12.37836 3.03291 -197.10128 1064.02909
125.0000 -208.46516 -197.19599 11.26917 3.03103 -197.13812 1066.55073
130.0000 -209.18851 -197.30551 11.88299 3.13724 -195.05282 1119.07632
135.0000 -209.28409 -197.67382 11.61027 3.05000 -196.76575 1063.95967
140.0000 -205.33380 -195.31031 10.02349 3.05256 -196.71540 1062.73319
145.0000 -208.43107 -195.66028 12.77078 3.09840 -195.81553 1106.59637
150.0000 -208.33643 -196.93464 11.40179 3.07387 -196.29713 1090.80734
155.0000 -209.94759 -199.54370 10.40389 3.00353 -197.67821 1024.72159
160.0000 -211.17203 -198.16707 13.00496 2.99338 -197.87745 1049.54234
165.0000 -208.47523 -197.06368 11.41156 3.00191 -197.70986 1047.67805
170.0000 -209.51314 -197.54977 11.96337 3.01957 -197.36327 1051.95300
175.0000 -210.45212 -199.29722 11.15490 2.89294 -199.84942 974.24486
180.0000 -209.28355 -199.26551 10.01804 2.95093 -198.71085 994.56210
185.0000 -208.12087 -196.20421 11.91666 3.00774 -197.59554 1063.70227
190.0000 -205.23589 -192.90281 12.33307 3.11023 -195.58320 1068.79166
195.0000 -207.71628 -196.65952 11.05675 3.13962 -195.00606 1086.60668
200.0000 -205.45129 -193.23317 12.21811 3.13320 -195.13214 1107.99970
205.0000 -209.32386 -197.32530 11.99857 3.12144 -195.36311 1089.80143
210.0000 -209.40900 -194.72325 14.68575 3.13745 -195.04873 1121.82397
215.0000 -208.05848 -195.01189 13.04658 3.19037 -194.00977 1182.87087
220.0000 -207.23119 -196.32810 10.90309 3.09406 -195.90075 1075.85662
225.0000 -208.07735 -195.22236 12.85498 3.16372 -194.53296 1151.83842
230.0000 -208.58608 -196.96296 11.62312 3.13684 -195.06071 1128.20077
235.0000 -209.28786 -197.31975 11.96811 3.06210 -196.52820 1057.04634
240.0000 -209.29683 -196.41626 12.88057 3.10761 -195.63466 1087.06484
245.0000 -210.36006 -198.63263 11.72744 2.97363 -198.26511 1042.40870
250.0000 -209.46736 -196.19247 13.27489 3.10334 -195.71852 1100.21359
FREEZING PROCESS: loop number 2 T-loop= 1038.0000000000000
main_MD> interactions number 2 at Temperature= 1038.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 3.73703 -2.23333 -1.66219
force_rgl> df(natom) -1.96803 -0.71512 -0.06601
255.0000 -207.09243 -194.84180 12.25062 3.10434 -195.69881 1117.93862
260.0000 -209.41731 -196.64385 12.77345 3.07268 -196.32041 1046.97417
265.0000 -210.05432 -197.66382 12.39050 3.03114 -197.13600 1074.91592
270.0000 -209.74073 -198.70078 11.03994 2.97082 -198.32030 1035.40967
275.0000 -207.29498 -198.00045 9.29453 3.03136 -197.13164 1035.50010
280.0000 -210.56028 -196.73227 13.82802 2.97167 -198.30365 995.91923
285.0000 -208.61453 -195.89649 12.71804 3.09901 -195.80350 1081.37405
290.0000 -212.01492 -198.94676 13.06816 3.01195 -197.51283 1041.43802
295.0000 -208.40554 -196.57152 11.83402 2.98686 -198.00545 1007.04298
300.0000 -208.37890 -194.16715 14.21175 3.05931 -196.58286 1063.49047
305.0000 -210.49922 -197.16840 13.33082 3.08177 -196.14203 1091.87538
310.0000 -208.15954 -197.04968 11.10986 3.05640 -196.64016 1088.07920
315.0000 -208.54764 -195.78856 12.75908 3.02464 -197.26373 1031.84778
320.0000 -206.91423 -193.81723 13.09700 3.15600 -194.68449 1106.96280
325.0000 -208.60726 -197.56137 11.04588 3.10279 -195.72917 1098.61357
330.0000 -211.10215 -200.32567 10.77648 2.94899 -198.74901 1004.62293
335.0000 -207.83410 -196.04839 11.78571 3.05491 -196.66934 1087.13531
340.0000 -209.82062 -196.71614 13.10448 3.09612 -195.86018 1100.76106
345.0000 -208.63688 -195.38453 13.25235 3.01259 -197.50030 1056.38867
350.0000 -209.63363 -197.98991 11.64372 3.03895 -196.98274 1070.65021
355.0000 -211.45902 -199.16200 12.29703 2.97179 -198.30124 1009.49516
360.0000 -207.56775 -195.25992 12.30783 3.07317 -196.31076 1065.75194
365.0000 -207.41341 -195.84844 11.56498 3.12553 -195.28277 1106.45190
370.0000 -209.88672 -196.95889 12.92783 3.13541 -195.08886 1136.62847
375.0000 -207.69141 -197.03672 10.65469 2.98691 -198.00455 1037.59356
380.0000 -209.74120 -196.94036 12.80084 3.02358 -197.28452 1075.12420
385.0000 -209.78040 -198.84484 10.93556 2.96686 -198.39813 1037.92405
390.0000 -210.87441 -197.61114 13.26327 2.94945 -198.73987 996.67497
395.0000 -209.69310 -198.95918 10.73392 2.98356 -198.07015 1037.18306
400.0000 -211.51867 -199.91389 11.60478 2.92817 -199.15774 990.01004
405.0000 -208.66824 -197.87671 10.79153 2.99028 -197.93827 1011.92689
410.0000 -209.49066 -198.54911 10.94155 2.97048 -198.32705 1009.88119
415.0000 -210.39421 -197.79206 12.60215 2.94686 -198.79072 1006.52087
420.0000 -208.59160 -194.59135 14.00025 3.04827 -196.79964 1066.77051
425.0000 -211.83026 -199.69742 12.13284 3.09323 -195.91697 1076.96184
430.0000 -210.98532 -199.98466 11.00066 2.87479 -200.20580 958.57364
435.0000 -208.96929 -197.83573 11.13356 2.97299 -198.27779 1037.11982
440.0000 -208.78551 -197.58596 11.19954 2.99866 -197.77368 1029.21481
445.0000 -210.27643 -198.99473 11.28170 2.95651 -198.60138 1005.89269
450.0000 -209.92663 -198.28550 11.64113 2.95979 -198.53704 1008.43324
455.0000 -208.38893 -198.57144 9.81749 2.97351 -198.26758 1005.45621
460.0000 -209.57572 -195.25690 14.31882 2.96872 -198.36163 1026.29309
465.0000 -209.77449 -197.44962 12.32487 3.12422 -195.30852 1108.33939
470.0000 -208.36087 -195.32651 13.03437 3.05657 -196.63670 1060.89127
475.0000 -209.56387 -198.65223 10.91164 3.01979 -197.35891 1029.81538
480.0000 -206.78264 -194.75961 12.02302 3.03127 -197.13347 1032.79826
485.0000 -211.32036 -200.22716 11.09320 3.04799 -196.80517 1029.76188
490.0000 -210.46859 -198.60854 11.86005 2.94444 -198.83837 1005.56814
495.0000 -211.75994 -200.63505 11.12489 2.91444 -199.42734 967.91504
500.0000 -211.21622 -199.70546 11.51077 2.84205 -200.84859 923.76371
FREEZING PROCESS: loop number 3 T-loop= 1013.0000000000000
main_MD> interactions number 3 at Temperature= 1013.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.02836 2.09214 -1.77401
force_rgl> df(natom) 0.11901 -0.14577 -1.18059
505.0000 -212.19321 -202.24967 9.94353 2.82194 -201.24355 980.99072
510.0000 -210.20078 -199.90484 10.29594 2.77900 -202.08665 906.25711
515.0000 -210.53376 -196.54994 13.98382 2.96595 -198.41603 976.14938
520.0000 -208.58076 -194.73340 13.84737 3.04167 -196.92937 1033.97284
525.0000 -210.25081 -197.19557 13.05524 3.12956 -195.20372 1134.63330
530.0000 -211.62276 -199.44051 12.18224 2.97747 -198.18974 1041.79194
535.0000 -209.78378 -199.27193 10.51185 2.89525 -199.80420 978.67727
540.0000 -211.39302 -200.44497 10.94804 2.86556 -200.38699 968.49574
545.0000 -209.59475 -199.34304 10.25171 2.85868 -200.52215 950.57440
550.0000 -210.80841 -199.57055 11.23786 2.89859 -199.73855 972.38081
555.0000 -208.93107 -199.35434 9.57673 2.88629 -199.98005 987.06844
560.0000 -209.73814 -196.30291 13.43522 2.97044 -198.32783 1039.42947
565.0000 -208.57756 -197.57047 11.00709 3.04513 -196.86136 1087.81885
570.0000 -210.52922 -198.86225 11.66697 2.97725 -198.19422 1018.57103
575.0000 -210.50792 -197.19894 13.30898 3.03432 -197.07369 1064.90359
580.0000 -209.28012 -197.77218 11.50794 3.00440 -197.66101 1049.97666
585.0000 -210.53611 -199.52491 11.01120 2.92137 -199.29135 974.03372
590.0000 -210.30220 -198.89056 11.41164 2.92390 -199.24160 980.17772
595.0000 -209.57175 -199.66335 9.90840 2.95807 -198.57068 993.87201
600.0000 -210.35775 -198.39711 11.96064 2.99024 -197.93899 1023.54364
605.0000 -210.46457 -198.10324 12.36132 2.94815 -198.76551 999.83978
610.0000 -209.61236 -198.02101 11.59135 3.02197 -197.31611 1038.73266
615.0000 -211.78886 -199.64642 12.14244 2.90765 -199.56068 983.98175
620.0000 -210.43094 -199.01244 11.41850 2.87377 -200.22580 943.56899
625.0000 -209.76271 -198.98227 10.78044 2.92296 -199.26003 974.47326
630.0000 -210.51812 -198.66424 11.85387 2.92522 -199.21560 975.05247
635.0000 -210.21645 -198.77045 11.44600 2.95015 -198.72626 1012.40651
640.0000 -209.17467 -198.23968 10.93499 2.91250 -199.46536 989.00392
645.0000 -210.20578 -198.54037 11.66542 3.04688 -196.82705 1034.65606
650.0000 -210.06494 -198.63437 11.43057 2.96299 -198.47403 1020.20728
655.0000 -209.17173 -198.72535 10.44638 2.94033 -198.91903 1023.17366
660.0000 -211.70164 -199.93018 11.77147 2.96499 -198.43478 1022.43969
665.0000 -209.55181 -199.76839 9.78341 2.91032 -199.50832 968.98626
670.0000 -211.61664 -201.90013 9.71651 2.86121 -200.47244 953.85293
675.0000 -210.39326 -198.05924 12.33402 2.88515 -200.00242 976.88365
680.0000 -211.52372 -198.32428 13.19943 2.96321 -198.46983 1025.95032
685.0000 -209.81820 -198.57125 11.24696 2.94546 -198.81839 994.68524
690.0000 -210.50465 -198.50370 12.00095 2.99536 -197.83865 1059.52067
695.0000 -209.79808 -198.98477 10.81331 2.95138 -198.70207 1009.60093
700.0000 -210.83916 -200.08947 10.74969 2.91044 -199.50597 982.30452
705.0000 -210.64459 -199.00041 11.64418 2.89107 -199.88617 950.84626
710.0000 -212.31427 -200.56160 11.75268 2.88704 -199.96530 978.72225
715.0000 -213.26287 -202.54773 10.71514 2.79483 -201.77576 928.54844
720.0000 -211.92047 -199.08500 12.83547 2.89091 -199.88929 992.60629
725.0000 -210.79144 -201.01720 9.77424 2.91450 -199.42608 975.35128
730.0000 -211.34112 -200.69373 10.64739 2.86759 -200.34716 956.57617
735.0000 -209.77776 -197.86566 11.91210 2.95829 -198.56648 1012.87182
740.0000 -211.58260 -199.00753 12.57507 2.91873 -199.34313 998.29177
745.0000 -210.02404 -198.90400 11.12004 2.97370 -198.26374 1003.91733
750.0000 -210.42593 -199.08790 11.33802 2.89790 -199.75218 948.76535
FREEZING PROCESS: loop number 4 T-loop= 988.00000000000000
main_MD> interactions number 4 at Temperature= 988.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -3.19767 -3.05772 -1.28453
force_rgl> df(natom) 0.61205 -0.26757 -1.57364
755.0000 -209.70768 -198.97264 10.73504 2.96435 -198.44739 1043.87633
760.0000 -210.90456 -199.76642 11.13814 2.88580 -199.98966 993.15933
765.0000 -209.06737 -199.15670 9.91067 2.88081 -200.08765 953.42101
770.0000 -212.61275 -199.94672 12.66603 2.93969 -198.93155 1014.89701
775.0000 -211.47226 -201.97575 9.49651 2.80295 -201.61637 917.13037
780.0000 -211.93863 -202.18934 9.74929 2.80932 -201.49134 894.24056
785.0000 -211.82586 -199.76175 12.06412 2.87181 -200.26432 948.50172
790.0000 -211.20185 -198.76609 12.43577 2.88855 -199.93571 960.59965
795.0000 -210.88021 -200.27827 10.60194 2.89527 -199.80376 951.53537
800.0000 -212.13090 -202.43960 9.69130 2.77759 -202.11429 920.78932
805.0000 -211.49676 -201.85229 9.64447 2.79248 -201.82184 895.98382
810.0000 -212.35262 -201.88851 10.46411 2.77795 -202.10720 912.69445
815.0000 -211.23824 -201.55990 9.67834 2.80213 -201.63237 922.61745
820.0000 -211.18320 -200.00816 11.17504 2.85948 -200.50650 954.67173
825.0000 -212.76596 -203.08986 9.67610 2.81509 -201.37805 932.97450
830.0000 -212.08757 -200.52912 11.55845 2.78361 -201.99611 922.40578
835.0000 -212.09254 -201.17535 10.91719 2.80972 -201.48353 910.81477
840.0000 -211.85030 -200.72437 11.12593 2.78553 -201.95843 896.88090
845.0000 -211.02262 -200.27306 10.74956 2.88734 -199.95935 949.98753
850.0000 -208.15971 -198.78484 9.37486 2.92666 -199.18746 979.51945
855.0000 -210.53485 -198.33231 12.20255 2.92903 -199.14087 1001.48443
860.0000 -211.84499 -198.63643 13.20857 2.98151 -198.11052 1025.40688
865.0000 -210.40344 -199.11145 11.29199 2.90539 -199.60509 979.18723
870.0000 -209.01592 -198.48644 10.52948 2.93610 -199.00216 976.52751
875.0000 -209.04046 -198.72721 10.31324 2.94736 -198.78100 999.35651
880.0000 -210.53413 -198.39440 12.13973 2.92560 -199.20831 984.64385
885.0000 -209.75825 -197.17572 12.58253 3.00387 -197.67138 1036.56563
890.0000 -209.99616 -199.36141 10.63475 2.99061 -197.93191 1041.22317
895.0000 -210.47022 -201.16369 9.30653 2.87626 -200.17693 952.06409
900.0000 -209.28138 -198.44586 10.83552 2.88171 -200.07006 981.24871
905.0000 -207.92471 -198.91473 9.00999 2.98956 -197.95240 1045.10399
910.0000 -209.44697 -200.01695 9.43002 2.88943 -199.91837 947.02070
915.0000 -209.99725 -198.28277 11.71449 2.93203 -199.08198 980.15127
920.0000 -209.44193 -196.84716 12.59477 3.00964 -197.55810 1036.43523
925.0000 -210.53772 -198.59950 11.93821 3.04558 -196.85250 1054.41048
930.0000 -211.48392 -199.72182 11.76210 2.87178 -200.26492 935.02082
935.0000 -209.28030 -197.22786 12.05244 2.97961 -198.14787 980.43102
940.0000 -209.44089 -196.84431 12.59658 3.04701 -196.82436 1080.93395
945.0000 -211.69545 -200.61897 11.07649 2.94983 -198.73244 1010.60930
950.0000 -210.45922 -197.86713 12.59209 2.95193 -198.69119 1017.75766
955.0000 -209.66825 -198.30136 11.36689 2.97215 -198.29419 1025.82389
960.0000 -209.47036 -199.03924 10.43113 2.93906 -198.94395 979.25780
965.0000 -211.89006 -200.69295 11.19712 2.89823 -199.74571 976.43327
970.0000 -211.50639 -199.48936 12.01704 2.90966 -199.52130 995.04663
975.0000 -211.48914 -200.45755 11.03159 2.86256 -200.44604 973.26986
980.0000 -207.92605 -195.80794 12.11812 3.03986 -196.96479 1089.48287
985.0000 -209.60275 -197.40355 12.19920 2.97556 -198.22728 1016.03457
990.0000 -207.22363 -196.67455 10.54908 2.97369 -198.26401 1008.33848
995.0000 -211.32811 -197.31804 14.01007 2.99284 -197.88798 1061.30577
1000.0000 -209.81746 -197.82273 11.99473 2.96441 -198.44629 1028.02239
FREEZING PROCESS: loop number 5 T-loop= 963.00000000000000
main_MD> interactions number 5 at Temperature= 963.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 3.19781 -3.58531 -0.86355
force_rgl> df(natom) 3.28611 1.65595 -0.38250
1005.0000 -210.27926 -200.21266 10.06660 2.92603 -199.19971 968.77177
1010.0000 -209.02408 -198.19201 10.83207 2.93114 -199.09953 1021.47443
1015.0000 -208.78430 -198.59905 10.18524 2.94945 -198.73990 1002.02429
1020.0000 -210.10611 -199.02176 11.08435 2.98134 -198.11386 1014.15010
1025.0000 -210.02464 -199.95028 10.07436 2.88788 -199.94880 934.91834
1030.0000 -211.07423 -199.10451 11.96972 2.90519 -199.60894 966.20633
1035.0000 -212.14504 -200.00557 12.13946 2.89663 -199.77695 975.45845
1040.0000 -211.62704 -201.13207 10.49496 2.87947 -200.11390 943.61868
1045.0000 -210.50589 -199.49947 11.00642 2.85613 -200.57220 928.43174
1050.0000 -211.58960 -200.04278 11.54681 2.88388 -200.02743 961.13914
1055.0000 -212.04128 -200.58562 11.45567 2.83406 -201.00552 909.34389
1060.0000 -209.84725 -200.71542 9.13183 2.83905 -200.90761 929.47538
1065.0000 -211.72599 -200.25230 11.47369 2.85171 -200.65907 929.78057
1070.0000 -211.06151 -201.06980 9.99170 2.84159 -200.85776 911.74525
1075.0000 -214.03158 -202.94396 11.08762 2.79798 -201.71387 894.28424
1080.0000 -211.57730 -199.27472 12.30258 2.84834 -200.72513 916.41603
1085.0000 -208.74581 -197.77907 10.96674 2.95839 -198.56448 1015.03814
1090.0000 -212.97296 -201.87874 11.09421 2.90191 -199.67330 967.76390
1095.0000 -211.12447 -199.93286 11.19161 2.84293 -200.83144 935.52615
1100.0000 -213.57578 -202.46432 11.11146 2.84318 -200.82657 935.98791
1105.0000 -212.87646 -203.11560 9.76086 2.74018 -202.84886 870.94716
1110.0000 -211.11269 -200.00473 11.10796 2.83630 -200.96164 933.29549
1115.0000 -211.47290 -201.78958 9.68332 2.85090 -200.67489 923.43236
1120.0000 -210.04182 -200.21574 9.82608 2.82518 -201.17997 908.09806
1125.0000 -211.19155 -199.47000 11.72155 2.89495 -199.81009 988.17247
1130.0000 -212.97325 -202.46779 10.50546 2.78953 -201.87978 927.51219
1135.0000 -212.08212 -202.50528 9.57685 2.80061 -201.66233 925.65883
1140.0000 -212.82532 -202.50276 10.32256 2.74481 -202.75786 893.80867
1145.0000 -211.90788 -200.84516 11.06273 2.87993 -200.10483 931.40421
1150.0000 -211.44840 -200.91886 10.52954 2.81737 -201.33324 937.99424
1155.0000 -209.39392 -200.32197 9.07195 2.85424 -200.60925 949.16830
1160.0000 -210.78098 -199.59324 11.18774 2.91880 -199.34166 954.64953
1165.0000 -210.12517 -198.64242 11.48275 2.90006 -199.70972 977.83239
1170.0000 -209.95843 -200.56416 9.39427 2.85438 -200.60654 945.64635
1175.0000 -209.02570 -198.71374 10.31197 2.87110 -200.27821 942.98164
1180.0000 -210.86139 -198.66750 12.19389 2.87050 -200.29012 951.06520
1185.0000 -211.00702 -198.60900 12.39802 2.97073 -198.32207 1019.55204
1190.0000 -209.02761 -198.76528 10.26233 2.91174 -199.48041 1011.72658
1195.0000 -211.29186 -199.65156 11.64030 2.94340 -198.85875 1024.71507
1200.0000 -211.75303 -200.92578 10.82725 2.87152 -200.27008 955.87257
1205.0000 -210.92346 -200.75632 10.16714 2.85417 -200.61070 946.57060
1210.0000 -212.62108 -201.32835 11.29273 2.78707 -201.92815 929.79384
1215.0000 -210.84234 -200.08132 10.76102 2.86826 -200.33399 986.95236
1220.0000 -211.03194 -199.79537 11.23657 2.87490 -200.20360 959.96786
1225.0000 -210.26225 -199.66924 10.59301 2.93654 -198.99345 983.56663
1230.0000 -209.21133 -198.07117 11.14016 2.93784 -198.96791 984.78697
1235.0000 -208.68757 -198.04139 10.64617 2.98726 -197.99750 986.56660
1240.0000 -209.12759 -197.60541 11.52219 3.02355 -197.28512 1048.18457
1245.0000 -210.94754 -199.97685 10.97069 2.98971 -197.94942 1030.05292
1250.0000 -211.55950 -200.99788 10.56162 2.83122 -201.06124 931.41655
FREEZING PROCESS: loop number 6 T-loop= 938.00000000000000
main_MD> interactions number 6 at Temperature= 938.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 6.36661 0.46836 1.57718
force_rgl> df(natom) 4.86274 2.67330 1.91542
1255.0000 -212.99966 -202.38853 10.61114 2.79428 -201.78650 906.63337
1260.0000 -211.54744 -201.93823 9.60921 2.82684 -201.14723 916.06059
1265.0000 -209.96156 -198.65395 11.30761 2.90758 -199.56202 950.22202
1270.0000 -210.95560 -200.79714 10.15846 2.86801 -200.33894 955.18509
1275.0000 -210.34411 -199.94080 10.40331 2.88769 -199.95253 966.84125
1280.0000 -209.71745 -198.53979 11.17767 2.93371 -199.04910 1000.02096
1285.0000 -209.61633 -199.25463 10.36170 2.89457 -199.81757 950.36857
1290.0000 -210.76193 -199.84974 10.91219 2.87380 -200.22535 955.95663
1295.0000 -213.32379 -202.75750 10.56629 2.80441 -201.58767 918.18695
1300.0000 -211.32883 -201.12996 10.19887 2.81633 -201.35367 920.95783
1305.0000 -213.13741 -203.21502 9.92240 2.84186 -200.85245 950.48606
1310.0000 -213.88465 -203.02509 10.85956 2.70696 -203.50114 881.42529
1315.0000 -213.88608 -203.19790 10.68818 2.72793 -203.08927 879.05643
1320.0000 -209.90793 -199.63761 10.27032 2.83087 -201.06822 901.61607
1325.0000 -210.76527 -199.27944 11.48584 2.91086 -199.49768 972.57123
1330.0000 -208.36038 -197.74092 10.61946 2.95249 -198.68028 977.76336
1335.0000 -211.58553 -201.30903 10.27650 2.93705 -198.98350 992.83924
1340.0000 -210.38319 -198.73690 11.64629 2.90329 -199.64632 949.04475
1345.0000 -210.72366 -200.54441 10.17926 2.87888 -200.12559 933.01245
1350.0000 -210.74145 -199.26997 11.47148 2.96854 -198.36518 985.30931
1355.0000 -211.60735 -201.75687 9.85047 2.85945 -200.50701 950.25208
1360.0000 -210.06148 -198.27254 11.78893 2.82398 -201.20337 932.61884
1365.0000 -211.03111 -199.95865 11.07246 2.91141 -199.48677 983.47682
1370.0000 -210.47759 -200.14370 10.33389 2.86362 -200.42513 966.10934
1375.0000 -211.52374 -200.58809 10.93565 2.85303 -200.63306 939.38742
1380.0000 -209.87990 -201.64534 8.23456 2.81148 -201.44883 913.62032
1385.0000 -211.36821 -200.47254 10.89567 2.85004 -200.69172 946.94660
1390.0000 -210.35591 -198.49566 11.86025 2.87399 -200.22156 963.75251
1395.0000 -213.04094 -202.72630 10.31465 2.82248 -201.23295 928.34241
1400.0000 -212.20748 -202.07755 10.12993 2.78718 -201.92595 919.45720
1405.0000 -212.28407 -202.54070 9.74337 2.81141 -201.45017 891.31992
1410.0000 -211.45602 -199.40759 12.04843 2.76702 -202.32183 873.90600
1415.0000 -212.98476 -201.75106 11.23369 2.85918 -200.51234 940.10117
1420.0000 -213.00670 -201.29600 11.71070 2.80212 -201.63274 926.83169
1425.0000 -210.89325 -201.30141 9.59183 2.82305 -201.22170 937.75498
1430.0000 -213.32992 -202.70408 10.62584 2.79482 -201.77590 912.14530
1435.0000 -213.16558 -201.03616 12.12942 2.75651 -202.52825 898.52625
1440.0000 -210.49800 -199.46453 11.03347 2.82577 -201.16827 936.33417
1445.0000 -209.54536 -199.88381 9.66155 2.84959 -200.70067 932.49410
1450.0000 -211.26606 -202.21784 9.04822 2.81597 -201.36073 913.54489
1455.0000 -211.81759 -202.21625 9.60134 2.85051 -200.68254 944.24965
1460.0000 -210.81810 -201.17492 9.64318 2.80492 -201.57777 910.16079
1465.0000 -212.51717 -202.45123 10.06594 2.79878 -201.69816 902.99600
1470.0000 -211.69100 -201.77418 9.91683 2.71234 -203.39535 828.82167
1475.0000 -210.90460 -200.69537 10.20923 2.84568 -200.77738 959.23789
1480.0000 -210.73340 -198.99145 11.74195 2.85461 -200.60197 926.76795
1485.0000 -210.49707 -199.32630 11.17077 2.92725 -199.17593 994.27239
1490.0000 -209.55685 -197.25392 12.30293 2.90172 -199.67702 981.73056
1495.0000 -210.78254 -199.46294 11.31959 2.99231 -197.89852 1020.95724
1500.0000 -210.68449 -199.62392 11.06057 2.92016 -199.31511 961.39238
FREEZING PROCESS: loop number 7 T-loop= 913.00000000000000
main_MD> interactions number 7 at Temperature= 913.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.23189 1.69115 -0.31191
force_rgl> df(natom) 1.71498 2.16107 -5.99593
1505.0000 -208.47103 -199.13834 9.33270 2.92453 -199.22921 975.60321
1510.0000 -211.41617 -199.94556 11.47061 2.85614 -200.57207 932.98461
1515.0000 -212.93827 -202.56632 10.37194 2.76699 -202.32247 904.45540
1520.0000 -211.89170 -202.25516 9.63654 2.78723 -201.92505 882.07972
1525.0000 -212.33001 -202.72610 9.60391 2.73524 -202.94580 868.83140
1530.0000 -211.06092 -200.29654 10.76438 2.80495 -201.57705 893.56478
1535.0000 -211.18679 -199.63245 11.55434 2.88825 -199.94165 944.10347
1540.0000 -208.30612 -196.74743 11.55869 2.94719 -198.78431 994.06492
1545.0000 -209.80702 -196.88066 12.92636 3.08112 -196.15466 1060.54152
1550.0000 -208.43608 -197.96398 10.47209 3.05384 -196.69025 1061.69421
1555.0000 -210.30117 -198.48116 11.82001 2.97894 -198.16103 996.36411
1560.0000 -209.96872 -199.57999 10.38872 2.92713 -199.17829 995.18236
1565.0000 -211.06277 -199.71002 11.35275 2.88170 -200.07026 972.46613
1570.0000 -212.11020 -199.01948 13.09072 2.90428 -199.62687 983.97780
1575.0000 -211.25510 -201.22337 10.03173 2.89155 -199.87672 944.71101
1580.0000 -212.53788 -203.39998 9.13789 2.78607 -201.94781 902.55511
1585.0000 -213.38978 -203.87728 9.51251 2.76454 -202.37058 891.22201
1590.0000 -213.44696 -203.40952 10.03743 2.74352 -202.78332 863.55969
1595.0000 -211.31782 -200.98895 10.32887 2.81751 -201.33040 892.34201
1600.0000 -210.23658 -200.02377 10.21281 2.82434 -201.19636 894.69517
1605.0000 -208.21805 -197.70950 10.50855 2.95938 -198.54507 999.98776
1610.0000 -213.37229 -202.75850 10.61378 2.88182 -200.06780 962.31765
1615.0000 -213.76273 -202.46908 11.29366 2.75787 -202.50141 894.67374
1620.0000 -212.84965 -203.13783 9.71181 2.77279 -202.20852 889.64002
1625.0000 -211.57861 -201.86430 9.71431 2.78640 -201.94126 913.71395
1630.0000 -210.56695 -201.19519 9.37177 2.84804 -200.73097 912.18303
1635.0000 -210.69576 -200.78974 9.90602 2.87505 -200.20078 947.03186
1640.0000 -211.19123 -200.68965 10.50158 2.94711 -198.78589 987.77359
1645.0000 -210.71223 -200.88689 9.82535 2.85379 -200.61821 938.78307
1650.0000 -210.17959 -200.10431 10.07527 2.80580 -201.56045 929.47594
1655.0000 -209.36926 -200.70759 8.66167 2.85622 -200.57049 949.92732
1660.0000 -212.29037 -201.47369 10.81667 2.85313 -200.63113 913.60012
1665.0000 -211.38795 -202.07109 9.31686 2.86411 -200.41563 963.32807
1670.0000 -212.20368 -202.59872 9.60497 2.77154 -202.23307 890.52908
1675.0000 -211.08280 -200.23648 10.84632 2.81191 -201.44044 925.73804
1680.0000 -212.31403 -201.69889 10.61513 2.80911 -201.49544 900.86019
1685.0000 -212.21365 -202.55089 9.66276 2.80167 -201.64153 922.67001
1690.0000 -211.73255 -201.08525 10.64730 2.82502 -201.18311 944.92921
1695.0000 -210.41118 -199.07681 11.33437 2.89085 -199.89049 971.72863
1700.0000 -212.39681 -201.99397 10.40285 2.85969 -200.50239 949.18660
1705.0000 -211.79392 -201.05893 10.73499 2.80829 -201.51154 902.36211
1710.0000 -210.58881 -199.17257 11.41623 2.90484 -199.61586 980.25366
1715.0000 -210.47779 -200.62557 9.85222 2.89494 -199.81028 953.44954
1720.0000 -211.61405 -200.23062 11.38344 2.84726 -200.74629 914.87642
1725.0000 -211.56201 -201.32081 10.24121 2.82768 -201.13072 905.34745
1730.0000 -209.21336 -198.62568 10.58768 2.90603 -199.59249 983.93633
1735.0000 -209.45488 -199.28728 10.16760 2.93720 -198.98046 985.67916
1740.0000 -212.47927 -202.42419 10.05509 2.81396 -201.40028 921.40277
1745.0000 -209.92064 -198.74433 11.17631 2.81103 -201.45775 924.47831
1750.0000 -211.45319 -199.74464 11.70855 2.86954 -200.30894 969.17431
FREEZING PROCESS: loop number 8 T-loop= 888.00000000000000
main_MD> interactions number 8 at Temperature= 888.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -2.30596 0.46630 -1.42352
force_rgl> df(natom) 1.21009 -3.96050 -2.31504
1755.0000 -212.09279 -203.73710 8.35570 2.76209 -202.41862 879.61234
1760.0000 -212.29646 -202.30605 9.99041 2.76513 -202.35902 885.67363
1765.0000 -213.63165 -204.99864 8.63301 2.67677 -204.09381 835.54426
1770.0000 -212.77302 -204.11896 8.65406 2.62670 -205.07688 796.85671
1775.0000 -211.72459 -203.30178 8.42280 2.70974 -203.44646 856.57682
1780.0000 -211.61890 -203.09646 8.52244 2.73847 -202.88238 847.83060
1785.0000 -214.18711 -204.36419 9.82292 2.71182 -203.40560 844.31129
1790.0000 -210.88163 -201.65278 9.22885 2.70823 -203.47619 872.85178
1795.0000 -212.93677 -202.85247 10.08429 2.78812 -201.90761 879.98260
1800.0000 -210.98773 -200.75654 10.23119 2.80704 -201.53600 922.15142
1805.0000 -212.32950 -203.00681 9.32269 2.81894 -201.30247 930.08250
1810.0000 -212.06899 -201.43021 10.63878 2.76816 -202.29938 882.05115
1815.0000 -212.64363 -202.14154 10.50209 2.80588 -201.55884 931.44422
1820.0000 -212.21636 -202.53489 9.68147 2.77335 -202.19763 907.92368
1825.0000 -210.94707 -200.45754 10.48953 2.82657 -201.15261 903.96466
1830.0000 -213.46989 -203.36517 10.10472 2.81628 -201.35460 900.45382
1835.0000 -213.73211 -204.84766 8.88446 2.70842 -203.47234 826.90817
1840.0000 -214.02606 -205.58875 8.43731 2.62167 -205.17566 804.37407
1845.0000 -214.33824 -205.39503 8.94322 2.59030 -205.79161 801.66576
1850.0000 -214.95831 -205.98827 8.97004 2.63377 -204.93813 816.86908
1855.0000 -212.61853 -203.92901 8.68952 2.64652 -204.68770 797.36360
1860.0000 -209.95163 -200.78316 9.16848 2.75888 -202.48168 881.91217
1865.0000 -211.29314 -200.88104 10.41210 2.83453 -200.99633 928.93201
1870.0000 -213.38446 -202.45695 10.92752 2.82058 -201.27013 919.32200
1875.0000 -212.93391 -202.24893 10.68498 2.79054 -201.86003 897.33167
1880.0000 -212.42987 -202.02876 10.40111 2.76067 -202.44642 904.63392
1885.0000 -213.31725 -204.11956 9.19770 2.66650 -204.29542 854.51213
1890.0000 -213.42213 -202.96237 10.45977 2.73475 -202.95535 874.81629
1895.0000 -209.72645 -198.91724 10.80921 2.81146 -201.44935 933.43797
1900.0000 -209.22998 -197.60490 11.62507 2.98148 -198.11112 1044.15584
1905.0000 -210.39646 -199.62856 10.76790 2.95470 -198.63696 970.53562
1910.0000 -210.47200 -199.04847 11.42352 2.90382 -199.63580 965.61554
1915.0000 -211.06300 -200.66254 10.40046 2.89544 -199.80041 953.34522
1920.0000 -210.96677 -200.69019 10.27659 2.89847 -199.74086 961.42662
1925.0000 -211.96417 -201.33251 10.63166 2.83293 -201.02772 939.96907
1930.0000 -211.13265 -201.87415 9.25850 2.80676 -201.54149 891.06523
1935.0000 -210.96100 -200.95626 10.00474 2.79278 -201.81600 892.57422
1940.0000 -212.86164 -201.65654 11.20510 2.82622 -201.15949 904.73735
1945.0000 -211.64960 -202.04657 9.60303 2.77034 -202.25668 879.99491
1950.0000 -210.55400 -201.25272 9.30128 2.81797 -201.32149 921.71555
1955.0000 -213.84180 -203.65744 10.18435 2.78050 -202.05722 909.39714
1960.0000 -213.32277 -204.46561 8.85715 2.70793 -203.48191 868.79490
1965.0000 -213.31629 -203.94974 9.36655 2.63811 -204.85287 814.07671
1970.0000 -211.40695 -202.01851 9.38844 2.73136 -203.02204 860.50450
1975.0000 -211.88570 -202.57686 9.30884 2.79082 -201.85451 920.17003
1980.0000 -213.12581 -202.88123 10.24458 2.77731 -202.11985 908.91441
1985.0000 -211.32270 -201.39736 9.92534 2.80061 -201.66236 925.64136
1990.0000 -211.08333 -201.35634 9.72699 2.81962 -201.28913 917.90357
1995.0000 -211.62270 -202.42271 9.19998 2.83604 -200.96671 894.18861
2000.0000 -212.33172 -202.14973 10.18199 2.78388 -201.99070 885.19480
FREEZING PROCESS: loop number 9 T-loop= 863.00000000000000
main_MD> interactions number 9 at Temperature= 863.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.32402 0.62290 1.30901
force_rgl> df(natom) -0.22967 0.33030 1.63446
2005.0000 -213.67620 -202.96837 10.70783 2.74153 -202.82225 867.14080
2010.0000 -212.69020 -202.64257 10.04763 2.77114 -202.24084 875.50955
2015.0000 -211.87867 -203.28316 8.59551 2.73360 -202.97797 865.02651
2020.0000 -214.79124 -204.86747 9.92377 2.68842 -203.86511 858.73503
2025.0000 -213.28262 -205.46238 7.82024 2.66759 -204.27412 848.47029
2030.0000 -214.93040 -206.73464 8.19577 2.53527 -206.87201 738.39353
2035.0000 -212.45377 -202.88242 9.57135 2.65582 -204.50514 810.78217
2040.0000 -213.50842 -202.75548 10.75294 2.66660 -204.29345 820.43155
2045.0000 -214.39424 -205.19923 9.19501 2.75981 -202.46346 880.31377
2050.0000 -213.44175 -202.68671 10.75503 2.66988 -204.22900 840.62820
2055.0000 -212.82172 -203.97007 8.85165 2.71264 -203.38955 863.54166
2060.0000 -211.93389 -201.73530 10.19859 2.75295 -202.59817 892.34692
2065.0000 -211.27308 -201.45912 9.81396 2.83040 -201.07731 926.47186
2070.0000 -211.49397 -201.99915 9.49482 2.76338 -202.39320 855.07249
2075.0000 -215.08918 -204.41912 10.67006 2.65133 -204.59333 811.25007
2080.0000 -214.37231 -203.41580 10.95651 2.68664 -203.89998 854.42582
2085.0000 -212.96362 -203.72627 9.23735 2.70442 -203.55085 846.03859
2090.0000 -215.88148 -206.38218 9.49930 2.60464 -205.50993 787.12906
2095.0000 -212.55063 -203.71575 8.83489 2.62600 -205.09062 809.42353
2100.0000 -212.75872 -202.29315 10.46557 2.74656 -202.72358 872.02046
2105.0000 -211.58986 -202.50033 9.08953 2.72807 -203.08659 867.50195
2110.0000 -213.21380 -203.11830 10.09551 2.77795 -202.10719 903.52201
2115.0000 -211.56487 -201.61659 9.94827 2.74524 -202.74952 875.12422
2120.0000 -212.48467 -202.72773 9.75695 2.82393 -201.20441 911.25558
2125.0000 -212.31699 -202.27556 10.04142 2.75388 -202.57985 871.49670
2130.0000 -213.46029 -202.94508 10.51521 2.75739 -202.51096 891.84172
2135.0000 -213.60504 -204.01432 9.59072 2.65033 -204.61285 828.64729
2140.0000 -212.60003 -202.92917 9.67086 2.69279 -203.77932 842.06160
2145.0000 -213.17595 -202.81829 10.35766 2.76032 -202.45331 867.23195
2150.0000 -211.32054 -202.02569 9.29485 2.73641 -202.92274 858.41224
2155.0000 -212.95892 -203.71114 9.24778 2.69925 -203.65247 835.20488
2160.0000 -212.51386 -202.46174 10.05213 2.71430 -203.35700 852.68715
2165.0000 -213.52389 -204.04463 9.47926 2.71935 -203.25786 864.12932
2170.0000 -211.56065 -202.39220 9.16845 2.70274 -203.58394 832.57793
2175.0000 -211.50887 -200.49331 11.01556 2.79693 -201.73457 878.97277
2180.0000 -211.05919 -201.16449 9.89470 2.83306 -201.02519 927.66593
2185.0000 -210.21314 -199.93926 10.27388 2.81286 -201.42187 902.50196
2190.0000 -209.86617 -199.14886 10.71731 2.92202 -199.27848 967.83357
2195.0000 -212.11205 -203.15338 8.95868 2.82615 -201.16087 910.66672
2200.0000 -212.43373 -201.80376 10.62998 2.73991 -202.85406 876.08554
2205.0000 -210.81371 -199.52028 11.29343 2.85595 -200.57568 952.24715
2210.0000 -209.18851 -199.56043 9.62808 2.90183 -199.67492 968.01140
2215.0000 -210.64525 -200.81248 9.83277 2.87118 -200.27670 936.98788
2220.0000 -211.02356 -199.49416 11.52940 2.88730 -199.96016 953.14714
2225.0000 -210.95145 -200.64323 10.30821 2.87578 -200.18642 967.49776
2230.0000 -211.80934 -201.97482 9.83452 2.77759 -202.11431 882.63618
2235.0000 -213.36048 -203.35318 10.00730 2.73197 -203.01002 874.04314
2240.0000 -210.91894 -200.84796 10.07098 2.76088 -202.44229 878.45485
2245.0000 -209.88763 -200.61751 9.27012 2.84716 -200.74840 959.23959
2250.0000 -213.10799 -203.03069 10.07730 2.75862 -202.48678 894.86284
FREEZING PROCESS: loop number 10 T-loop= 838.00000000000000
main_MD> interactions number 10 at Temperature= 838.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.11758 -1.31974 0.54305
force_rgl> df(natom) -1.85820 -1.34795 -1.61542
2255.0000 -211.26726 -201.28652 9.98073 2.82387 -201.20563 920.39774
2260.0000 -213.05618 -204.83070 8.22548 2.75582 -202.54163 878.18917
2265.0000 -213.41056 -203.71318 9.69738 2.63763 -204.86239 838.66223
2270.0000 -212.09072 -202.32965 9.76107 2.65886 -204.44539 818.74746
2275.0000 -211.22028 -202.42108 8.79920 2.76550 -202.35163 883.15925
2280.0000 -213.31606 -204.65811 8.65795 2.70261 -203.58646 861.82065
2285.0000 -213.47436 -203.10511 10.36926 2.66836 -204.25887 819.15339
2290.0000 -212.85635 -204.28708 8.56927 2.69407 -203.75412 836.90243
2295.0000 -212.47981 -204.50739 7.97241 2.66594 -204.30643 813.76139
2300.0000 -211.38873 -202.78841 8.60032 2.68257 -203.97994 835.92914
2305.0000 -212.73603 -203.83966 8.89637 2.71326 -203.37731 877.22631
2310.0000 -214.92612 -206.43413 8.49199 2.66994 -204.22787 838.98905
2315.0000 -214.37260 -205.06755 9.30506 2.56359 -206.31593 781.19100
2320.0000 -213.85881 -206.74027 7.11853 2.56456 -206.29693 778.25570
2325.0000 -214.95661 -205.33886 9.61775 2.56574 -206.27384 782.05327
2330.0000 -213.87705 -204.77952 9.09753 2.64482 -204.72106 805.82779
2335.0000 -215.30518 -206.23779 9.06739 2.59822 -205.63612 803.35398
2340.0000 -213.58213 -204.23679 9.34535 2.66385 -204.34745 835.15054
2345.0000 -213.83777 -205.55355 8.28422 2.65118 -204.59628 804.19844
2350.0000 -214.03431 -205.38291 8.65141 2.61582 -205.29053 820.37377
2355.0000 -214.62864 -204.82612 9.80252 2.59555 -205.68859 794.13720
2360.0000 -213.33554 -203.25184 10.08370 2.69396 -203.75624 823.63307
2365.0000 -211.86520 -202.37523 9.48997 2.74911 -202.67352 875.92207
2370.0000 -211.44770 -201.37521 10.07250 2.77880 -202.09057 877.99453
2375.0000 -213.45271 -201.60423 11.84848 2.79780 -201.71749 926.90300
2380.0000 -211.08456 -201.94901 9.13555 2.83411 -201.00447 926.80117
2385.0000 -210.78512 -202.00302 8.78210 2.76852 -202.29233 900.65259
2390.0000 -213.29635 -201.95963 11.33672 2.74908 -202.67413 867.27795
2395.0000 -212.76696 -203.80264 8.96432 2.77483 -202.16841 876.12357
2400.0000 -214.51811 -203.93410 10.58401 2.68563 -203.91987 850.20238
2405.0000 -213.44200 -204.37836 9.06364 2.72346 -203.17712 859.87794
2410.0000 -214.55350 -203.77627 10.77722 2.65153 -204.58937 798.39281
2415.0000 -212.20049 -202.81521 9.38529 2.68459 -203.94023 822.29066
2420.0000 -211.96834 -201.39102 10.57732 2.78715 -201.92654 884.31364
2425.0000 -213.42269 -201.45600 11.96669 2.78505 -201.96784 920.19207
2430.0000 -211.64592 -201.31761 10.32831 2.82649 -201.15425 926.93015
2435.0000 -215.33609 -203.57150 11.76459 2.77981 -202.07061 902.14409
2440.0000 -216.45325 -206.31672 10.13653 2.63438 -204.92613 832.90974
2445.0000 -213.03160 -203.88529 9.14631 2.62954 -205.02120 840.76777
2450.0000 -213.56820 -203.37803 10.19016 2.67499 -204.12878 841.24717
2455.0000 -212.88768 -203.92143 8.96626 2.69778 -203.68129 844.73050
2460.0000 -213.82687 -203.15582 10.67104 2.65130 -204.59381 830.87083
2465.0000 -213.16746 -203.68215 9.48531 2.74986 -202.65868 879.67434
2470.0000 -213.99835 -204.16915 9.82920 2.66527 -204.31952 829.29826
2475.0000 -213.45213 -202.75808 10.69405 2.69147 -203.80512 838.41623
2480.0000 -213.27120 -204.34849 8.92271 2.71922 -203.26040 867.99984
2485.0000 -215.25702 -205.90308 9.35394 2.66162 -204.39124 836.54460
2490.0000 -216.61505 -207.62222 8.99283 2.48055 -207.94638 715.15451
2495.0000 -214.27090 -205.06691 9.20399 2.53985 -206.78209 774.93487
2500.0000 -213.41551 -205.01260 8.40291 2.65269 -204.56655 826.71493
FREEZING PROCESS: loop number 11 T-loop= 813.00000000000000
main_MD> interactions number 11 at Temperature= 813.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -4.02259 -3.37237 -2.64380
force_rgl> df(natom) 1.40629 7.58336 -1.85106
2505.0000 -214.34849 -202.96962 11.37886 2.64054 -204.80525 807.90406
2510.0000 -213.95244 -204.84884 9.10360 2.69514 -203.73309 838.88466
2515.0000 -214.26272 -204.75837 9.50434 2.65253 -204.56981 802.20843
2520.0000 -214.21134 -204.64774 9.56360 2.63769 -204.86117 820.11001
2525.0000 -213.61884 -204.65961 8.95924 2.66060 -204.41135 810.36214
2530.0000 -214.14254 -205.24693 8.89561 2.65311 -204.55826 814.53562
2535.0000 -213.20026 -204.01587 9.18439 2.64159 -204.78458 823.72591
2540.0000 -214.66660 -205.47810 9.18851 2.62801 -205.05125 790.41480
2545.0000 -214.07026 -206.68589 7.38437 2.57239 -206.14332 775.65513
2550.0000 -214.81275 -206.52656 8.28620 2.56963 -206.19736 782.97925
2555.0000 -214.68452 -206.52471 8.15981 2.57151 -206.16056 767.44246
2560.0000 -215.70672 -207.26036 8.44637 2.51199 -207.32906 742.72133
2565.0000 -214.70204 -206.00273 8.69931 2.55792 -206.42733 744.14143
2570.0000 -213.25955 -203.73758 9.52197 2.62902 -205.03127 783.84719
2575.0000 -214.13073 -205.03980 9.09093 2.61791 -205.24940 800.79610
2580.0000 -213.25718 -203.88852 9.36866 2.69012 -203.83177 854.13227
2585.0000 -211.41904 -202.72794 8.69109 2.73495 -202.95145 858.15838
2590.0000 -213.07997 -203.44066 9.63931 2.70173 -203.60383 848.39526
2595.0000 -212.60752 -203.95128 8.65624 2.67448 -204.13869 811.59341
2600.0000 -212.97333 -204.01961 8.95372 2.70384 -203.56222 852.68311
2605.0000 -213.22131 -204.70337 8.51794 2.65785 -204.46532 831.28705
2610.0000 -214.42531 -203.86345 10.56186 2.64174 -204.78167 804.95302
2615.0000 -212.91382 -204.28831 8.62551 2.67895 -204.05094 834.19353
2620.0000 -212.39205 -205.03863 7.35342 2.64453 -204.72674 783.22763
2625.0000 -215.74420 -204.93357 10.81063 2.62275 -205.15450 778.01396
2630.0000 -214.79014 -203.74551 11.04463 2.68181 -203.99476 857.75624
2635.0000 -212.35198 -203.74531 8.60667 2.74726 -202.70972 875.65828
2640.0000 -214.27921 -204.51861 9.76060 2.70657 -203.50868 846.84312
2645.0000 -215.55261 -207.21472 8.33789 2.58349 -205.92532 758.97074
2650.0000 -214.91690 -205.05023 9.86667 2.57759 -206.04121 775.99251
2655.0000 -214.27280 -204.23656 10.03624 2.65434 -204.53424 813.45909
2660.0000 -213.77205 -204.51620 9.25585 2.67632 -204.10260 841.65824
2665.0000 -213.56698 -205.31059 8.25639 2.61522 -205.30220 801.56217
2670.0000 -213.53037 -202.45594 11.07443 2.70326 -203.57379 867.33164
2675.0000 -212.57875 -203.88676 8.69199 2.69703 -203.69595 842.43585
2680.0000 -214.17317 -204.66244 9.51074 2.66386 -204.34733 784.72605
2685.0000 -212.42040 -202.73465 9.68575 2.67024 -204.22205 826.88967
2690.0000 -212.79586 -203.55880 9.23706 2.72203 -203.20523 864.36879
2695.0000 -213.77554 -205.39597 8.37957 2.66998 -204.22713 831.82509
2700.0000 -212.30601 -204.63123 7.67477 2.64685 -204.68131 791.92227
2705.0000 -216.24804 -208.15125 8.09679 2.57314 -206.12847 783.76508
2710.0000 -213.11749 -205.33163 7.78586 2.55976 -206.39117 741.55800
2715.0000 -214.22709 -205.49867 8.72842 2.65504 -204.52049 803.85393
2720.0000 -214.00119 -204.60421 9.39698 2.60115 -205.57851 779.79366
2725.0000 -212.83382 -203.16461 9.66921 2.70821 -203.47651 828.07457
2730.0000 -213.85042 -204.31009 9.54033 2.67615 -204.10605 826.69415
2735.0000 -212.41475 -203.30931 9.10544 2.68497 -203.93290 816.11278
2740.0000 -213.69018 -204.71263 8.97755 2.68370 -203.95773 840.99037
2745.0000 -213.06594 -204.50311 8.56283 2.60302 -205.54186 764.85008
2750.0000 -211.95085 -203.39520 8.55565 2.69846 -203.66795 852.84065
FREEZING PROCESS: loop number 12 T-loop= 788.00000000000000
main_MD> interactions number 12 at Temperature= 788.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.54810 2.45770 -2.88230
force_rgl> df(natom) -2.46839 -5.07949 1.88125
2755.0000 -213.94326 -203.64832 10.29494 2.68418 -203.94838 840.03026
2760.0000 -212.20389 -203.11298 9.09091 2.69900 -203.65740 841.45361
2765.0000 -213.74430 -205.69016 8.05414 2.72536 -203.13981 847.85480
2770.0000 -213.73662 -203.66579 10.07083 2.67178 -204.19170 826.31693
2775.0000 -214.90415 -205.43147 9.47268 2.66091 -204.40524 826.11378
2780.0000 -214.91142 -205.94175 8.96967 2.58425 -205.91036 787.00964
2785.0000 -213.93665 -205.05138 8.88527 2.63518 -204.91036 783.75886
2790.0000 -215.81006 -206.96934 8.84072 2.54819 -206.61834 759.23178
2795.0000 -214.62380 -206.08666 8.53714 2.52111 -207.15002 708.42597
2800.0000 -215.38646 -206.98696 8.39950 2.58745 -205.84754 777.98369
2805.0000 -213.51709 -204.02860 9.48849 2.63152 -204.98220 805.79841
2810.0000 -215.06608 -205.32012 9.74596 2.59926 -205.61556 764.77457
2815.0000 -215.44158 -204.91848 10.52310 2.61413 -205.32360 788.83354
2820.0000 -214.08007 -205.41394 8.66613 2.59995 -205.60207 781.53240
2825.0000 -214.65069 -205.85512 8.79557 2.59468 -205.70560 778.24058
2830.0000 -215.09115 -206.54121 8.54995 2.59527 -205.69391 763.50389
2835.0000 -212.82782 -204.92688 7.90095 2.58875 -205.82208 774.44689
2840.0000 -214.63644 -205.35095 9.28549 2.58965 -205.80436 799.88728
2845.0000 -211.72545 -203.43548 8.28996 2.62210 -205.16716 815.41902
2850.0000 -213.84100 -204.22313 9.61787 2.67844 -204.06105 826.47981
2855.0000 -213.49995 -204.14546 9.35449 2.70884 -203.46418 869.34264
2860.0000 -212.71902 -203.81392 8.90510 2.65806 -204.46109 813.37149
2865.0000 -213.84475 -205.14639 8.69836 2.63303 -204.95252 790.09692
2870.0000 -213.81518 -205.40939 8.40579 2.64578 -204.70218 809.01615
2875.0000 -213.88365 -203.80706 10.07659 2.66285 -204.36703 830.36674
2880.0000 -212.50216 -204.22551 8.27664 2.69408 -203.75402 854.74092
2885.0000 -214.05691 -206.13140 7.92552 2.62984 -205.01519 791.51426
2890.0000 -213.84591 -204.94705 8.89886 2.60366 -205.52925 789.77255
2895.0000 -214.37994 -206.65454 7.72539 2.54554 -206.67040 754.18381
2900.0000 -215.05281 -205.89580 9.15702 2.60503 -205.50240 794.69112
2905.0000 -214.35168 -206.11072 8.24096 2.58468 -205.90195 767.23456
2910.0000 -215.11262 -206.03295 9.07967 2.58984 -205.80057 764.07092
2915.0000 -214.44839 -205.43168 9.01672 2.56866 -206.21647 777.90559
2920.0000 -215.32396 -207.34033 7.98363 2.53373 -206.90222 737.60737
2925.0000 -215.94053 -206.57503 9.36550 2.53378 -206.90126 750.15367
2930.0000 -215.31311 -207.35192 7.96119 2.53266 -206.92330 757.49728
2935.0000 -213.26142 -204.51817 8.74325 2.56887 -206.21236 730.99625
2940.0000 -212.25001 -203.33451 8.91550 2.65043 -204.61097 817.08216
2945.0000 -214.65829 -206.60007 8.05822 2.61393 -205.32760 792.55044
2950.0000 -215.68766 -207.73190 7.95575 2.51179 -207.33313 739.29817
2955.0000 -215.86438 -207.33406 8.53032 2.54370 -206.70657 753.38783
2960.0000 -215.81890 -206.71798 9.10092 2.52530 -207.06781 728.30062
2965.0000 -216.26156 -206.18100 10.08057 2.54865 -206.60944 752.32933
2970.0000 -214.02782 -206.63959 7.38823 2.52396 -207.09415 729.62967
2975.0000 -216.14740 -206.75184 9.39556 2.55066 -206.56991 752.33740
2980.0000 -215.12217 -207.24383 7.87834 2.55393 -206.50565 748.53509
2985.0000 -216.32785 -206.53431 9.79354 2.55366 -206.51102 785.96666
2990.0000 -214.42553 -205.17139 9.25413 2.59310 -205.73662 781.34038
2995.0000 -214.28520 -205.41603 8.86917 2.59277 -205.74307 797.14755
3000.0000 -213.49203 -205.54957 7.94246 2.60114 -205.57874 781.69707
FREEZING PROCESS: loop number 13 T-loop= 763.00000000000000
main_MD> interactions number 13 at Temperature= 763.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.03368 3.44722 -0.97066
force_rgl> df(natom) -2.10336 4.15396 0.92453
3005.0000 -213.19552 -205.36286 7.83266 2.58252 -205.94430 764.34172
3010.0000 -213.07548 -205.62374 7.45174 2.60210 -205.55998 769.91215
3015.0000 -215.14609 -206.08373 9.06236 2.55027 -206.57753 744.72282
3020.0000 -214.05197 -205.30743 8.74454 2.55674 -206.45049 762.26803
3025.0000 -214.78624 -206.32922 8.45702 2.55924 -206.40151 754.72932
3030.0000 -215.05965 -207.05101 8.00863 2.53237 -206.92903 743.83823
3035.0000 -214.77096 -207.28042 7.49054 2.49972 -207.57001 735.86364
3040.0000 -214.08027 -205.38730 8.69297 2.55893 -206.40741 755.27517
3045.0000 -214.31884 -205.64813 8.67071 2.61072 -205.39065 768.24811
3050.0000 -214.98790 -206.60610 8.38180 2.55574 -206.47019 774.78779
3055.0000 -214.78256 -205.59396 9.18860 2.55688 -206.44778 752.97411
3060.0000 -214.09738 -205.77323 8.32415 2.64279 -204.76097 823.78487
3065.0000 -214.76039 -205.46686 9.29353 2.61611 -205.28474 777.36344
3070.0000 -215.96983 -207.42917 8.54066 2.55800 -206.42572 764.34600
3075.0000 -213.29437 -204.57442 8.71995 2.58297 -205.93544 783.06846
3080.0000 -213.82459 -205.45958 8.36501 2.59507 -205.69791 788.29557
3085.0000 -213.97388 -206.02825 7.94563 2.62273 -205.15489 802.14847
3090.0000 -214.09603 -206.47649 7.61954 2.59482 -205.70289 771.85068
3095.0000 -215.33985 -205.22246 10.11739 2.58539 -205.88791 783.42418
3100.0000 -214.86330 -207.14132 7.72198 2.56941 -206.20173 759.39067
3105.0000 -214.34934 -207.21326 7.13608 2.51766 -207.21780 722.36699
3110.0000 -215.26327 -206.38076 8.88250 2.50454 -207.47546 708.69531
3115.0000 -214.53826 -206.33839 8.19987 2.51796 -207.21183 734.88022
3120.0000 -214.44441 -205.75171 8.69270 2.57877 -206.01789 767.47130
3125.0000 -213.67201 -204.67709 8.99491 2.63616 -204.89120 808.72177
3130.0000 -214.07797 -204.59724 9.48073 2.60867 -205.43088 776.78920
3135.0000 -212.47502 -205.57924 6.89578 2.61116 -205.38196 770.83096
3140.0000 -214.40973 -205.89335 8.51637 2.56319 -206.32395 743.15139
3145.0000 -214.13437 -204.24130 9.89306 2.61923 -205.22353 792.48233
3150.0000 -213.88226 -205.20308 8.67918 2.62921 -205.02754 819.61950
3155.0000 -214.63058 -206.83974 7.79084 2.55725 -206.44041 767.52567
3160.0000 -216.73366 -207.36475 9.36891 2.51914 -207.18872 741.89049
3165.0000 -215.77078 -208.20909 7.56168 2.50697 -207.42774 711.83926
3170.0000 -217.44615 -208.76737 8.67878 2.48520 -207.85523 714.55557
3175.0000 -216.72680 -208.40647 8.32033 2.48189 -207.92012 712.27382
3180.0000 -215.11996 -207.78004 7.33992 2.47273 -208.09998 712.12077
3185.0000 -215.91628 -207.40041 8.51586 2.49616 -207.64000 710.70484
3190.0000 -214.24122 -206.53813 7.70309 2.56865 -206.21667 771.39893
3195.0000 -214.51395 -205.25606 9.25788 2.60453 -205.51217 801.49280
3200.0000 -215.17744 -207.10368 8.07376 2.60287 -205.54476 823.53866
3205.0000 -214.58889 -206.57737 8.01152 2.53432 -206.89074 759.12960
3210.0000 -213.33399 -205.64287 7.69112 2.56008 -206.38499 781.13978
3215.0000 -215.37633 -207.18402 8.19231 2.54261 -206.72793 739.74840
3220.0000 -214.75652 -206.50863 8.24788 2.53795 -206.81942 754.41617
3225.0000 -214.67777 -206.51367 8.16410 2.53460 -206.88514 738.39242
3230.0000 -215.55669 -206.52817 9.02852 2.55601 -206.46490 750.21877
3235.0000 -214.95029 -205.55544 9.39485 2.56307 -206.32628 763.12284
3240.0000 -214.23567 -206.92344 7.31222 2.54376 -206.70540 748.88266
3245.0000 -214.99941 -205.72873 9.27068 2.56063 -206.37404 747.30949
3250.0000 -216.01909 -207.20775 8.81134 2.53062 -206.96344 742.87811
FREEZING PROCESS: loop number 14 T-loop= 738.00000000000000
main_MD> interactions number 14 at Temperature= 738.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.20151 -0.36596 1.65800
force_rgl> df(natom) 4.05754 -1.69734 -2.69251
3255.0000 -214.85880 -206.59295 8.26585 2.51630 -207.24456 742.74099
3260.0000 -216.18670 -207.11218 9.07452 2.56939 -206.20212 765.26658
3265.0000 -215.12269 -206.79978 8.32291 2.50283 -207.50901 743.04710
3270.0000 -215.61033 -206.05357 9.55676 2.55807 -206.42440 752.02542
3275.0000 -213.90740 -204.92704 8.98035 2.60855 -205.43320 779.08548
3280.0000 -215.89329 -206.44248 9.45081 2.63580 -204.89817 801.95383
3285.0000 -215.20745 -207.25702 7.95043 2.55987 -206.38911 753.06557
3290.0000 -215.67485 -206.97665 8.69820 2.52598 -207.05439 737.19510
3295.0000 -213.88718 -205.11937 8.76781 2.58011 -205.99166 772.42961
3300.0000 -213.73551 -205.62547 8.11004 2.55749 -206.43586 769.87626
3305.0000 -216.50013 -208.53741 7.96272 2.51828 -207.20563 743.84655
3310.0000 -214.94996 -207.52235 7.42761 2.49260 -207.70990 712.71032
3315.0000 -215.38703 -207.53961 7.84742 2.52937 -206.98784 742.88282
3320.0000 -216.02338 -207.94292 8.08046 2.50651 -207.43674 741.32523
3325.0000 -215.10145 -206.52759 8.57386 2.54346 -206.71132 737.60939
3330.0000 -213.31428 -204.89346 8.42082 2.60414 -205.51976 781.08621
3335.0000 -214.66971 -206.19575 8.47396 2.58329 -205.92917 774.44945
3340.0000 -216.25612 -206.64531 9.61080 2.56785 -206.23234 756.57010
3345.0000 -213.36174 -204.95217 8.40956 2.56778 -206.23380 778.83453
3350.0000 -215.68199 -208.23028 7.45172 2.55341 -206.51595 766.29017
3355.0000 -215.00232 -206.96719 8.03513 2.45768 -208.39536 701.64738
3360.0000 -215.25706 -206.39878 8.85828 2.52802 -207.01444 743.75343
3365.0000 -215.36871 -207.84079 7.52792 2.50630 -207.44094 708.64702
3370.0000 -214.93863 -206.34428 8.59436 2.54414 -206.69792 745.55549
3375.0000 -216.48906 -207.98587 8.50319 2.53490 -206.87933 740.74800
3380.0000 -215.45624 -207.07797 8.37827 2.50951 -207.37782 749.38633
3385.0000 -215.23102 -207.00818 8.22285 2.56025 -206.38163 778.69340
3390.0000 -215.58302 -207.49795 8.08507 2.52072 -207.15768 739.96301
3395.0000 -215.31739 -208.04734 7.27006 2.49512 -207.66039 702.28773
3400.0000 -215.61530 -207.25273 8.36257 2.48693 -207.82126 705.66618
3405.0000 -216.37342 -208.81931 7.55411 2.48800 -207.80016 713.46727
3410.0000 -216.91525 -208.21940 8.69584 2.47556 -208.04434 717.42472
3415.0000 -215.96084 -206.92133 9.03951 2.51500 -207.27002 723.31746
3420.0000 -213.77334 -204.63589 9.13745 2.60820 -205.44019 791.22859
3425.0000 -212.74977 -202.13683 10.61294 2.73490 -202.95252 843.37033
3430.0000 -213.85129 -204.82562 9.02566 2.68731 -203.88684 854.87847
3435.0000 -214.21540 -206.27916 7.93624 2.65715 -204.47912 814.95980
3440.0000 -213.33746 -203.59960 9.73785 2.65734 -204.47531 820.65098
3445.0000 -212.40370 -204.42443 7.97927 2.66530 -204.31909 820.27117
3450.0000 -214.46492 -206.04102 8.42391 2.62541 -205.10229 785.71971
3455.0000 -214.31688 -206.75605 7.56083 2.59298 -205.73897 773.50440
3460.0000 -215.67318 -207.67435 7.99882 2.50304 -207.50486 702.88974
3465.0000 -215.73119 -207.74923 7.98196 2.53110 -206.95398 736.72096
3470.0000 -215.83628 -208.09183 7.74445 2.49554 -207.65215 716.26694
3475.0000 -214.30280 -207.02255 7.28025 2.51538 -207.26261 737.57846
3480.0000 -216.00419 -208.16290 7.84129 2.48514 -207.85634 694.36623
3485.0000 -215.98480 -208.74375 7.24106 2.46325 -208.28614 702.44261
3490.0000 -215.75912 -208.81255 6.94656 2.43334 -208.87327 704.70756
3495.0000 -216.40392 -207.83353 8.57039 2.42857 -208.96694 676.10196
3500.0000 -215.45365 -206.59823 8.85542 2.54920 -206.59856 777.11323
FREEZING PROCESS: loop number 15 T-loop= 713.00000000000000
main_MD> interactions number 15 at Temperature= 713.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -2.66257 0.22965 3.17791
force_rgl> df(natom) 3.09882 -0.22329 0.78069
3505.0000 -214.84966 -206.51600 8.33366 2.54332 -206.71392 748.04346
3510.0000 -214.95104 -205.19910 9.75195 2.53779 -206.82248 751.67912
3515.0000 -214.79998 -205.95856 8.84141 2.60677 -205.46814 784.03456
3520.0000 -216.59331 -208.28760 8.30571 2.50060 -207.55267 741.96456
3525.0000 -216.92477 -209.88843 7.03634 2.45922 -208.36531 705.65978
3530.0000 -216.15151 -209.35618 6.79533 2.42790 -208.98023 664.14720
3535.0000 -215.03577 -208.63345 6.40231 2.39681 -209.59062 665.83537
3540.0000 -216.17627 -209.04574 7.13053 2.42034 -209.12860 686.93052
3545.0000 -216.53448 -208.26994 8.26454 2.44618 -208.62120 698.87464
3550.0000 -215.67312 -207.27502 8.39810 2.46765 -208.19979 733.40819
3555.0000 -215.25964 -207.51353 7.74612 2.55140 -206.55529 744.14026
3560.0000 -216.71451 -207.01847 9.69604 2.51973 -207.17715 733.05824
3565.0000 -216.46016 -206.98322 9.47693 2.50326 -207.50060 740.36069
3570.0000 -218.46291 -211.42215 7.04077 2.42853 -208.96779 697.04066
3575.0000 -218.10826 -210.53025 7.57801 2.34726 -210.56349 655.92334
3580.0000 -216.34380 -209.08362 7.26018 2.41383 -209.25641 694.39283
3585.0000 -216.54571 -208.23741 8.30830 2.43446 -208.85145 701.27191
3590.0000 -215.94260 -207.70327 8.23933 2.49917 -207.58085 741.54705
3595.0000 -215.84990 -208.31298 7.53693 2.45012 -208.54395 689.03349
3600.0000 -216.06275 -208.18868 7.87407 2.43190 -208.90157 681.76844
3605.0000 -216.67436 -207.36122 9.31314 2.45377 -208.47223 704.11862
3610.0000 -214.83825 -206.07597 8.76228 2.58154 -205.96355 768.15552
3615.0000 -215.94611 -208.73056 7.21555 2.48909 -207.77870 700.31331
3620.0000 -216.43377 -207.91310 8.52067 2.45719 -208.40513 687.77686
3625.0000 -216.32886 -208.05473 8.27413 2.52778 -207.01915 733.22400
3630.0000 -215.12350 -207.43943 7.68407 2.46910 -208.17118 692.62200
3635.0000 -216.57441 -206.69943 9.87499 2.51024 -207.36351 712.91827
3640.0000 -215.25910 -207.54859 7.71051 2.48904 -207.77973 724.49700
3645.0000 -215.57347 -207.15096 8.42251 2.49676 -207.62819 717.63437
3650.0000 -215.97323 -206.62989 9.34334 2.51255 -207.31815 709.16965
3655.0000 -216.71989 -206.97279 9.74710 2.53937 -206.79154 739.16848
3660.0000 -215.22496 -207.54617 7.67879 2.52748 -207.02497 771.92239
3665.0000 -217.45510 -207.60739 9.84772 2.49597 -207.64371 734.35670
3670.0000 -216.07284 -208.22485 7.84799 2.44822 -208.58113 705.01734
3675.0000 -217.56939 -208.17887 9.39051 2.47304 -208.09392 717.94626
3680.0000 -214.66703 -206.17682 8.49021 2.50703 -207.42656 732.01769
3685.0000 -215.59893 -207.58334 8.01559 2.55061 -206.57077 736.18369
3690.0000 -216.44737 -208.12482 8.32255 2.50294 -207.50690 714.78580
3695.0000 -215.43190 -209.02373 6.40817 2.46429 -208.26568 673.26068
3700.0000 -216.89432 -208.45344 8.44089 2.41989 -209.13735 666.75790
3705.0000 -215.58375 -207.96204 7.62172 2.46538 -208.24427 712.32365
3710.0000 -216.98738 -207.99011 8.99727 2.48019 -207.95348 726.15741
3715.0000 -216.62238 -207.98629 8.63609 2.46394 -208.27251 708.23211
3720.0000 -214.98462 -207.03467 7.94995 2.51759 -207.21925 743.72059
3725.0000 -216.15651 -207.80914 8.34737 2.54703 -206.64122 762.97309
3730.0000 -215.44802 -207.91057 7.53744 2.43693 -208.80285 700.90419
3735.0000 -216.15118 -209.24351 6.90767 2.46835 -208.18592 696.39498
3740.0000 -216.38395 -208.80554 7.57840 2.40352 -209.45894 647.26515
3745.0000 -217.10807 -209.27557 7.83250 2.39175 -209.68985 658.12284
3750.0000 -217.40897 -209.59959 7.80938 2.41014 -209.32877 659.02153
FREEZING PROCESS: loop number 16 T-loop= 688.00000000000000
main_MD> interactions number 16 at Temperature= 688.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.24604 1.69409 -3.22327
force_rgl> df(natom) 4.31294 -0.54093 -5.66688
3755.0000 -217.05116 -208.77146 8.27969 2.41312 -209.27039 663.55021
3760.0000 -216.27063 -209.42770 6.84293 2.44588 -208.62723 680.70202
3765.0000 -216.81612 -209.24509 7.57103 2.41868 -209.16110 666.22091
3770.0000 -217.04162 -208.75113 8.29048 2.41808 -209.17290 678.64158
3775.0000 -217.91178 -209.95758 7.95420 2.43430 -208.85444 705.70779
3780.0000 -216.81627 -209.92141 6.89485 2.36152 -210.28345 648.70045
3785.0000 -216.33205 -208.59149 7.74057 2.41470 -209.23933 674.56462
3790.0000 -216.83196 -210.77905 6.05291 2.37511 -210.01663 657.00855
3795.0000 -217.27738 -209.42848 7.84890 2.37444 -210.02980 656.23304
3800.0000 -217.39927 -208.97112 8.42814 2.41037 -209.32433 684.29520
3805.0000 -216.52539 -209.38967 7.13571 2.40288 -209.47148 651.56266
3810.0000 -215.75641 -208.02497 7.73144 2.46739 -208.20480 698.67458
3815.0000 -216.10577 -207.89330 8.21246 2.53490 -206.87936 740.28073
3820.0000 -216.48885 -210.32656 6.16229 2.40789 -209.37309 646.88467
3825.0000 -216.20973 -209.09247 7.11726 2.38257 -209.87027 632.51097
3830.0000 -218.81648 -210.23423 8.58225 2.37947 -209.93114 662.61398
3835.0000 -218.01341 -210.74790 7.26551 2.33803 -210.74474 621.98058
3840.0000 -216.70215 -208.15814 8.54401 2.38187 -209.88398 653.28262
3845.0000 -217.17593 -208.84608 8.32984 2.42311 -209.07426 696.47064
3850.0000 -215.51363 -208.20523 7.30840 2.46732 -208.20622 691.58499
3855.0000 -216.14166 -207.63958 8.50208 2.47900 -207.97684 690.55402
3860.0000 -214.71882 -206.21180 8.50702 2.49596 -207.64378 696.58716
3865.0000 -216.33299 -208.81169 7.52130 2.47970 -207.96318 700.74748
3870.0000 -216.23158 -208.37096 7.86063 2.42237 -209.08878 687.47262
3875.0000 -216.54902 -208.23384 8.31518 2.47599 -208.03596 725.45089
3880.0000 -216.64353 -207.24145 9.40208 2.49026 -207.75585 736.26532
3885.0000 -216.06913 -208.60530 7.46383 2.45909 -208.36785 707.46119
3890.0000 -216.62925 -209.15264 7.47661 2.47055 -208.14271 715.25202
3895.0000 -216.69951 -209.50610 7.19341 2.43001 -208.93865 677.89890
3900.0000 -215.34755 -206.82314 8.52441 2.46108 -208.32868 672.27837
3905.0000 -215.99596 -207.81429 8.18167 2.51754 -207.22021 726.46194
3910.0000 -216.77652 -208.46481 8.31171 2.50089 -207.54707 694.99028
3915.0000 -216.02040 -208.27502 7.74538 2.49169 -207.72764 733.12517
3920.0000 -216.37153 -208.85875 7.51278 2.46352 -208.28072 700.94016
3925.0000 -216.32735 -208.09769 8.22966 2.40966 -209.33834 677.86501
3930.0000 -217.60980 -210.38375 7.22605 2.38536 -209.81549 648.90155
3935.0000 -216.41978 -208.42466 7.99512 2.41320 -209.26872 683.06567
3940.0000 -217.32985 -209.02911 8.30074 2.46661 -208.22004 693.58086
3945.0000 -217.36780 -209.15080 8.21700 2.41336 -209.26568 680.42323
3950.0000 -215.71152 -208.44535 7.26617 2.45760 -208.39698 691.65619
3955.0000 -216.28953 -210.13841 6.15112 2.46694 -208.21371 704.31379
3960.0000 -214.45664 -206.09439 8.36225 2.43987 -208.74509 700.17895
3965.0000 -215.01101 -205.94657 9.06445 2.55750 -206.43566 771.64713
3970.0000 -216.55542 -208.86651 7.68891 2.50177 -207.52987 726.18617
3975.0000 -214.96424 -207.56496 7.39927 2.46786 -208.19564 706.34382
3980.0000 -215.82166 -208.57002 7.25164 2.47243 -208.10593 700.52842
3985.0000 -217.75066 -210.42671 7.32395 2.39939 -209.53999 668.92769
3990.0000 -216.74777 -209.03456 7.71321 2.40225 -209.48384 667.61250
3995.0000 -215.45946 -208.28730 7.17216 2.45692 -208.41029 663.54454
4000.0000 -216.66211 -208.92937 7.73275 2.42282 -209.07996 685.05911
FREEZING PROCESS: loop number 17 T-loop= 663.00000000000000
main_MD> interactions number 17 at Temperature= 663.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.23183 1.17652 0.28587
force_rgl> df(natom) 2.42755 -1.67166 -0.42014
4005.0000 -217.08945 -208.67585 8.41360 2.48279 -207.90239 715.99956
4010.0000 -214.77079 -207.72084 7.04995 2.44357 -208.67241 682.79167
4015.0000 -217.98681 -210.57737 7.40943 2.42787 -208.98072 691.71100
4020.0000 -217.46493 -211.12229 6.34264 2.31634 -211.17065 603.18353
4025.0000 -216.84746 -210.12097 6.72649 2.38040 -209.91270 671.34630
4030.0000 -216.88202 -209.71903 7.16299 2.35766 -210.35929 632.07424
4035.0000 -216.27681 -208.51512 7.76169 2.41370 -209.25905 680.63390
4040.0000 -216.40921 -208.91237 7.49683 2.39749 -209.57719 653.03745
4045.0000 -216.77124 -209.67240 7.09884 2.37713 -209.97692 650.47238
4050.0000 -216.00077 -207.66079 8.33998 2.44688 -208.60743 702.57293
4055.0000 -216.50436 -207.54510 8.95926 2.49359 -207.69049 724.83603
4060.0000 -216.66471 -208.99662 7.66809 2.46561 -208.23979 701.55872
4065.0000 -215.27177 -208.18734 7.08442 2.43204 -208.89897 642.51398
4070.0000 -215.47243 -208.34562 7.12681 2.44997 -208.54680 666.34921
4075.0000 -216.27557 -208.91580 7.35977 2.44267 -208.69020 681.22201
4080.0000 -215.40451 -206.97360 8.43091 2.47688 -208.01857 694.17697
4085.0000 -216.65853 -207.84295 8.81558 2.52042 -207.16362 729.03006
4090.0000 -216.71876 -208.80749 7.91127 2.46109 -208.32843 676.48746
4095.0000 -218.74233 -210.91745 7.82488 2.38933 -209.73755 649.84593
4100.0000 -217.71421 -210.95531 6.75890 2.29143 -211.65962 603.69196
4105.0000 -216.89467 -209.65744 7.23722 2.34595 -210.58915 650.45339
4110.0000 -217.12560 -211.01809 6.10752 2.32745 -210.95233 621.26377
4115.0000 -216.45753 -209.90654 6.55098 2.40901 -209.35096 681.68371
4120.0000 -216.32914 -208.55506 7.77408 2.44507 -208.64308 696.06606
4125.0000 -217.64852 -210.49753 7.15099 2.39098 -209.70515 653.95258
4130.0000 -216.86105 -210.42659 6.43447 2.37090 -210.09931 633.26456
4135.0000 -217.28353 -209.14671 8.13682 2.37550 -210.00903 643.25293
4140.0000 -215.05252 -207.55089 7.50164 2.44649 -208.61516 700.05892
4145.0000 -218.25377 -210.40498 7.84879 2.43611 -208.81898 661.34886
4150.0000 -217.77423 -210.15682 7.61740 2.37266 -210.06476 645.45825
4155.0000 -218.04322 -210.34293 7.70029 2.40028 -209.52240 680.49945
4160.0000 -216.94116 -210.42417 6.51699 2.36291 -210.25621 641.72086
4165.0000 -217.48520 -209.62441 7.86079 2.39564 -209.61363 659.76884
4170.0000 -217.74333 -210.45161 7.29172 2.37708 -209.97801 651.82230
4175.0000 -217.04091 -210.72209 6.31882 2.35204 -210.46965 629.92493
4180.0000 -216.21376 -208.63802 7.57574 2.41878 -209.15918 700.09850
4185.0000 -216.61437 -209.33962 7.27475 2.42015 -209.13241 667.95408
4190.0000 -217.35453 -210.07813 7.27640 2.40809 -209.36911 668.14703
4195.0000 -217.38608 -210.19881 7.18728 2.35466 -210.41825 639.53519
4200.0000 -215.44194 -207.52854 7.91340 2.45392 -208.46920 712.87249
4205.0000 -215.59247 -207.76878 7.82368 2.47893 -207.97829 737.86369
4210.0000 -215.55378 -207.95124 7.60254 2.49194 -207.72286 724.98690
4215.0000 -216.85451 -209.91955 6.93495 2.43574 -208.82631 699.50267
4220.0000 -217.50256 -211.35660 6.14597 2.36506 -210.21392 656.66536
4225.0000 -217.91743 -210.31166 7.60576 2.34239 -210.65913 634.63681
4230.0000 -216.18889 -209.18732 7.00157 2.35625 -210.38687 640.97702
4235.0000 -217.60934 -210.43842 7.17092 2.34276 -210.65177 642.15689
4240.0000 -217.84125 -209.80218 8.03907 2.31674 -211.16273 642.89179
4245.0000 -217.73904 -210.07573 7.66331 2.39883 -209.55103 681.73441
4250.0000 -217.13197 -209.02811 8.10386 2.42808 -208.97673 703.54704
FREEZING PROCESS: loop number 18 T-loop= 638.00000000000000
main_MD> interactions number 18 at Temperature= 638.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.48359 2.92050 -1.70713
force_rgl> df(natom) 0.28261 1.15937 -2.76901
4255.0000 -217.38908 -210.43093 6.95816 2.40543 -209.42136 662.65769
4260.0000 -216.80429 -208.80390 8.00039 2.37637 -209.99185 656.19190
4265.0000 -217.58754 -209.64871 7.93883 2.43309 -208.87819 672.92555
4270.0000 -216.73922 -208.73973 7.99949 2.41193 -209.29373 668.49235
4275.0000 -217.32336 -210.20088 7.12247 2.38245 -209.87257 646.39212
4280.0000 -216.20754 -209.06885 7.13868 2.35912 -210.33053 658.60826
4285.0000 -217.22488 -209.43090 7.79398 2.44768 -208.59172 717.92413
4290.0000 -217.27857 -210.10508 7.17350 2.34329 -210.64143 629.59598
4295.0000 -218.17585 -210.95429 7.22156 2.35767 -210.35900 641.11322
4300.0000 -217.49876 -210.68487 6.81390 2.33359 -210.83184 632.79837
4305.0000 -218.64633 -211.34611 7.30022 2.30193 -211.45344 606.78971
4310.0000 -217.53122 -208.82177 8.70946 2.36533 -210.20864 652.72007
4315.0000 -217.08757 -210.80820 6.27937 2.38975 -209.72923 649.97714
4320.0000 -216.79214 -208.17710 8.61504 2.39767 -209.57374 658.35277
4325.0000 -216.13393 -208.12276 8.01117 2.42670 -209.00367 678.36698
4330.0000 -217.26480 -210.07838 7.18641 2.41793 -209.17592 685.05808
4335.0000 -218.12037 -210.49894 7.62143 2.41381 -209.25677 674.90950
4340.0000 -217.01895 -209.84698 7.17197 2.36068 -210.29991 655.80158
4345.0000 -217.38181 -209.84515 7.53666 2.38058 -209.90925 663.81714
4350.0000 -219.55727 -212.94895 6.60832 2.27276 -212.02626 595.95355
4355.0000 -218.26171 -211.37676 6.88495 2.26101 -212.25690 588.36425
4360.0000 -217.19052 -209.75641 7.43411 2.35331 -210.44459 633.98741
4365.0000 -217.98245 -210.51111 7.47134 2.32279 -211.04399 614.44519
4370.0000 -216.04759 -209.77388 6.27371 2.35447 -210.42189 625.31355
4375.0000 -216.98281 -210.23319 6.74962 2.35326 -210.44568 631.30449
4380.0000 -217.46804 -209.42700 8.04105 2.39354 -209.65485 665.76707
4385.0000 -217.03922 -209.17899 7.86023 2.37649 -209.98959 657.13144
4390.0000 -216.62298 -209.54619 7.07678 2.42399 -209.05696 664.73009
4395.0000 -217.17947 -209.67036 7.50911 2.36193 -210.27543 652.84774
4400.0000 -217.47373 -211.48269 5.99104 2.36824 -210.15156 655.32288
4405.0000 -218.28473 -212.30858 5.97616 2.29879 -211.51517 599.35427
4410.0000 -217.42792 -210.25686 7.17107 2.31585 -211.18019 626.56438
4415.0000 -217.45506 -210.38610 7.06896 2.33152 -210.87259 635.80026
4420.0000 -217.89584 -211.36650 6.52934 2.35447 -210.42197 642.85599
4425.0000 -218.95425 -212.30025 6.65400 2.31423 -211.21190 628.24877
4430.0000 -218.61879 -212.06556 6.55323 2.27943 -211.89521 607.93050
4435.0000 -217.81598 -210.43309 7.38289 2.27839 -211.91567 592.36102
4440.0000 -217.70816 -210.96787 6.74029 2.34532 -210.60147 636.91233
4445.0000 -218.04464 -211.43474 6.60989 2.33184 -210.86614 606.21937
4450.0000 -218.97231 -211.40106 7.57125 2.32304 -211.03891 617.63809
4455.0000 -217.40800 -210.38220 7.02580 2.29281 -211.63247 594.13844
4460.0000 -217.75182 -210.48863 7.26319 2.34368 -210.63383 630.24030
4465.0000 -217.21879 -209.58103 7.63775 2.32134 -211.07246 641.48850
4470.0000 -218.21296 -211.79009 6.42287 2.33616 -210.78147 637.15442
4475.0000 -218.63683 -211.89853 6.73830 2.27684 -211.94620 587.53582
4480.0000 -217.80410 -209.65789 8.14621 2.33711 -210.76273 608.92756
4485.0000 -216.75471 -208.84071 7.91401 2.41458 -209.24171 657.35539
4490.0000 -217.09479 -210.13511 6.95968 2.40833 -209.36444 649.64565
4495.0000 -215.31590 -209.62215 5.69376 2.40877 -209.35583 663.19633
4500.0000 -216.71540 -209.94058 6.77483 2.40557 -209.41855 646.08446
FREEZING PROCESS: loop number 19 T-loop= 613.00000000000000
main_MD> interactions number 19 at Temperature= 613.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.73283 -0.66474 1.44994
force_rgl> df(natom) -1.10551 -3.22952 0.92581
4505.0000 -218.32015 -210.74438 7.57577 2.35349 -210.44123 612.86150
4510.0000 -218.63846 -210.64045 7.99801 2.33832 -210.73898 638.03205
4515.0000 -217.15625 -210.81597 6.34028 2.35621 -210.38782 637.66786
4520.0000 -217.85830 -211.65483 6.20346 2.33589 -210.78675 599.22754
4525.0000 -218.33755 -212.06619 6.27136 2.25560 -212.36307 551.20294
4530.0000 -218.56854 -213.26423 5.30431 2.24278 -212.61494 553.64619
4535.0000 -218.38607 -212.59054 5.79553 2.22205 -213.02182 537.13282
4540.0000 -218.33102 -212.65860 5.67242 2.24573 -212.55693 548.64831
4545.0000 -217.53450 -210.86911 6.66539 2.26941 -212.09201 563.07321
4550.0000 -218.16801 -211.54405 6.62397 2.29211 -211.64631 570.07977
4555.0000 -219.49965 -212.85484 6.64481 2.23465 -212.77445 556.39514
4560.0000 -218.79370 -212.63009 6.16361 2.21012 -213.25610 554.67250
4565.0000 -219.58235 -212.96048 6.62187 2.24952 -212.48242 577.66282
4570.0000 -218.25038 -211.90026 6.35012 2.28179 -211.84887 585.06448
4575.0000 -219.24888 -211.97176 7.27712 2.26960 -212.08821 570.30709
4580.0000 -217.66896 -210.25026 7.41871 2.34579 -210.59226 613.73989
4585.0000 -216.51582 -209.90788 6.60794 2.35243 -210.46201 624.53759
4590.0000 -217.21891 -209.56261 7.65630 2.39481 -209.62982 683.43924
4595.0000 -218.53299 -211.80895 6.72405 2.36624 -210.19074 657.03591
4600.0000 -219.12870 -211.43962 7.68908 2.27486 -211.98490 576.42226
4605.0000 -219.59864 -213.17579 6.42285 2.26217 -212.23423 585.92799
4610.0000 -219.75454 -213.96872 5.78581 2.22356 -212.99212 553.87954
4615.0000 -218.57379 -211.90718 6.66660 2.21852 -213.09123 558.37605
4620.0000 -218.64895 -211.73306 6.91589 2.29641 -211.56188 588.13594
4625.0000 -217.31345 -209.93984 7.37361 2.32812 -210.93932 608.48505
4630.0000 -218.41684 -211.53428 6.88255 2.34916 -210.52617 633.92071
4635.0000 -218.69842 -211.70977 6.98865 2.28396 -211.80624 597.13090
4640.0000 -218.26528 -211.42581 6.83946 2.27718 -211.93934 606.16916
4645.0000 -217.49166 -210.97510 6.51656 2.32080 -211.08305 627.45897
4650.0000 -217.67531 -210.21864 7.45667 2.36714 -210.17308 651.95127
4655.0000 -217.94432 -210.56844 7.37588 2.35859 -210.34110 627.91930
4660.0000 -217.97154 -210.68337 7.28817 2.34480 -210.61181 639.47844
4665.0000 -218.63712 -211.09451 7.54261 2.35143 -210.48158 651.13621
4670.0000 -218.88213 -211.13342 7.74871 2.32982 -210.90587 648.48805
4675.0000 -218.64618 -211.31272 7.33346 2.30308 -211.43091 622.53259
4680.0000 -218.46548 -212.25604 6.20943 2.27581 -211.96627 623.22940
4685.0000 -219.32950 -212.79083 6.53867 2.29050 -211.67792 615.97997
4690.0000 -218.62775 -211.96057 6.66717 2.27327 -212.01617 584.02947
4695.0000 -219.04489 -211.97653 7.06836 2.29277 -211.63338 614.11849
4700.0000 -219.03516 -212.02786 7.00731 2.32668 -210.96752 638.82169
4705.0000 -218.06513 -210.69997 7.36516 2.29029 -211.68208 599.21174
4710.0000 -218.65840 -212.54691 6.11149 2.28891 -211.70904 608.51096
4715.0000 -217.45037 -210.45174 6.99863 2.29857 -211.51951 622.86278
4720.0000 -218.90087 -211.32722 7.57365 2.34620 -210.58428 623.51207
4725.0000 -217.33061 -210.20982 7.12079 2.35335 -210.44395 632.25252
4730.0000 -215.99335 -209.43469 6.55866 2.41097 -209.31250 674.11413
4735.0000 -216.63674 -209.45869 7.17804 2.40253 -209.47829 650.25067
4740.0000 -216.01915 -208.49481 7.52434 2.41532 -209.22718 666.15315
4745.0000 -216.74935 -209.40991 7.33944 2.45161 -208.51455 697.53165
4750.0000 -216.06898 -208.19692 7.87207 2.43742 -208.79320 680.35518
FREEZING PROCESS: loop number 20 T-loop= 588.00000000000000
main_MD> interactions number 20 at Temperature= 588.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.51788 3.36205 0.90850
force_rgl> df(natom) -0.57731 -2.40296 -0.10642
4755.0000 -217.63977 -210.69751 6.94226 2.38609 -209.80100 643.78199
4760.0000 -218.12680 -211.34825 6.77855 2.29142 -211.65975 577.61023
4765.0000 -217.75652 -211.20554 6.55098 2.33027 -210.89701 607.45435
4770.0000 -219.23627 -212.72549 6.51078 2.25388 -212.39692 587.99629
4775.0000 -218.97301 -212.47508 6.49792 2.24613 -212.54905 577.46789
4780.0000 -218.83711 -211.93373 6.90338 2.25714 -212.33291 555.33334
4785.0000 -218.35030 -210.94144 7.40885 2.29826 -211.52560 587.57186
4790.0000 -217.67051 -211.34672 6.32379 2.31113 -211.27286 599.41165
4795.0000 -217.14297 -210.29918 6.84378 2.36266 -210.26105 622.43637
4800.0000 -217.85250 -210.97949 6.87301 2.35127 -210.48479 628.73226
4805.0000 -219.69435 -212.72424 6.97010 2.28751 -211.73667 600.32426
4810.0000 -218.64056 -212.60381 6.03675 2.21135 -213.23203 543.93189
4815.0000 -219.45691 -214.04822 5.40869 2.19867 -213.48093 533.67350
4820.0000 -219.16975 -212.45526 6.71448 2.19668 -213.52006 546.33489
4825.0000 -218.84823 -212.20596 6.64226 2.25498 -212.37529 582.82125
4830.0000 -218.75311 -213.43038 5.32272 2.20549 -213.34709 556.30217
4835.0000 -219.48344 -212.80088 6.68256 2.21075 -213.24371 546.18571
4840.0000 -217.96343 -212.24325 5.72018 2.24716 -212.52879 566.44222
4845.0000 -219.67807 -211.42877 8.24930 2.27138 -212.05331 597.74353
4850.0000 -219.32176 -213.33232 5.98944 2.20539 -213.34904 566.02848
4855.0000 -219.69381 -212.98381 6.71000 2.24880 -212.49675 591.82452
4860.0000 -219.27759 -212.86478 6.41281 2.20882 -213.28171 561.27872
4865.0000 -219.70699 -214.06507 5.64192 2.16374 -214.16673 535.80765
4870.0000 -218.59251 -211.76949 6.82302 2.22171 -213.02862 567.23812
4875.0000 -218.99434 -212.94558 6.04876 2.23047 -212.85654 569.85769
4880.0000 -220.12322 -212.76065 7.36257 2.23258 -212.81504 570.57085
4885.0000 -219.85940 -212.97943 6.87997 2.22520 -212.95994 565.57812
4890.0000 -218.44255 -211.57605 6.86650 2.23304 -212.80612 579.85293
4895.0000 -218.28935 -212.15805 6.13130 2.28365 -211.81247 588.25232
4900.0000 -218.65931 -211.17584 7.48348 2.26608 -212.15740 578.90954
4905.0000 -217.68771 -210.95248 6.73523 2.26221 -212.23335 580.96113
4910.0000 -218.36961 -211.00892 7.36069 2.32259 -211.04793 602.55645
4915.0000 -218.54764 -211.83418 6.71346 2.29299 -211.62909 610.20369
4920.0000 -220.34154 -213.43304 6.90850 2.23612 -212.74568 584.47064
4925.0000 -219.79130 -213.23098 6.56032 2.17540 -213.93787 542.27194
4930.0000 -220.60923 -214.54442 6.06481 2.17627 -213.92062 543.52996
4935.0000 -219.46891 -212.86944 6.59947 2.20094 -213.43638 560.04366
4940.0000 -218.74421 -212.73906 6.00515 2.26680 -212.14316 583.48274
4945.0000 -218.81782 -212.90054 5.91729 2.25047 -212.46396 577.67671
4950.0000 -219.45209 -212.31078 7.14131 2.26061 -212.26471 579.85077
4955.0000 -217.68212 -211.75396 5.92816 2.25720 -212.33179 558.37834
4960.0000 -218.57338 -211.61575 6.95764 2.28502 -211.78556 600.31101
4965.0000 -218.49717 -212.37790 6.11927 2.27312 -212.01922 591.12943
4970.0000 -218.75317 -211.74499 7.00818 2.29820 -211.52668 595.97137
4975.0000 -217.23781 -210.67257 6.56524 2.29132 -211.66183 598.48085
4980.0000 -218.65984 -212.20657 6.45327 2.30036 -211.48424 601.85299
4985.0000 -218.08391 -212.55540 5.52851 2.28050 -211.87417 595.07804
4990.0000 -217.91691 -210.46164 7.45527 2.30514 -211.39045 602.48209
4995.0000 -218.41028 -212.00680 6.40347 2.32699 -210.96143 622.10943
5000.0000 -218.28047 -211.77848 6.50199 2.28451 -211.79545 595.14366
FREEZING PROCESS: loop number 21 T-loop= 563.00000000000000
main_MD> interactions number 21 at Temperature= 563.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.36756 -2.97965 -2.95510
force_rgl> df(natom) -1.64274 -0.60179 -2.67269
5005.0000 -219.42765 -213.45225 5.97540 2.22595 -212.94522 552.54007
5010.0000 -219.08191 -212.25800 6.82391 2.20733 -213.31092 527.35236
5015.0000 -220.17842 -214.27215 5.90627 2.21426 -213.17474 542.20370
5020.0000 -219.00114 -213.58800 5.41315 2.18348 -213.77915 516.76354
5025.0000 -220.04884 -213.26563 6.78321 2.22290 -213.00519 558.46838
5030.0000 -220.03273 -213.13554 6.89719 2.20400 -213.37616 583.85172
5035.0000 -220.12198 -213.37423 6.74775 2.21954 -213.07113 572.42248
5040.0000 -218.92071 -212.86030 6.06041 2.19085 -213.63450 559.79023
5045.0000 -220.18522 -213.86677 6.31845 2.21457 -213.16867 555.09426
5050.0000 -218.11720 -212.15976 5.95745 2.23949 -212.67954 560.48273
5055.0000 -218.10612 -211.13963 6.96649 2.27648 -211.95317 588.14778
5060.0000 -218.98965 -212.20859 6.78106 2.30312 -211.43021 620.04395
5065.0000 -218.76168 -212.15567 6.60601 2.23645 -212.73923 573.45215
5070.0000 -219.52574 -212.62025 6.90549 2.23135 -212.83925 565.49089
5075.0000 -220.20207 -214.71923 5.48284 2.18800 -213.69036 536.64262
5080.0000 -220.48738 -214.29920 6.18818 2.11088 -215.20462 508.79669
5085.0000 -220.27227 -213.63798 6.63428 2.18747 -213.70080 564.90995
5090.0000 -219.90748 -214.01853 5.88895 2.18561 -213.73729 556.03713
5095.0000 -219.81377 -213.62135 6.19242 2.17820 -213.88278 546.33883
5100.0000 -218.34294 -212.08725 6.25569 2.24663 -212.53935 587.18177
5105.0000 -219.52388 -212.88964 6.63424 2.25534 -212.36825 586.23216
5110.0000 -218.99208 -212.88844 6.10364 2.25203 -212.43331 565.86149
5115.0000 -218.78354 -212.50745 6.27609 2.24799 -212.51261 570.94485
5120.0000 -219.27464 -212.81994 6.45470 2.26000 -212.27674 582.76606
5125.0000 -219.09819 -212.00846 7.08973 2.26654 -212.14841 615.67072
5130.0000 -219.54529 -214.04488 5.50041 2.23939 -212.68148 584.01259
5135.0000 -220.70329 -213.65765 7.04564 2.18432 -213.76261 546.21909
5140.0000 -220.56676 -213.95462 6.61214 2.19828 -213.48863 558.57126
5145.0000 -220.46478 -214.12387 6.34090 2.18625 -213.72471 552.96774
5150.0000 -220.41319 -214.17481 6.23839 2.14129 -214.60757 513.71015
5155.0000 -219.89559 -213.79188 6.10371 2.17569 -213.93215 524.99327
5160.0000 -219.34556 -213.71550 5.63007 2.18186 -213.81100 515.23629
5165.0000 -218.99031 -213.33473 5.65558 2.18811 -213.68831 522.47390
5170.0000 -220.86132 -215.31930 5.54202 2.16860 -214.07124 521.68678
5175.0000 -219.09859 -212.58909 6.50950 2.15993 -214.24151 506.63207
5180.0000 -218.71761 -211.54233 7.17527 2.27208 -212.03957 607.38926
5185.0000 -219.24765 -212.65167 6.59598 2.26952 -212.08990 597.92521
5190.0000 -219.90157 -214.11338 5.78818 2.19962 -213.46235 577.86265
5195.0000 -221.21272 -213.96170 7.25101 2.17442 -213.95696 544.64016
5200.0000 -219.68015 -213.87078 5.80936 2.17351 -213.97485 531.86836
5205.0000 -219.51763 -214.00555 5.51208 2.15444 -214.34930 537.98407
5210.0000 -219.79265 -213.02552 6.76713 2.16828 -214.07753 547.88180
5215.0000 -220.26208 -214.46014 5.80195 2.17224 -213.99978 552.97247
5220.0000 -219.75514 -213.10346 6.65168 2.13869 -214.65861 516.95705
5225.0000 -219.41593 -213.24698 6.16895 2.22110 -213.04060 575.66245
5230.0000 -218.04475 -212.16385 5.88090 2.21915 -213.07889 582.55384
5235.0000 -220.69418 -213.25589 7.43829 2.22284 -213.00636 589.97398
5240.0000 -218.60757 -212.04929 6.55828 2.25173 -212.43909 569.13376
5245.0000 -218.30805 -212.23866 6.06939 2.24747 -212.52281 549.48715
5250.0000 -219.34222 -213.58614 5.75607 2.21792 -213.10291 525.27666
FREEZING PROCESS: loop number 22 T-loop= 538.00000000000000
main_MD> interactions number 22 at Temperature= 538.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.82490 -0.02524 -1.99163
force_rgl> df(natom) 1.78785 -0.63703 -0.77665
5255.0000 -219.83637 -213.80953 6.02684 2.20193 -213.41685 514.61139
5260.0000 -219.08777 -212.19645 6.89132 2.22143 -213.03405 546.42430
5265.0000 -218.48522 -212.48474 6.00048 2.28460 -211.79375 596.98255
5270.0000 -218.70077 -212.74226 5.95851 2.25155 -212.44259 547.17140
5275.0000 -219.52727 -212.99137 6.53590 2.22191 -213.02457 549.68341
5280.0000 -219.14587 -212.70335 6.44252 2.22858 -212.89364 541.71399
5285.0000 -218.04883 -211.89488 6.15394 2.26818 -212.11609 570.39705
5290.0000 -219.26566 -213.80351 5.46216 2.21077 -213.24336 527.04870
5295.0000 -218.81815 -213.64118 5.17696 2.17248 -213.99506 521.33163
5300.0000 -218.68684 -211.42863 7.25822 2.22098 -213.04278 552.10290
5305.0000 -218.66950 -213.09979 5.56971 2.23513 -212.76503 546.47487
5310.0000 -219.99607 -213.67801 6.31806 2.21304 -213.19886 550.06277
5315.0000 -219.41887 -212.37797 7.04090 2.22289 -213.00532 561.28900
5320.0000 -220.02075 -213.07468 6.94607 2.22059 -213.05056 559.40811
5325.0000 -219.11501 -213.49581 5.61920 2.22079 -213.04656 554.12867
5330.0000 -219.95601 -214.09031 5.86569 2.15894 -214.26095 515.40882
5335.0000 -219.28635 -213.22986 6.05648 2.18048 -213.83803 520.11950
5340.0000 -219.29499 -212.26766 7.02732 2.20935 -213.27124 542.96636
5345.0000 -220.02658 -213.05573 6.97085 2.21076 -213.24357 547.04703
5350.0000 -219.17046 -213.67257 5.49789 2.20567 -213.34354 554.37199
5355.0000 -219.10099 -213.43454 5.66644 2.21587 -213.14321 573.62969
5360.0000 -220.12724 -214.51690 5.61033 2.15434 -214.35134 527.25470
5365.0000 -219.74792 -213.19885 6.54907 2.19939 -213.46673 562.27402
5370.0000 -219.99045 -213.38944 6.60101 2.23339 -212.79928 594.39736
5375.0000 -219.66034 -213.52681 6.13353 2.18908 -213.66914 553.84672
5380.0000 -219.48244 -212.95064 6.53180 2.21891 -213.08345 579.81510
5385.0000 -219.66484 -213.38070 6.28415 2.20879 -213.28216 565.90535
5390.0000 -220.65306 -214.36999 6.28307 2.16055 -214.22943 532.45409
5395.0000 -219.99873 -214.02296 5.97576 2.18941 -213.66274 561.19513
5400.0000 -220.44640 -214.11493 6.33148 2.18545 -213.74052 541.55576
5405.0000 -219.85211 -213.36704 6.48507 2.18690 -213.71191 539.15074
5410.0000 -219.61198 -213.43563 6.17635 2.20023 -213.45037 534.30076
5415.0000 -218.49333 -213.05503 5.43830 2.19226 -213.60686 521.31762
5420.0000 -219.67686 -213.94150 5.73536 2.20601 -213.33679 520.59412
5425.0000 -220.15391 -214.15806 5.99586 2.15652 -214.30846 521.59876
5430.0000 -221.18118 -215.45997 5.72121 2.10094 -215.39983 491.41948
5435.0000 -220.67534 -214.51666 6.15868 2.09859 -215.44596 484.50593
5440.0000 -220.13022 -213.91140 6.21881 2.18597 -213.73024 549.96294
5445.0000 -219.75286 -213.88981 5.86304 2.19809 -213.49229 539.22470
5450.0000 -219.91337 -214.55887 5.35449 2.18235 -213.80137 550.82048
5455.0000 -220.71410 -214.30670 6.40741 2.16226 -214.19586 536.26243
5460.0000 -219.62167 -213.78192 5.83975 2.17013 -214.04127 545.58036
5465.0000 -221.10286 -215.03635 6.06651 2.16365 -214.16843 549.59092
5470.0000 -221.20886 -215.69047 5.51839 2.10481 -215.32373 497.06525
5475.0000 -220.52823 -213.92175 6.60648 2.11780 -215.06864 497.05038
5480.0000 -220.03917 -213.80265 6.23652 2.16858 -214.07161 527.20871
5485.0000 -220.12637 -214.76886 5.35751 2.17708 -213.90491 535.12130
5490.0000 -219.61768 -213.48236 6.13532 2.15694 -214.30032 523.99597
5495.0000 -219.19078 -214.40455 4.78623 2.19370 -213.57841 521.82969
5500.0000 -220.53161 -213.44125 7.09037 2.18705 -213.70900 518.17441
FREEZING PROCESS: loop number 23 T-loop= 513.00000000000000
main_MD> interactions number 23 at Temperature= 513.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.29534 -0.37197 -0.75390
force_rgl> df(natom) -0.30024 -0.22064 4.75134
5505.0000 -219.08816 -213.37763 5.71053 2.20172 -213.42107 534.32939
5510.0000 -220.28741 -214.46181 5.82559 2.16698 -214.10317 522.56199
5515.0000 -220.16791 -213.62977 6.53814 2.15222 -214.39288 513.13573
5520.0000 -220.72108 -214.68452 6.03656 2.18677 -213.71453 539.35010
5525.0000 -219.25769 -214.39220 4.86549 2.14824 -214.47105 513.32093
5530.0000 -220.11435 -213.67074 6.44361 2.15258 -214.38582 522.00437
5535.0000 -220.26632 -213.32891 6.93741 2.20006 -213.45358 554.55218
5540.0000 -220.54548 -214.86735 5.67812 2.16474 -214.14717 528.43749
5545.0000 -219.53882 -214.37667 5.16215 2.15470 -214.34427 524.89057
5550.0000 -221.25729 -214.61346 6.64384 2.13063 -214.81678 499.09289
5555.0000 -221.35183 -214.58870 6.76312 2.15836 -214.27228 519.25701
5560.0000 -221.13044 -215.49482 5.63561 2.11866 -215.05190 511.13475
5565.0000 -219.49682 -214.02644 5.47037 2.13858 -214.66082 510.82516
5570.0000 -219.80673 -213.54793 6.25880 2.14182 -214.59720 500.45764
5575.0000 -220.02605 -213.37604 6.65001 2.18390 -213.77098 537.96407
5580.0000 -220.58724 -215.00717 5.58006 2.16485 -214.14503 553.68125
5585.0000 -220.83850 -214.97775 5.86075 2.12491 -214.92917 538.38668
5590.0000 -220.12248 -214.32889 5.79359 2.14528 -214.52925 545.87224
5595.0000 -220.29934 -214.08836 6.21098 2.15713 -214.29649 526.38648
5600.0000 -219.66812 -213.85844 5.80969 2.15185 -214.40010 544.07486
5605.0000 -220.63210 -214.42123 6.21086 2.15794 -214.28070 533.48027
5610.0000 -220.32765 -214.48579 5.84186 2.14400 -214.55422 527.47925
5615.0000 -221.06485 -215.47750 5.58735 2.12528 -214.92182 514.35755
5620.0000 -220.52976 -214.89220 5.63756 2.10229 -215.37318 491.07371
5625.0000 -221.45444 -215.78320 5.67124 2.09113 -215.59229 480.05757
5630.0000 -220.94741 -215.23789 5.70952 2.10175 -215.38393 489.76703
5635.0000 -221.44062 -215.68565 5.75497 2.05783 -216.24625 483.76784
5640.0000 -221.17503 -214.64023 6.53480 2.11139 -215.19455 506.20418
5645.0000 -221.77055 -216.44281 5.32774 2.08003 -215.81035 480.83120
5650.0000 -221.56907 -215.76374 5.80533 2.09253 -215.56490 510.12744
5655.0000 -220.82120 -214.50797 6.31323 2.11131 -215.19616 512.94752
5660.0000 -221.75486 -215.99816 5.75670 2.09877 -215.44227 515.28910
5665.0000 -221.24264 -216.24905 4.99359 2.05544 -216.29313 496.05038
5670.0000 -221.96875 -216.58960 5.37916 2.02919 -216.80843 487.58011
5675.0000 -222.26206 -217.15815 5.10391 2.04210 -216.55502 490.69185
5680.0000 -222.35985 -216.68804 5.67181 2.02124 -216.96465 475.81524
5685.0000 -221.71108 -216.59977 5.11131 2.08442 -215.72407 525.45522
5690.0000 -222.24074 -216.87562 5.36513 2.03025 -216.78768 478.34658
5695.0000 -221.23961 -215.38668 5.85292 2.07438 -215.92119 516.31598
5700.0000 -221.31959 -216.17711 5.14248 2.06442 -216.11687 518.48706
5705.0000 -222.41490 -215.54043 6.87447 2.07946 -215.82156 527.64784
5710.0000 -222.55822 -215.87553 6.68269 2.05772 -216.24834 497.55265
5715.0000 -220.73142 -215.11114 5.62028 2.10152 -215.38842 522.64931
5720.0000 -221.74710 -215.17224 6.57487 2.09903 -215.43724 529.57137
5725.0000 -220.68681 -215.60795 5.07886 2.07922 -215.82622 514.45529
5730.0000 -221.04058 -215.81451 5.22607 2.09357 -215.54438 517.35812
5735.0000 -222.61507 -216.57103 6.04404 2.06321 -216.14065 501.97449
5740.0000 -222.77468 -217.54082 5.23386 2.00429 -217.29733 457.17312
5745.0000 -222.23155 -216.31105 5.92051 2.01327 -217.12104 466.70182
5750.0000 -221.16611 -215.26841 5.89770 2.07332 -215.94202 502.03585
FREEZING PROCESS: loop number 24 T-loop= 488.00000000000000
main_MD> interactions number 24 at Temperature= 488.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -2.30476 1.25904 -0.52167
force_rgl> df(natom) -2.49674 0.00121 0.54345
5755.0000 -221.78328 -217.01202 4.77126 2.05446 -216.31234 476.05226
5760.0000 -222.56231 -217.07884 5.48348 1.99810 -217.41889 439.39495
5765.0000 -222.40274 -216.62333 5.77941 2.03206 -216.75215 466.97824
5770.0000 -222.34154 -216.67218 5.66936 2.01952 -216.99843 472.25608
5775.0000 -221.78663 -215.01526 6.77137 2.09712 -215.47484 534.95669
5780.0000 -220.32625 -214.57890 5.74734 2.12368 -214.95329 544.92326
5785.0000 -222.12657 -216.92697 5.19961 2.07622 -215.88505 516.73865
5790.0000 -221.55346 -215.71975 5.83371 2.05270 -216.34688 505.61848
5795.0000 -220.63946 -215.10296 5.53650 2.08319 -215.74827 498.26279
5800.0000 -221.89340 -216.41686 5.47654 2.07662 -215.87730 490.49083
5805.0000 -222.99157 -217.19447 5.79710 2.01566 -217.07419 463.48881
5810.0000 -222.23027 -217.14186 5.08841 2.01731 -217.04179 473.71473
5815.0000 -222.10605 -216.90811 5.19794 2.02276 -216.93482 473.85332
5820.0000 -221.68081 -216.89094 4.78987 2.02286 -216.93280 447.10635
5825.0000 -221.21608 -215.82173 5.39435 2.05190 -216.36271 457.56798
5830.0000 -221.06316 -215.48912 5.57404 2.08738 -215.66601 478.68336
5835.0000 -220.78798 -215.11972 5.66826 2.10130 -215.39276 499.63203
5840.0000 -220.89402 -214.89550 5.99852 2.12516 -214.92425 530.46243
5845.0000 -221.32940 -214.82839 6.50101 2.12904 -214.84800 529.07493
5850.0000 -221.37268 -215.53528 5.83739 2.11151 -215.19224 542.25554
5855.0000 -221.70396 -216.09187 5.61209 2.05117 -216.37690 487.15277
5860.0000 -222.32201 -216.66258 5.65943 2.04965 -216.40676 484.92068
5865.0000 -221.60134 -216.19253 5.40881 2.05837 -216.23559 488.98911
5870.0000 -221.75709 -216.00525 5.75184 2.04133 -216.57022 478.60067
5875.0000 -222.24903 -216.47861 5.77043 2.02778 -216.83616 462.48066
5880.0000 -222.20920 -216.53591 5.67329 2.05052 -216.38975 478.18031
5885.0000 -222.31279 -216.34983 5.96296 2.04580 -216.48235 463.07857
5890.0000 -220.79222 -215.44494 5.34728 2.09521 -215.51217 491.42875
5895.0000 -220.61678 -215.40211 5.21467 2.11951 -215.03519 490.32463
5900.0000 -220.94896 -214.90644 6.04252 2.11853 -215.05438 484.42792
5905.0000 -220.98902 -214.71786 6.27116 2.11331 -215.15695 491.53200
5910.0000 -221.21008 -215.76390 5.44619 2.13023 -214.82466 494.37038
5915.0000 -220.52231 -215.14237 5.37995 2.11278 -215.16735 470.23937
5920.0000 -220.97615 -215.58152 5.39462 2.10836 -215.25410 490.33897
5925.0000 -221.91655 -216.57540 5.34115 2.05850 -216.23313 463.75170
5930.0000 -221.65959 -215.84054 5.81905 2.05174 -216.36581 466.38364
5935.0000 -221.22973 -216.55419 4.67555 2.05248 -216.35131 461.66184
5940.0000 -221.08139 -215.42881 5.65257 2.04806 -216.43803 450.82377
5945.0000 -219.17785 -213.84975 5.32810 2.12939 -214.84112 511.94948
5950.0000 -221.33265 -215.61358 5.71907 2.13010 -214.82724 509.22894
5955.0000 -220.53873 -215.40446 5.13427 2.10776 -215.26589 504.32492
5960.0000 -221.49759 -216.57142 4.92616 2.09441 -215.52807 488.01396
5965.0000 -221.03661 -215.64484 5.39176 2.07943 -215.82213 478.89512
5970.0000 -220.62215 -215.34761 5.27454 2.09227 -215.57004 506.38663
5975.0000 -222.25318 -216.86197 5.39121 2.04098 -216.57708 465.42428
5980.0000 -223.13028 -216.69795 6.43233 2.03399 -216.71432 484.83428
5985.0000 -221.90638 -216.53814 5.36823 2.02997 -216.79326 490.09709
5990.0000 -222.40461 -217.11801 5.28660 2.02256 -216.93866 480.02054
5995.0000 -222.89611 -217.55255 5.34356 2.01957 -216.99742 484.67910
6000.0000 -221.91079 -217.40577 4.50502 1.98151 -217.74461 448.44287
FREEZING PROCESS: loop number 25 T-loop= 463.00000000000000
main_MD> interactions number 25 at Temperature= 463.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.75981 -1.08846 -1.02151
force_rgl> df(natom) 1.38370 1.56309 1.92961
6005.0000 -222.61056 -217.96397 4.64658 1.97297 -217.91244 430.10516
6010.0000 -221.64875 -216.39414 5.25461 1.99614 -217.45738 438.02177
6015.0000 -223.09156 -217.41425 5.67731 2.03040 -216.78484 474.41530
6020.0000 -221.37821 -216.85757 4.52064 2.01721 -217.04365 462.68797
6025.0000 -222.46107 -217.38105 5.08003 2.02588 -216.87356 463.15398
6030.0000 -222.11308 -217.16191 4.95118 2.03215 -216.75032 463.11747
6035.0000 -221.28964 -216.64634 4.64330 2.02583 -216.87450 445.94954
6040.0000 -221.34752 -215.29950 6.04801 2.09567 -215.50332 528.74510
6045.0000 -221.64173 -216.49901 5.14272 2.06472 -216.11094 500.95644
6050.0000 -222.67697 -217.34466 5.33231 2.01478 -217.09148 468.79813
6055.0000 -221.87246 -216.45431 5.41815 2.03272 -216.73921 486.51923
6060.0000 -222.42213 -216.17813 6.24400 2.06039 -216.19592 498.81814
6065.0000 -222.00142 -216.79938 5.20204 2.04625 -216.47348 488.47821
6070.0000 -222.65400 -217.68301 4.97099 2.02398 -216.91071 478.40034
6075.0000 -222.70440 -217.68762 5.01677 1.97012 -217.96831 440.39308
6080.0000 -222.89939 -217.27316 5.62623 1.98033 -217.76775 447.23645
6085.0000 -222.20058 -216.37684 5.82374 2.05426 -216.31636 497.96695
6090.0000 -222.82309 -217.90438 4.91871 2.00149 -217.35246 458.57776
6095.0000 -222.02018 -217.67839 4.34179 2.00707 -217.24288 455.09443
6100.0000 -222.87056 -218.12995 4.74061 1.97689 -217.83544 437.77039
6105.0000 -222.55381 -218.01944 4.53437 1.99001 -217.57787 446.32929
6110.0000 -222.61492 -217.85742 4.75751 1.97740 -217.82531 440.31393
6115.0000 -222.65136 -217.45117 5.20019 1.96453 -218.07803 424.20736
6120.0000 -222.25826 -216.72005 5.53820 2.01249 -217.13641 453.05593
6125.0000 -222.13382 -217.30160 4.83222 2.01630 -217.06161 462.52280
6130.0000 -221.62184 -216.57712 5.04472 2.00079 -217.36620 462.79848
6135.0000 -222.29591 -216.90741 5.38851 2.01640 -217.05965 474.09101
6140.0000 -222.21825 -216.45154 5.76671 2.02403 -216.90987 478.15814
6145.0000 -221.60190 -216.92463 4.67727 2.01991 -216.99063 454.25938
6150.0000 -222.52173 -217.50032 5.02141 2.01385 -217.10975 462.66504
6155.0000 -222.64392 -217.54958 5.09434 2.00244 -217.33372 460.49896
6160.0000 -222.32984 -217.32273 5.00710 2.00208 -217.34080 461.84446
6165.0000 -222.05439 -217.39699 4.65740 2.01079 -217.16973 472.12179
6170.0000 -223.50261 -218.18792 5.31468 1.95859 -218.19462 427.26122
6175.0000 -222.30738 -217.48896 4.81841 1.97747 -217.82395 438.64161
6180.0000 -221.94198 -216.35585 5.58613 2.01308 -217.12483 449.07028
6185.0000 -222.17238 -217.37021 4.80217 2.03988 -216.59863 490.57047
6190.0000 -222.27097 -217.43028 4.84069 2.01102 -217.16529 470.42656
6195.0000 -222.74196 -217.51218 5.22978 2.01218 -217.14247 468.58293
6200.0000 -222.71129 -217.16521 5.54607 2.03772 -216.64111 494.32318
6205.0000 -222.64863 -217.22373 5.42490 2.03551 -216.68444 488.77344
6210.0000 -222.29667 -216.48527 5.81140 2.01706 -217.04666 477.29834
6215.0000 -222.34882 -216.97272 5.37610 2.03580 -216.67868 494.16900
6220.0000 -222.16057 -217.06157 5.09900 2.02459 -216.89888 489.79019
6225.0000 -222.46525 -217.42742 5.03783 1.99882 -217.40479 466.22743
6230.0000 -222.70856 -217.26905 5.43951 1.97143 -217.94259 450.20042
6235.0000 -222.13664 -217.14354 4.99310 2.01763 -217.03542 453.89766
6240.0000 -221.28081 -215.82962 5.45119 2.05176 -216.36532 481.70010
6245.0000 -221.88549 -216.75083 5.13466 2.07904 -215.82972 499.58342
6250.0000 -222.13572 -217.33322 4.80249 2.04016 -216.59320 475.46542
FREEZING PROCESS: loop number 26 T-loop= 438.00000000000000
main_MD> interactions number 26 at Temperature= 438.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.71617 -3.98515 0.68379
force_rgl> df(natom) 0.48010 0.57373 0.24316
6255.0000 -223.00054 -217.84165 5.15889 1.96738 -218.02217 441.15754
6260.0000 -223.57997 -218.50635 5.07362 1.95108 -218.34210 436.29729
6265.0000 -223.67835 -218.22712 5.45123 1.95593 -218.24694 439.10289
6270.0000 -222.55693 -217.75541 4.80152 1.99531 -217.47375 467.31754
6275.0000 -223.95667 -218.96835 4.98832 1.95448 -218.27546 437.43419
6280.0000 -223.42839 -218.30046 5.12793 1.94936 -218.37589 439.36074
6285.0000 -222.68978 -217.72992 4.95987 1.98294 -217.71651 460.98002
6290.0000 -222.90612 -217.38620 5.51993 1.99544 -217.47107 472.33838
6295.0000 -222.87383 -217.89741 4.97642 1.97220 -217.92746 448.06443
6300.0000 -223.99469 -218.62590 5.36879 1.95479 -218.26936 438.99526
6305.0000 -222.81042 -217.80529 5.00513 1.95937 -218.17933 445.53765
6310.0000 -223.47858 -218.45655 5.02202 1.93559 -218.64620 425.37132
6315.0000 -222.91988 -217.47974 5.44014 1.97172 -217.93680 452.19834
6320.0000 -222.60353 -217.10908 5.49445 1.99842 -217.41260 475.22695
6325.0000 -222.73339 -217.86558 4.86781 1.97622 -217.84856 454.72701
6330.0000 -223.00999 -218.05029 4.95969 1.95898 -218.18707 441.14273
6335.0000 -223.87509 -219.86015 4.01494 1.92567 -218.84113 419.12862
6340.0000 -223.42753 -218.40939 5.01814 1.90313 -219.28365 400.12648
6345.0000 -222.58273 -217.27190 5.31083 1.97782 -217.81705 453.02920
6350.0000 -222.84084 -217.62549 5.21535 1.98452 -217.68565 455.19842
6355.0000 -222.66924 -218.42894 4.24030 1.96942 -217.98212 442.38447
6360.0000 -222.88245 -218.26145 4.62100 1.93429 -218.67176 423.16655
6365.0000 -222.77449 -217.96473 4.80976 1.97463 -217.87985 452.38762
6370.0000 -223.05954 -217.72823 5.33132 1.97575 -217.85771 456.82326
6375.0000 -223.08638 -217.51191 5.57447 1.95770 -218.21225 439.65174
6380.0000 -223.22026 -218.19736 5.02290 1.93979 -218.56385 425.77440
6385.0000 -222.70446 -217.97636 4.72810 1.93216 -218.71358 423.33081
6390.0000 -221.66700 -216.72373 4.94327 2.01487 -217.08963 475.07131
6395.0000 -223.54438 -218.34773 5.19665 2.01065 -217.17255 464.03616
6400.0000 -223.12460 -217.14268 5.98192 1.98303 -217.71480 453.69834
6405.0000 -222.28709 -217.87022 4.41686 1.97859 -217.80195 451.13534
6410.0000 -222.68620 -217.41617 5.27003 2.00793 -217.22595 468.94782
6415.0000 -223.46962 -218.96159 4.50803 1.93912 -218.57688 421.86850
6420.0000 -222.90243 -218.53019 4.37224 1.92820 -218.79141 415.37566
6425.0000 -223.15085 -218.14273 5.00812 1.94659 -218.43025 428.72307
6430.0000 -222.82383 -217.82236 5.00147 1.98405 -217.69488 456.08571
6435.0000 -223.15631 -218.02420 5.13210 1.98376 -217.70055 455.70882
6440.0000 -222.69961 -217.79147 4.90814 1.95730 -218.22005 439.22149
6445.0000 -223.68715 -219.25167 4.43548 1.94152 -218.52975 428.25020
6450.0000 -223.56841 -217.86965 5.69876 1.94132 -218.53369 431.02714
6455.0000 -222.79030 -218.31854 4.47176 1.99672 -217.44606 471.29100
6460.0000 -223.41616 -218.91803 4.49813 1.91982 -218.95590 410.59774
6465.0000 -222.62125 -217.97967 4.64158 1.96052 -218.15689 446.27113
6470.0000 -222.74271 -217.69371 5.04900 1.97965 -217.78114 459.25419
6475.0000 -223.16773 -218.70632 4.46142 1.96067 -218.15376 445.31295
6480.0000 -223.55436 -218.90397 4.65038 1.94508 -218.45992 425.56958
6485.0000 -222.78217 -217.96314 4.81904 1.92949 -218.76599 419.35447
6490.0000 -223.31808 -219.02549 4.29258 1.93277 -218.70166 419.90043
6495.0000 -223.02171 -218.42213 4.59958 1.95683 -218.22926 439.86214
6500.0000 -223.27820 -217.98980 5.28840 1.97652 -217.84255 454.19475
FREEZING PROCESS: loop number 27 T-loop= 413.00000000000000
main_MD> interactions number 27 at Temperature= 413.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.71349 1.72524 -2.01594
force_rgl> df(natom) 0.50590 -1.11274 0.84049
6505.0000 -222.86064 -218.14229 4.71836 1.94898 -218.38333 437.84834
6510.0000 -223.45792 -218.74237 4.71556 1.96765 -218.01675 451.81347
6515.0000 -223.73973 -219.24424 4.49549 1.90887 -219.17083 405.05982
6520.0000 -223.83196 -219.12169 4.71026 1.90959 -219.15681 406.03778
6525.0000 -223.14152 -217.93511 5.20642 1.93532 -218.65152 417.33313
6530.0000 -223.79324 -219.17240 4.62083 1.94200 -218.52040 431.86181
6535.0000 -223.33912 -219.04414 4.29498 1.90517 -219.24362 401.23242
6540.0000 -223.42810 -218.89673 4.53136 1.92630 -218.82865 417.81103
6545.0000 -224.19378 -219.58965 4.60413 1.90387 -219.26914 400.28860
6550.0000 -224.91355 -220.57634 4.33720 1.87660 -219.80457 376.24709
6555.0000 -224.01212 -220.18144 3.83069 1.84819 -220.36228 354.52597
6560.0000 -223.49111 -219.23105 4.26007 1.85545 -220.21980 359.09473
6565.0000 -223.92840 -219.56338 4.36503 1.89396 -219.46360 392.10309
6570.0000 -224.48758 -219.84084 4.64674 1.89013 -219.53887 387.88685
6575.0000 -224.20819 -220.25371 3.95449 1.86704 -219.99218 372.49696
6580.0000 -224.35143 -219.33422 5.01721 1.88407 -219.65790 382.98670
6585.0000 -224.21146 -219.93138 4.28008 1.86976 -219.93870 364.78575
6590.0000 -223.87006 -219.12127 4.74880 1.89963 -219.35225 392.54375
6595.0000 -223.88718 -219.04874 4.83844 1.91235 -219.10257 402.81066
6600.0000 -223.93822 -219.01818 4.92004 1.92054 -218.94167 413.11526
6605.0000 -223.38487 -218.56225 4.82262 1.93070 -218.74238 421.86133
6610.0000 -223.71588 -218.70851 5.00736 1.90886 -219.17119 404.42235
6615.0000 -222.82380 -217.67662 5.14718 1.96584 -218.05232 448.63242
6620.0000 -223.97644 -218.95917 5.01727 1.95418 -218.28134 439.55901
6625.0000 -223.76803 -219.23615 4.53187 1.92119 -218.92898 410.93368
6630.0000 -223.82195 -219.39866 4.42328 1.89319 -219.47870 391.80090
6635.0000 -222.96272 -218.89872 4.06400 1.91167 -219.11594 408.37948
6640.0000 -223.15788 -218.60183 4.55605 1.92621 -218.83046 414.65997
6645.0000 -223.65083 -219.08547 4.56537 1.94170 -218.52640 431.37076
6650.0000 -224.59883 -219.00693 5.59190 1.91959 -218.96035 411.98629
6655.0000 -223.87755 -219.02752 4.85004 1.91866 -218.97876 413.09409
6660.0000 -224.42231 -219.83061 4.59170 1.89859 -219.37265 400.47232
6665.0000 -223.96933 -219.30312 4.66621 1.87901 -219.75723 379.30151
6670.0000 -222.88718 -218.04534 4.84184 1.93704 -218.61789 428.82808
6675.0000 -223.46807 -218.67597 4.79210 1.96265 -218.11502 440.69853
6680.0000 -222.76269 -217.95365 4.80904 1.95841 -218.19818 434.62078
6685.0000 -224.10353 -218.88685 5.21668 1.94844 -218.39399 432.48255
6690.0000 -224.28886 -219.63638 4.65247 1.92346 -218.88443 413.31148
6695.0000 -224.06930 -219.79701 4.27229 1.88197 -219.69904 377.65993
6700.0000 -223.75194 -219.77710 3.97484 1.88209 -219.69674 381.49416
6705.0000 -223.95628 -219.21489 4.74139 1.89510 -219.44120 386.68650
6710.0000 -223.64151 -218.95053 4.69098 1.90949 -219.15879 392.86477
6715.0000 -224.22384 -219.50423 4.71960 1.92606 -218.83338 405.35778
6720.0000 -223.67602 -219.37830 4.29771 1.88535 -219.63264 373.79842
6725.0000 -223.61161 -218.90214 4.70946 1.90391 -219.26829 385.93481
6730.0000 -222.94903 -218.38432 4.56470 1.92371 -218.87961 404.51043
6735.0000 -223.76283 -219.06890 4.69394 1.93638 -218.63067 410.73748
6740.0000 -223.64874 -219.94045 3.70829 1.91142 -219.12084 396.40204
6745.0000 -223.50018 -218.70646 4.79372 1.87317 -219.87191 361.67199
6750.0000 -223.41283 -219.31831 4.09451 1.90883 -219.17164 389.08777
FREEZING PROCESS: loop number 28 T-loop= 388.00000000000000
main_MD> interactions number 28 at Temperature= 388.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -3.21249 0.51829 0.79927
force_rgl> df(natom) -0.84911 2.49445 3.37268
6755.0000 -224.08466 -219.68652 4.39815 1.90316 -219.28301 387.69904
6760.0000 -223.18589 -218.02816 5.15773 1.92604 -218.83372 402.15243
6765.0000 -223.01495 -218.38534 4.62961 1.94889 -218.38509 433.03201
6770.0000 -223.41057 -219.37389 4.03668 1.93912 -218.57692 426.93692
6775.0000 -223.04842 -218.73749 4.31094 1.90075 -219.33034 393.30607
6780.0000 -223.48372 -218.96340 4.52032 1.90187 -219.30837 393.63015
6785.0000 -223.02112 -217.88372 5.13740 1.94492 -218.46302 427.47308
6790.0000 -223.42346 -219.36809 4.05537 1.94449 -218.47156 433.99516
6795.0000 -223.87826 -219.89877 3.97948 1.88812 -219.57834 382.74001
6800.0000 -223.75423 -219.07985 4.67437 1.88014 -219.73498 371.73772
6805.0000 -223.14932 -218.92506 4.22426 1.90292 -219.28765 385.83407
6810.0000 -223.22966 -218.82724 4.40243 1.92719 -218.81118 408.79717
6815.0000 -223.80128 -219.10513 4.69615 1.92792 -218.79692 413.80337
6820.0000 -222.92390 -218.18390 4.74000 1.91005 -219.14778 407.37593
6825.0000 -223.87822 -219.24324 4.63498 1.92896 -218.77648 423.34647
6830.0000 -224.19036 -219.32706 4.86331 1.90346 -219.27719 401.38336
6835.0000 -223.86193 -218.85994 5.00199 1.89903 -219.36404 402.33209
6840.0000 -222.98131 -218.20940 4.77191 1.94983 -218.36676 432.76678
6845.0000 -223.57025 -219.12625 4.44400 1.92390 -218.87574 419.87931
6850.0000 -224.36518 -219.48910 4.87609 1.89100 -219.52184 395.32159
6855.0000 -224.84101 -220.86487 3.97614 1.83695 -220.58308 353.27235
6860.0000 -224.61393 -220.35146 4.26247 1.83798 -220.56284 355.95739
6865.0000 -224.29016 -219.90641 4.38375 1.85632 -220.20262 366.30835
6870.0000 -223.62972 -220.10138 3.52834 1.87880 -219.76122 383.85132
6875.0000 -224.17656 -219.27682 4.89974 1.88304 -219.67813 392.03115
6880.0000 -224.35404 -220.07722 4.27682 1.87102 -219.91399 380.14819
6885.0000 -224.52098 -220.05782 4.46316 1.85970 -220.13626 371.77686
6890.0000 -224.46549 -219.47366 4.99183 1.90352 -219.27595 402.80958
6895.0000 -224.21424 -219.36180 4.85244 1.89366 -219.46961 396.46807
6900.0000 -224.18956 -219.21194 4.97763 1.89629 -219.41781 398.95446
6905.0000 -224.04594 -219.27336 4.77258 1.89578 -219.42798 399.09746
6910.0000 -223.85409 -219.65015 4.20395 1.90721 -219.20351 398.41861
6915.0000 -223.96335 -219.69158 4.27178 1.88398 -219.65965 390.35428
6920.0000 -222.94682 -219.38885 3.55797 1.85659 -220.19743 365.37245
6925.0000 -224.21823 -220.27955 3.93868 1.84859 -220.35447 358.42340
6930.0000 -224.46154 -219.67842 4.78311 1.87036 -219.92707 375.67150
6935.0000 -224.29522 -219.95230 4.34292 1.87456 -219.84458 380.92206
6940.0000 -223.83405 -219.75323 4.08082 1.85656 -220.19797 368.68228
6945.0000 -224.11467 -220.15671 3.95795 1.86995 -219.93504 379.40629
6950.0000 -223.55663 -218.84795 4.70868 1.90602 -219.22687 405.68892
6955.0000 -224.39758 -219.57511 4.82247 1.90996 -219.14949 406.34710
6960.0000 -223.98652 -219.79075 4.19577 1.87835 -219.77015 387.71475
6965.0000 -224.15991 -219.66445 4.49546 1.86190 -220.09320 374.17504
6970.0000 -223.37958 -219.27287 4.10671 1.91784 -218.99470 408.81081
6975.0000 -223.83401 -219.47090 4.36310 1.89901 -219.36456 402.73378
6980.0000 -224.62554 -220.61014 4.01539 1.88123 -219.71357 388.48312
6985.0000 -224.23461 -220.25954 3.97507 1.85655 -220.19817 369.62678
6990.0000 -224.18948 -219.73744 4.45204 1.86249 -220.08146 369.91013
6995.0000 -224.09015 -219.91798 4.17218 1.88223 -219.69390 389.66675
7000.0000 -224.44357 -220.75346 3.69011 1.85023 -220.32219 360.98697
FREEZING PROCESS: loop number 29 T-loop= 363.00000000000000
main_MD> interactions number 29 at Temperature= 363.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.15360 -0.34326 -0.59251
force_rgl> df(natom) -3.69606 -1.38984 -0.30250
7005.0000 -224.16587 -220.62594 3.53993 1.84498 -220.42535 359.14922
7010.0000 -223.63669 -219.63686 3.99982 1.85471 -220.23425 365.57695
7015.0000 -224.03149 -219.78373 4.24776 1.86768 -219.97971 375.92783
7020.0000 -224.79079 -220.10585 4.68494 1.88314 -219.67602 387.57131
7025.0000 -224.74802 -220.12306 4.62496 1.85716 -220.18618 370.86355
7030.0000 -224.39695 -220.69176 3.70519 1.84304 -220.46343 358.49157
7035.0000 -224.14049 -220.41072 3.72978 1.83935 -220.53596 353.63370
7040.0000 -224.49186 -220.42296 4.06890 1.84604 -220.40459 357.33251
7045.0000 -223.82952 -219.22815 4.60136 1.86656 -220.00167 374.42216
7050.0000 -224.00379 -220.33330 3.67049 1.88500 -219.63964 389.22945
7055.0000 -224.39788 -220.47306 3.92482 1.84929 -220.34070 366.49714
7060.0000 -224.49112 -220.51357 3.97755 1.83170 -220.68601 346.12743
7065.0000 -224.20793 -220.60908 3.59886 1.84489 -220.42706 360.22811
7070.0000 -224.37000 -219.81020 4.55980 1.84630 -220.39937 358.09567
7075.0000 -224.38055 -219.69219 4.68836 1.86332 -220.06522 372.44402
7080.0000 -223.84054 -219.58163 4.25891 1.89404 -219.46210 393.71400
7085.0000 -225.01617 -219.82334 5.19283 1.88762 -219.58817 395.74929
7090.0000 -225.23092 -220.38134 4.84958 1.86718 -219.98942 375.85055
7095.0000 -225.05248 -220.18657 4.86591 1.84396 -220.44529 358.49962
7100.0000 -224.49894 -220.39323 4.10571 1.85582 -220.21248 364.73059
7105.0000 -224.32561 -220.07086 4.25475 1.84294 -220.46547 357.62069
7110.0000 -224.33258 -220.07728 4.25531 1.87587 -219.81876 379.47947
7115.0000 -223.99184 -219.87385 4.11799 1.87672 -219.80214 376.17050
7120.0000 -224.39338 -220.28170 4.11167 1.86740 -219.98503 378.19099
7125.0000 -224.72624 -220.78510 3.94114 1.84293 -220.46565 355.58586
7130.0000 -224.42428 -220.14431 4.27997 1.83243 -220.67178 347.12056
7135.0000 -224.75927 -220.51151 4.24776 1.84204 -220.48309 354.28756
7140.0000 -224.34293 -220.10970 4.23323 1.85249 -220.27787 364.44298
7145.0000 -224.60850 -220.74659 3.86192 1.83892 -220.54428 350.41442
7150.0000 -224.59016 -220.89771 3.69245 1.82764 -220.76580 340.08718
7155.0000 -224.30458 -220.62677 3.67781 1.83678 -220.58642 350.67684
7160.0000 -224.30571 -220.68819 3.61752 1.83919 -220.53900 350.37104
7165.0000 -223.30443 -218.94196 4.36247 1.87347 -219.86594 380.93274
7170.0000 -224.31867 -220.02765 4.29102 1.86467 -220.03869 374.84840
7175.0000 -225.14695 -220.76539 4.38156 1.84254 -220.47328 356.60559
7180.0000 -224.09429 -220.08243 4.01187 1.85220 -220.28351 363.09722
7185.0000 -224.10935 -220.60734 3.50201 1.84400 -220.44464 357.52648
7190.0000 -224.13240 -219.52825 4.60415 1.85036 -220.31970 360.70589
7195.0000 -223.72504 -220.15832 3.56672 1.87055 -219.92328 379.41968
7200.0000 -224.15572 -220.07825 4.07747 1.86618 -220.00909 373.62372
7205.0000 -224.62795 -220.57604 4.05191 1.85523 -220.22412 363.98000
7210.0000 -224.89628 -220.42603 4.47025 1.83910 -220.54077 352.61556
7215.0000 -225.13091 -220.83189 4.29902 1.86532 -220.02606 371.40528
7220.0000 -224.10679 -220.60880 3.49799 1.83362 -220.64840 349.10216
7225.0000 -224.39802 -220.84162 3.55640 1.83645 -220.59276 348.67195
7230.0000 -225.12627 -221.47319 3.65307 1.80301 -221.24930 321.39721
7235.0000 -225.32328 -221.59933 3.72395 1.79194 -221.46674 314.36273
7240.0000 -224.82222 -221.29180 3.53042 1.79673 -221.37272 317.79325
7245.0000 -224.45288 -220.09616 4.35673 1.82716 -220.77526 345.05474
7250.0000 -224.19812 -219.78338 4.41474 1.87821 -219.77294 386.93244
FREEZING PROCESS: loop number 30 T-loop= 338.00000000000000
main_MD> interactions number 30 at Temperature= 338.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.22985 -1.36046 3.74621
force_rgl> df(natom) -0.11640 -1.07183 -0.33322
7255.0000 -224.63006 -220.75171 3.87836 1.85260 -220.27569 365.96832
7260.0000 -225.28928 -221.48695 3.80233 1.81864 -220.94256 338.83338
7265.0000 -225.14677 -220.85244 4.29433 1.79997 -221.30907 319.55620
7270.0000 -224.65499 -221.41365 3.24134 1.80894 -221.13285 326.81808
7275.0000 -224.90020 -221.01260 3.88760 1.80853 -221.14102 327.72592
7280.0000 -224.60216 -220.96147 3.64069 1.80864 -221.13882 329.00975
7285.0000 -224.62389 -220.73058 3.89331 1.83614 -220.59894 348.02371
7290.0000 -225.05028 -220.88993 4.16035 1.83635 -220.59483 350.73122
7295.0000 -224.59557 -220.91528 3.68029 1.81753 -220.96419 336.63512
7300.0000 -224.66403 -221.26673 3.39730 1.81928 -220.92987 334.16769
7305.0000 -225.00721 -221.87439 3.13282 1.79754 -221.35682 319.00168
7310.0000 -224.90651 -221.61400 3.29251 1.75593 -222.17385 285.14344
7315.0000 -225.20617 -222.01164 3.19454 1.77049 -221.88793 298.49186
7320.0000 -224.34294 -220.55861 3.78433 1.80492 -221.21179 325.04068
7325.0000 -224.69111 -220.47554 4.21557 1.83896 -220.54358 354.25183
7330.0000 -224.62397 -220.52758 4.09639 1.83865 -220.54958 349.89900
7335.0000 -224.06848 -220.21348 3.85500 1.83564 -220.60866 349.78785
7340.0000 -224.75767 -220.92687 3.83080 1.83699 -220.58212 355.09184
7345.0000 -224.76337 -220.83493 3.92844 1.81874 -220.94053 338.62635
7350.0000 -225.06281 -221.41287 3.64994 1.80467 -221.21676 324.47637
7355.0000 -225.03186 -221.12107 3.91078 1.81130 -221.08666 332.38512
7360.0000 -224.71854 -220.94708 3.77146 1.82586 -220.80080 342.85958
7365.0000 -225.01818 -221.53264 3.48554 1.80683 -221.17430 325.84336
7370.0000 -225.09319 -221.16087 3.93232 1.80541 -221.20235 326.45341
7375.0000 -224.67981 -221.34691 3.33290 1.80677 -221.17559 325.90867
7380.0000 -224.95767 -221.40296 3.55470 1.79178 -221.46994 316.79446
7385.0000 -224.93930 -221.66834 3.27096 1.78942 -221.51621 313.19165
7390.0000 -225.13849 -221.94023 3.19826 1.78648 -221.57384 309.81893
7395.0000 -224.84396 -221.91204 2.93191 1.77738 -221.75263 303.53733
7400.0000 -224.81085 -221.01480 3.79605 1.79313 -221.44335 317.55816
7405.0000 -224.81254 -221.16882 3.64372 1.80219 -221.26540 323.38176
7410.0000 -225.00957 -220.67842 4.33115 1.82565 -220.80480 341.93142
7415.0000 -224.76042 -221.05440 3.70602 1.82701 -220.77814 343.59409
7420.0000 -224.85922 -221.14619 3.71304 1.82637 -220.79066 341.99629
7425.0000 -224.07863 -220.27665 3.80198 1.82564 -220.80499 342.57725
7430.0000 -224.50818 -220.60759 3.90059 1.83777 -220.56689 353.41338
7435.0000 -224.85869 -220.43505 4.42365 1.84284 -220.46728 358.81095
7440.0000 -224.62803 -221.12391 3.50411 1.81683 -220.97804 336.30284
7445.0000 -224.95435 -220.85319 4.10115 1.81757 -220.96359 336.75149
7450.0000 -224.31595 -220.96355 3.35241 1.82423 -220.83269 341.01860
7455.0000 -225.02885 -220.77413 4.25472 1.83693 -220.58341 350.34492
7460.0000 -224.14062 -220.14197 3.99865 1.84442 -220.43637 357.07597
7465.0000 -224.23465 -220.16988 4.06477 1.88047 -219.72858 381.19191
7470.0000 -225.03096 -221.69684 3.33412 1.82329 -220.85126 339.91133
7475.0000 -224.87289 -221.12284 3.75005 1.79733 -221.36084 321.33460
7480.0000 -224.78249 -220.79705 3.98544 1.81033 -221.10561 329.32675
7485.0000 -224.54217 -220.01477 4.52740 1.82422 -220.83298 340.72956
7490.0000 -224.89655 -221.07050 3.82605 1.83095 -220.70073 346.59349
7495.0000 -224.67711 -220.87770 3.79941 1.82561 -220.80562 343.43407
7500.0000 -225.12375 -221.55428 3.56947 1.82261 -220.86458 339.17712
FREEZING PROCESS: loop number 31 T-loop= 313.00000000000000
main_MD> interactions number 31 at Temperature= 313.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -2.12967 -1.32981 -0.00130
force_rgl> df(natom) -2.80316 0.06306 1.69938
7505.0000 -224.67122 -220.72933 3.94189 1.81543 -221.00561 332.43875
7510.0000 -225.07456 -221.47393 3.60063 1.81108 -221.09098 328.30927
7515.0000 -224.38407 -221.49724 2.88683 1.78573 -221.58864 309.39903
7520.0000 -225.11453 -221.26148 3.85304 1.81099 -221.09264 331.60245
7525.0000 -224.53848 -220.51559 4.02289 1.82386 -220.84009 337.70883
7530.0000 -224.59784 -221.19457 3.40327 1.81186 -221.07567 330.32950
7535.0000 -224.75440 -220.90170 3.85269 1.81134 -221.08588 330.29801
7540.0000 -224.89444 -221.48581 3.40863 1.81147 -221.08333 333.99653
7545.0000 -225.00585 -221.70596 3.29989 1.77969 -221.70715 305.30252
7550.0000 -225.12691 -221.45023 3.67667 1.79373 -221.43151 316.40064
7555.0000 -225.35779 -221.95674 3.40105 1.77491 -221.80111 299.34278
7560.0000 -224.87759 -221.78739 3.09020 1.78568 -221.58966 308.92614
7565.0000 -224.50047 -220.97378 3.52669 1.79565 -221.39384 317.08680
7570.0000 -225.34795 -221.93779 3.41016 1.78857 -221.53296 310.93860
7575.0000 -225.41508 -222.36532 3.04976 1.76936 -221.91015 294.75059
7580.0000 -224.64780 -221.54005 3.10775 1.77368 -221.82521 300.70093
7585.0000 -224.62556 -221.21867 3.40689 1.79185 -221.46847 314.18630
7590.0000 -224.99405 -220.88251 4.11153 1.82347 -220.84757 339.03580
7595.0000 -225.08905 -221.26677 3.82227 1.80401 -221.22982 322.12303
7600.0000 -225.21332 -220.84249 4.37083 1.80717 -221.16769 327.99795
7605.0000 -224.77214 -221.33238 3.43976 1.81165 -221.07966 335.14893
7610.0000 -224.53471 -220.63294 3.90177 1.81530 -221.00808 334.28186
7615.0000 -224.91896 -221.41974 3.49923 1.79474 -221.41166 317.91032
7620.0000 -225.24631 -221.64694 3.59937 1.76624 -221.97127 294.45975
7625.0000 -224.76167 -221.23554 3.52612 1.78770 -221.54993 311.42422
7630.0000 -225.25777 -221.56803 3.68974 1.81022 -221.10778 330.83982
7635.0000 -224.90571 -221.80668 3.09903 1.77559 -221.78765 300.07223
7640.0000 -225.09913 -221.65030 3.44883 1.79156 -221.47419 312.57713
7645.0000 -225.28292 -221.66743 3.61548 1.77816 -221.73725 301.21282
7650.0000 -225.27049 -221.75201 3.51848 1.79377 -221.43075 315.11641
7655.0000 -224.86413 -221.89132 2.97281 1.77142 -221.86965 296.41780
7660.0000 -225.09988 -221.71850 3.38139 1.76139 -222.06653 286.60820
7665.0000 -224.96829 -221.34045 3.62784 1.79149 -221.47551 315.63514
7670.0000 -224.80532 -221.11262 3.69270 1.80107 -221.28749 321.14231
7675.0000 -225.34976 -221.60105 3.74872 1.81293 -221.05467 331.74743
7680.0000 -225.01870 -221.47598 3.54272 1.79565 -221.39391 320.09583
7685.0000 -225.02885 -221.49491 3.53394 1.78270 -221.64817 306.60365
7690.0000 -225.36986 -222.48594 2.88392 1.76295 -222.03592 293.83364
7695.0000 -225.50158 -222.57286 2.92872 1.73126 -222.65809 265.44455
7700.0000 -225.51254 -222.21438 3.29816 1.73481 -222.58834 267.58129
7705.0000 -225.36893 -222.21068 3.15824 1.75586 -222.17505 283.90077
7710.0000 -224.88903 -221.51537 3.37366 1.77496 -221.80013 301.49346
7715.0000 -225.11324 -221.75992 3.35331 1.77817 -221.73715 304.46988
7720.0000 -224.99776 -221.46215 3.53560 1.78817 -221.54066 314.17828
7725.0000 -225.01953 -221.52024 3.49929 1.79202 -221.46508 313.82224
7730.0000 -225.42064 -221.96868 3.45196 1.78754 -221.55304 309.84893
7735.0000 -225.22791 -221.83811 3.38981 1.77308 -221.83709 301.09263
7740.0000 -224.82477 -221.28245 3.54232 1.79553 -221.39621 316.54780
7745.0000 -225.34104 -222.07990 3.26114 1.77834 -221.73375 304.40563
7750.0000 -224.68809 -220.64007 4.04802 1.80389 -221.23218 324.66714
main_MD> EXECUTION TIME: 0 [day], 0 [hour], 16 [min], 47.2960487 [s].
main_MD> Deallocating global variables
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