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nanoparticlesims/growth_Melting_Silver_ICO_2451/freezeSims/run_61/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_61.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 = 61 ntipo2 = 0
read_input> Finish reading input
main_MD> Allocating global variables
main_MD> Number of outputs that will be created: 1750
main_MD> Size of nv and nvoiz: 61 6100
main_MD> Size of nv and nvoiz: 61 6100
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 = 61
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> 2.1445361697965359E-002 -0.10135304004196795 -0.11586184068300134 initial drift of cluster / NP1 for coalescence
init> 0.35720087495514824 0.33693121699104434 0.33717597493663276 scaling for velocity /for coalescence NP1
init.f90 > facguy = 3.6912320798597304E-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) 0.22472 -0.66461 2.53844
force_rgl> df(natom) 0.80243 -0.15365 -4.63040
preparo> THERMALIZATION PROCESS AT 1184.9518591387398
preparo> TOTAL ENERGY, KINETIC EN., POT. ENERGY, DELTA
5000 -132.89938626727192 10.342832442839569 -143.24221871011150 6.5115709064045909E-004
preparo> END THERMALISATION ON NPAST DEFINE IN PARACLUSTER MODULE
main_MD> Time-loop is starting for freezing
main_MD> Now the computation of EXECUTION TIME starts
main_MD> Running from loop 1 to 35
FREEZING PROCESS: loop number 1 T-loop= 1157.0000000000000
main_MD> interactions number 1 at Temperature= 1157.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.36993 0.88854 -0.11728
force_rgl> df(natom) 0.45967 -5.12720 -5.02119
5.0000 -143.08856 -133.68138 9.40718 2.97421 -133.86155 1157.95562
10.0000 -143.28511 -133.42539 9.85972 2.96663 -133.97905 1149.51997
15.0000 -142.05141 -132.60642 9.44500 3.03757 -132.87982 1180.63393
20.0000 -143.03909 -134.82398 8.21511 2.97280 -133.88346 1152.04204
25.0000 -143.26176 -134.42236 8.83939 2.97895 -133.78810 1183.13690
30.0000 -144.07715 -136.05734 8.01980 2.94200 -134.36073 1115.36813
35.0000 -143.26139 -134.28620 8.97519 2.87415 -135.41215 1084.95067
40.0000 -142.16503 -132.87285 9.29218 2.94238 -134.35482 1151.43360
45.0000 -142.72124 -134.17081 8.55043 3.01365 -133.25041 1195.01159
50.0000 -142.71911 -134.63408 8.08503 2.88962 -135.17248 1077.06604
55.0000 -141.92126 -133.40893 8.51233 2.91960 -134.70782 1077.32931
60.0000 -142.51703 -133.23234 9.28469 2.95808 -134.11161 1113.68314
65.0000 -144.43057 -135.46267 8.96790 2.90869 -134.87690 1093.92330
70.0000 -143.29014 -134.07420 9.21594 2.87309 -135.42855 1056.05979
75.0000 -141.36118 -131.99916 9.36202 3.02452 -133.08205 1206.16228
80.0000 -141.80895 -132.29741 9.51154 3.06840 -132.40208 1250.20095
85.0000 -142.63289 -132.63272 10.00016 3.02910 -133.01106 1188.48653
90.0000 -141.48865 -131.68852 9.80014 3.12980 -131.45053 1286.68302
95.0000 -145.12915 -134.80393 10.32522 3.02955 -133.00407 1205.85042
100.0000 -142.29556 -133.95209 8.34347 2.97547 -133.84215 1154.71585
105.0000 -141.26642 -131.53519 9.73123 3.11212 -131.72453 1232.98394
110.0000 -142.87561 -132.81193 10.06368 3.07359 -132.32165 1202.57915
115.0000 -142.37907 -134.54601 7.83307 2.96227 -134.04664 1130.54365
120.0000 -141.76079 -132.33258 9.42821 3.04442 -132.77357 1117.91958
125.0000 -142.40714 -132.93916 9.46798 3.11622 -131.66108 1251.97888
130.0000 -143.80802 -134.42137 9.38666 2.84225 -135.90648 1086.66088
135.0000 -143.37822 -134.69986 8.67836 2.98293 -133.72649 1129.34757
140.0000 -143.89138 -135.25709 8.63430 2.92852 -134.56969 1105.26887
145.0000 -142.91911 -133.85156 9.06755 2.89985 -135.01391 1054.08833
150.0000 -140.81900 -128.91788 11.90112 3.15516 -131.05768 1294.42293
155.0000 -142.47336 -132.32217 10.15120 3.25231 -129.55220 1341.70421
160.0000 -144.60520 -135.85063 8.75458 3.00574 -133.37298 1183.12743
165.0000 -142.06672 -132.91438 9.15234 2.89598 -135.07389 1116.22181
170.0000 -141.72688 -133.03857 8.68831 3.08928 -132.07850 1212.25821
175.0000 -141.28430 -131.88317 9.40113 3.05887 -132.54972 1197.72243
180.0000 -141.94913 -132.14066 9.80847 3.06602 -132.43892 1216.90181
185.0000 -143.36185 -135.08821 8.27364 2.96456 -134.01114 1146.62473
190.0000 -144.22540 -134.05963 10.16577 2.95191 -134.20713 1119.30779
195.0000 -143.48995 -133.74314 9.74681 2.98632 -133.67394 1181.11847
200.0000 -143.92985 -133.61809 10.31176 2.97849 -133.79523 1168.01744
205.0000 -144.10586 -134.98776 9.11810 3.00216 -133.42847 1184.99089
210.0000 -143.31216 -134.62494 8.68723 2.94197 -134.36121 1117.07788
215.0000 -141.02527 -131.14615 9.87913 3.07956 -132.22907 1239.60670
220.0000 -141.43625 -131.45049 9.98575 3.18894 -130.53410 1297.03735
225.0000 -142.43420 -132.38885 10.04535 3.06287 -132.48777 1183.64502
230.0000 -142.20600 -131.68158 10.52442 3.04501 -132.76445 1213.19949
235.0000 -141.97914 -132.63755 9.34159 2.96853 -133.94962 1181.87442
240.0000 -141.95316 -132.84861 9.10455 2.96986 -133.92897 1141.04533
245.0000 -142.22221 -133.36273 8.85948 3.04673 -132.73782 1172.09664
250.0000 -142.25501 -133.09928 9.15574 2.93737 -134.43253 1118.82576
FREEZING PROCESS: loop number 2 T-loop= 1132.0000000000000
main_MD> interactions number 2 at Temperature= 1132.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.62589 -0.58604 1.40764
force_rgl> df(natom) -1.76921 -1.60285 -0.17722
255.0000 -142.59156 -132.21740 10.37416 3.10857 -131.77949 1257.57141
260.0000 -142.09653 -132.68011 9.41642 3.03702 -132.88825 1203.68766
265.0000 -143.24346 -133.47835 9.76511 3.00905 -133.32181 1209.83476
270.0000 -142.07585 -132.99706 9.07879 3.04277 -132.79920 1199.75443
275.0000 -142.29808 -133.51539 8.78270 3.07149 -132.35414 1220.24303
280.0000 -141.21046 -133.69870 7.51176 3.04413 -132.77819 1233.68651
285.0000 -142.82901 -133.85621 8.97280 2.98713 -133.66147 1172.77087
290.0000 -143.62591 -134.76993 8.85598 2.98914 -133.63028 1152.45923
295.0000 -143.55198 -135.39010 8.16188 2.87612 -135.38159 1092.02007
300.0000 -145.14805 -136.53312 8.61494 2.85973 -135.63566 1065.15946
305.0000 -142.61427 -134.60213 8.01214 2.87285 -135.43225 1084.55869
310.0000 -144.66170 -136.19773 8.46397 2.89750 -135.05024 1078.39006
315.0000 -142.78825 -135.60178 7.18647 2.81654 -136.30480 1043.77655
320.0000 -143.98039 -135.82084 8.15955 2.80967 -136.41135 1033.35908
325.0000 -144.01457 -134.87762 9.13695 2.96479 -134.00752 1168.25316
330.0000 -142.31405 -135.27106 7.04299 2.85242 -135.74883 1088.88647
335.0000 -142.11695 -133.66039 8.45656 2.89314 -135.11784 1093.27982
340.0000 -142.61669 -133.50930 9.10739 3.01829 -133.17856 1170.38808
345.0000 -142.71302 -134.59719 8.11583 2.99740 -133.50220 1160.33754
350.0000 -142.06105 -133.86123 8.19982 3.01548 -133.22214 1187.02185
355.0000 -141.31621 -131.13370 10.18251 3.07278 -132.33419 1211.84130
360.0000 -144.86806 -135.50390 9.36415 3.04607 -132.74800 1192.70839
365.0000 -145.07864 -137.49594 7.58271 2.85478 -135.71234 1070.97373
370.0000 -144.37980 -135.16344 9.21636 2.78896 -136.73225 1025.93220
375.0000 -142.11910 -131.95041 10.16869 3.01885 -133.16986 1199.14819
380.0000 -142.25999 -132.95350 9.30649 3.04796 -132.71884 1227.56316
385.0000 -142.32494 -132.10427 10.22067 3.07223 -132.34266 1263.83274
390.0000 -144.89824 -132.51366 12.38458 3.02521 -133.07137 1190.61325
395.0000 -139.34162 -130.26358 9.07805 3.12993 -131.44857 1240.32282
400.0000 -142.93534 -132.53643 10.39891 3.13183 -131.41914 1244.18521
405.0000 -144.05252 -134.60990 9.44262 3.02566 -133.06433 1220.36213
410.0000 -142.88377 -133.62268 9.26109 2.95136 -134.21563 1143.80475
415.0000 -142.75652 -132.94681 9.80970 3.12562 -131.51543 1252.35548
420.0000 -141.58034 -132.91055 8.66979 3.05079 -132.67488 1167.73780
425.0000 -142.44887 -132.40400 10.04487 3.06263 -132.49145 1199.05309
430.0000 -144.29076 -135.01629 9.27447 3.03500 -132.91957 1232.64114
435.0000 -144.71751 -135.85877 8.85873 2.87399 -135.41457 1073.77661
440.0000 -143.12319 -133.82162 9.30157 2.84774 -135.82145 1063.28626
445.0000 -141.90605 -133.36343 8.54262 2.97717 -133.81569 1157.38118
450.0000 -143.74952 -134.85962 8.88990 2.91138 -134.83522 1136.99201
455.0000 -142.50118 -133.99663 8.50454 2.94573 -134.30301 1142.88529
460.0000 -142.57930 -134.38989 8.18941 2.98492 -133.69559 1155.31396
465.0000 -143.09289 -134.04488 9.04801 2.99762 -133.49887 1164.26760
470.0000 -144.60147 -135.88325 8.71823 2.92099 -134.68627 1112.66378
475.0000 -144.15422 -135.21292 8.94130 2.97374 -133.86894 1156.16313
480.0000 -144.63743 -136.40387 8.23356 2.79927 -136.57252 1060.02787
485.0000 -142.06842 -135.45387 6.61454 2.86747 -135.51563 1090.78216
490.0000 -141.83948 -132.79640 9.04308 2.94915 -134.24992 1131.25256
495.0000 -141.66338 -133.84187 7.82151 2.97412 -133.86293 1150.18571
500.0000 -143.49794 -133.32470 10.17324 2.93222 -134.51226 1107.43492
FREEZING PROCESS: loop number 3 T-loop= 1107.0000000000000
main_MD> interactions number 3 at Temperature= 1107.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.86371 -0.64147 -1.54666
force_rgl> df(natom) 1.17141 1.63368 4.84541
505.0000 -142.84569 -134.17376 8.67193 2.94760 -134.27391 1164.97222
510.0000 -143.20816 -132.83470 10.37346 3.02302 -133.10532 1213.82687
515.0000 -143.61570 -135.55811 8.05759 2.98940 -133.62618 1137.61805
520.0000 -146.02524 -137.41950 8.60574 2.82429 -136.18483 1025.98358
525.0000 -144.18972 -135.78678 8.40294 2.78017 -136.86853 971.44228
530.0000 -142.49345 -133.54899 8.94447 2.95572 -134.14818 1145.65558
535.0000 -144.19739 -134.21542 9.98196 2.94338 -134.33930 1149.94787
540.0000 -143.87338 -135.14690 8.72648 2.89834 -135.03734 1110.69069
545.0000 -144.09110 -134.32421 9.76690 2.88669 -135.21779 1089.00662
550.0000 -143.92585 -134.78709 9.13877 2.95342 -134.18378 1132.54764
555.0000 -143.52187 -134.48055 9.04131 2.90994 -134.85757 1079.11148
560.0000 -144.08567 -135.52700 8.55867 2.89375 -135.10839 1068.18481
565.0000 -144.93072 -135.53106 9.39966 2.83209 -136.06386 1072.55492
570.0000 -145.18338 -136.61291 8.57047 2.84632 -135.84336 1055.77917
575.0000 -143.86447 -135.17877 8.68570 2.80111 -136.54398 1026.42688
580.0000 -142.85952 -133.81470 9.04482 2.98761 -133.65391 1149.38426
585.0000 -142.12772 -134.20850 7.91922 2.92966 -134.55197 1104.73773
590.0000 -143.38293 -135.59078 7.79215 2.94378 -134.33310 1119.22107
595.0000 -143.12511 -134.91248 8.21263 2.84218 -135.90759 1041.23638
600.0000 -142.96219 -133.53977 9.42242 2.91695 -134.74893 1110.99594
605.0000 -142.51176 -135.79462 6.71713 2.90582 -134.92144 1094.74795
610.0000 -144.03608 -133.50674 10.52934 2.87381 -135.41737 1032.02027
615.0000 -142.65598 -133.74749 8.90848 2.98209 -133.73948 1140.54525
620.0000 -143.60749 -134.96811 8.63938 2.89288 -135.12194 1094.23444
625.0000 -144.22393 -135.13501 9.08893 2.87685 -135.37026 1115.86262
630.0000 -144.60622 -135.97812 8.62811 2.88137 -135.30026 1118.03178
635.0000 -144.65929 -136.02684 8.63245 2.80596 -136.46882 1050.65832
640.0000 -146.02417 -138.11572 7.90845 2.76653 -137.07978 1042.26989
645.0000 -145.84743 -136.70297 9.14446 2.73207 -137.61379 1003.41873
650.0000 -144.11109 -135.62852 8.48257 2.73180 -137.61800 982.88909
655.0000 -143.64272 -134.16476 9.47796 2.90934 -134.86691 1132.85735
660.0000 -145.50974 -138.05726 7.45248 2.82044 -136.24448 1038.82857
665.0000 -145.27734 -137.33821 7.93913 2.73920 -137.50332 1033.43760
670.0000 -142.64861 -133.64615 9.00246 2.85463 -135.71461 1114.00778
675.0000 -143.38352 -132.41571 10.96781 3.03820 -132.86997 1163.53635
680.0000 -144.15771 -135.08119 9.07652 2.90677 -134.90671 1121.77038
685.0000 -143.64738 -135.08268 8.56470 2.94098 -134.37647 1130.79397
690.0000 -143.70519 -134.44848 9.25671 2.89234 -135.13032 1099.16924
695.0000 -143.63604 -133.63544 10.00061 2.91601 -134.76346 1089.84693
700.0000 -144.46993 -137.03584 7.43409 2.94425 -134.32584 1142.75761
705.0000 -145.02543 -136.71872 8.30671 2.74170 -137.46466 986.71076
710.0000 -142.97914 -134.06627 8.91287 2.86038 -135.62553 1054.92216
715.0000 -143.01538 -132.63819 10.37718 2.98915 -133.63003 1145.89051
720.0000 -144.65237 -134.12961 10.52276 2.97666 -133.82368 1210.18929
725.0000 -141.24934 -133.54364 7.70570 2.96456 -134.01114 1141.82344
730.0000 -143.99922 -136.08031 7.91890 2.88182 -135.29326 1054.55436
735.0000 -142.37090 -133.62649 8.74441 2.88306 -135.27404 1097.95809
740.0000 -143.14570 -132.39876 10.74694 3.06503 -132.45419 1228.17451
745.0000 -144.81989 -137.23966 7.58022 2.94459 -134.32065 1155.71023
750.0000 -144.22762 -136.09304 8.13458 2.83414 -136.03219 1069.30381
FREEZING PROCESS: loop number 4 T-loop= 1082.0000000000000
main_MD> interactions number 4 at Temperature= 1082.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.74104 -1.19498 0.41983
force_rgl> df(natom) 1.46057 -0.86326 -3.45530
755.0000 -145.53915 -136.90855 8.63060 2.80843 -136.43054 1066.90847
760.0000 -145.24700 -137.68270 7.56430 2.79247 -136.67786 1021.52731
765.0000 -145.37544 -137.56914 7.80630 2.71265 -137.91480 968.19375
770.0000 -145.07523 -137.15992 7.91531 2.79914 -136.57450 1056.17992
775.0000 -144.56038 -136.44838 8.11200 2.81449 -136.33665 1041.33445
780.0000 -144.66091 -135.62570 9.03522 2.85747 -135.67064 1096.44932
785.0000 -143.59779 -135.41451 8.18328 2.79956 -136.56796 1024.17888
790.0000 -144.44119 -136.80787 7.63332 2.84081 -135.92883 1063.29273
795.0000 -144.01325 -134.33414 9.67911 2.82938 -136.10587 1084.23652
800.0000 -141.27663 -131.71457 9.56207 3.02901 -133.01241 1199.66549
805.0000 -140.74685 -131.72105 9.02580 3.12146 -131.57975 1249.94941
810.0000 -144.45152 -135.19559 9.25592 3.03721 -132.88542 1207.19153
815.0000 -142.93490 -134.34165 8.59325 2.88453 -135.25123 1067.16767
820.0000 -146.65712 -137.18969 9.46743 2.87535 -135.39353 1096.15368
825.0000 -143.61047 -134.71444 8.89603 2.77847 -136.89482 1045.46900
830.0000 -143.92999 -136.45648 7.47351 2.81753 -136.28948 1045.57246
835.0000 -145.45315 -137.66244 7.79071 2.76801 -137.05690 997.26146
840.0000 -145.28838 -136.55992 8.72846 2.78296 -136.82525 1035.94484
845.0000 -144.99016 -136.50319 8.48697 2.80039 -136.55519 1045.87655
850.0000 -144.74000 -135.36297 9.37703 2.79043 -136.70941 1069.21500
855.0000 -144.22488 -135.39131 8.83357 2.92086 -134.68830 1115.81459
860.0000 -143.83049 -134.84449 8.98600 2.89683 -135.06064 1100.39743
865.0000 -144.35348 -134.77144 9.58204 2.94356 -134.33657 1138.38863
870.0000 -141.89431 -131.26224 10.63207 2.98703 -133.66288 1139.43222
875.0000 -143.99258 -135.37622 8.61635 3.07245 -132.33930 1257.25153
880.0000 -144.13914 -135.23945 8.89969 2.85938 -135.64107 1096.27613
885.0000 -145.45133 -137.25171 8.19962 2.74182 -137.46279 990.68491
890.0000 -144.93992 -136.13465 8.80527 2.81606 -136.31229 1051.97282
895.0000 -144.48332 -136.04585 8.43748 2.84028 -135.93699 1063.64401
900.0000 -142.56482 -134.30995 8.25487 2.89906 -135.02609 1109.84733
905.0000 -142.71193 -134.65730 8.05463 2.89581 -135.07655 1085.42249
910.0000 -143.25500 -134.81791 8.43709 2.92379 -134.64299 1113.98890
915.0000 -144.54462 -135.99966 8.54496 2.85353 -135.73168 1094.00550
920.0000 -143.91913 -135.84223 8.07690 2.83635 -135.99786 1049.69773
925.0000 -143.57543 -134.70113 8.87430 2.89524 -135.08536 1065.85488
930.0000 -144.75439 -134.61832 10.13606 2.96094 -134.06724 1095.61436
935.0000 -145.48822 -137.62040 7.86781 2.84631 -135.84351 1093.91284
940.0000 -145.02348 -137.30461 7.71887 2.72853 -137.66872 1027.17348
945.0000 -143.70207 -136.09887 7.60321 2.75115 -137.31812 994.66781
950.0000 -144.90185 -135.49054 9.41132 2.92600 -134.60870 1130.25998
955.0000 -144.24684 -135.78901 8.45782 2.82682 -136.14556 1072.84445
960.0000 -143.66537 -134.47347 9.19190 2.94220 -134.35772 1126.42283
965.0000 -143.38773 -134.52815 8.85958 2.98113 -133.75442 1158.04687
970.0000 -142.32840 -133.95683 8.37158 2.96543 -133.99766 1167.57506
975.0000 -144.86330 -136.07236 8.79093 2.88227 -135.28639 1094.68122
980.0000 -145.62479 -136.75167 8.87311 2.80061 -136.55179 1048.38093
985.0000 -144.94754 -136.50423 8.44331 2.77895 -136.88740 1033.08661
990.0000 -145.42910 -136.35181 9.07729 2.80983 -136.40887 1042.89337
995.0000 -145.12380 -138.34288 6.78092 2.83502 -136.01857 1075.59230
1000.0000 -145.79921 -137.84288 7.95633 2.71579 -137.86605 989.12603
FREEZING PROCESS: loop number 5 T-loop= 1057.0000000000000
main_MD> interactions number 5 at Temperature= 1057.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -3.25488 -0.07979 -3.50163
force_rgl> df(natom) -0.82707 1.81893 -0.43626
1005.0000 -146.55099 -138.82694 7.72406 2.67268 -138.53406 937.16490
1010.0000 -146.24081 -138.63015 7.61066 2.66378 -138.67197 935.89946
1015.0000 -145.34497 -137.23892 8.10605 2.76007 -137.17986 1006.93623
1020.0000 -145.08194 -135.88462 9.19732 2.82005 -136.25055 1066.34582
1025.0000 -145.35123 -136.38122 8.97001 2.81704 -136.29712 1023.29955
1030.0000 -146.05407 -138.44741 7.60665 2.66621 -138.63433 920.02868
1035.0000 -144.15843 -136.62015 7.53828 2.75897 -137.19698 995.74958
1040.0000 -143.29802 -135.35376 7.94426 2.85776 -135.66615 1048.68724
1045.0000 -143.95629 -134.48095 9.47534 2.90405 -134.94886 1086.80114
1050.0000 -143.57122 -133.45483 10.11640 2.95953 -134.08905 1161.91673
1055.0000 -145.24872 -136.02304 9.22568 2.97113 -133.90940 1148.30192
1060.0000 -142.91026 -134.45099 8.45928 2.93976 -134.39539 1100.00920
1065.0000 -144.72068 -136.04953 8.67115 2.88700 -135.21304 1078.91766
1070.0000 -145.08495 -136.27776 8.80720 2.82950 -136.10411 1047.74737
1075.0000 -145.38184 -136.41469 8.96715 2.74705 -137.38169 993.40683
1080.0000 -144.46115 -136.45002 8.01113 2.80920 -136.41854 1033.00680
1085.0000 -144.09904 -135.36375 8.73529 2.76906 -137.04068 1028.31412
1090.0000 -145.51722 -137.38493 8.13229 2.81684 -136.30023 1040.47268
1095.0000 -145.76729 -137.33558 8.43171 2.77388 -136.96598 1038.20060
1100.0000 -142.84496 -135.01640 7.82856 2.82128 -136.23135 1073.87980
1105.0000 -143.00714 -135.59205 7.41509 2.86624 -135.53465 1083.40001
1110.0000 -143.54402 -135.20020 8.34382 2.90056 -135.00294 1100.88308
1115.0000 -144.16524 -135.08924 9.07601 2.88338 -135.26917 1047.55405
1120.0000 -145.23353 -138.37593 6.85760 2.80431 -136.49445 1034.37498
1125.0000 -145.55560 -137.48776 8.06783 2.71714 -137.84519 967.95843
1130.0000 -145.19828 -136.58976 8.60852 2.76979 -137.02927 988.54640
1135.0000 -145.52333 -136.94213 8.58120 2.82640 -136.15211 1024.98676
1140.0000 -143.25222 -134.47870 8.77351 2.80200 -136.53019 1014.08094
1145.0000 -142.37334 -132.67303 9.70032 2.95047 -134.22956 1152.87562
1150.0000 -143.91560 -134.19627 9.71933 2.98462 -133.70033 1163.31580
1155.0000 -146.01534 -136.74002 9.27531 2.87187 -135.44753 1123.99869
1160.0000 -144.46040 -135.70139 8.75901 2.79887 -136.57865 1042.28084
1165.0000 -143.89338 -135.70265 8.19073 2.86892 -135.49313 1077.61746
1170.0000 -144.53368 -136.27256 8.26112 2.80973 -136.41039 1022.28285
1175.0000 -145.39703 -136.82701 8.57002 2.78277 -136.82814 1036.15934
1180.0000 -144.54585 -136.72081 7.82504 2.80013 -136.55912 1056.76393
1185.0000 -145.48969 -136.21324 9.27644 2.83956 -135.94819 1059.41275
1190.0000 -145.72102 -137.13257 8.58845 2.83366 -136.03954 1055.52520
1195.0000 -145.47835 -136.75401 8.72434 2.71476 -137.88211 978.47928
1200.0000 -145.48972 -136.79993 8.68979 2.76889 -137.04329 985.21261
1205.0000 -145.37423 -137.60083 7.77341 2.74443 -137.42234 981.32009
1210.0000 -144.35959 -136.54398 7.81561 2.76621 -137.08475 1015.17758
1215.0000 -145.06751 -136.80302 8.26449 2.79406 -136.65321 1053.93097
1220.0000 -146.00949 -139.10304 6.90645 2.68659 -138.31858 918.90506
1225.0000 -144.17146 -136.51467 7.65679 2.72615 -137.70552 985.45416
1230.0000 -145.89598 -138.85708 7.03891 2.73637 -137.54725 1008.79023
1235.0000 -146.10037 -138.71239 7.38798 2.70656 -138.00914 963.56365
1240.0000 -146.21905 -138.10387 8.11518 2.72954 -137.65306 995.97114
1245.0000 -143.50591 -136.33651 7.16941 2.78109 -136.85415 1036.65780
1250.0000 -144.77362 -136.46583 8.30779 2.80937 -136.41593 1027.27695
FREEZING PROCESS: loop number 6 T-loop= 1032.0000000000000
main_MD> interactions number 6 at Temperature= 1032.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -8.61051 3.51020 1.41381
force_rgl> df(natom) -2.52793 -2.85819 -1.73684
1255.0000 -144.15608 -135.46478 8.69130 2.89423 -135.10092 1093.06703
1260.0000 -144.37482 -134.17014 10.20468 2.86487 -135.55591 1104.91574
1265.0000 -143.79393 -134.11750 9.67643 2.98881 -133.63542 1193.95497
1270.0000 -145.05054 -137.71119 7.33935 2.85197 -135.75583 1054.16012
1275.0000 -144.93727 -136.65856 8.27871 2.79613 -136.62114 1017.78931
1280.0000 -145.46237 -138.81794 6.64443 2.75300 -137.28941 1006.29514
1285.0000 -144.73491 -137.13400 7.60091 2.72143 -137.77874 961.79801
1290.0000 -144.23994 -136.68928 7.55066 2.77306 -136.97856 1018.04799
1295.0000 -145.10727 -137.16232 7.94495 2.76111 -137.16381 1010.06871
1300.0000 -146.21990 -139.16314 7.05676 2.68064 -138.41074 925.30058
1305.0000 -146.54589 -138.96968 7.57621 2.69006 -138.26485 957.48369
1310.0000 -144.87166 -138.13727 6.73439 2.66376 -138.67232 954.30369
1315.0000 -143.56455 -134.36519 9.19935 2.84097 -135.92623 1067.71610
1320.0000 -144.37880 -136.87409 7.50472 2.85782 -135.66526 1070.79853
1325.0000 -146.07052 -138.93507 7.13545 2.72621 -137.70470 964.98898
1330.0000 -144.61751 -136.99109 7.62642 2.66039 -138.72453 902.64799
1335.0000 -143.24721 -136.38580 6.86140 2.80804 -136.43657 1040.93089
1340.0000 -143.52656 -133.63505 9.89151 2.94211 -134.35898 1130.22449
1345.0000 -145.11538 -137.04640 8.06898 2.89534 -135.08371 1119.84232
1350.0000 -145.40210 -138.16085 7.24125 2.69371 -138.20817 945.31821
1355.0000 -146.16081 -139.23456 6.92625 2.68622 -138.32429 968.61272
1360.0000 -145.35504 -138.24365 7.11139 2.70781 -137.98968 955.91524
1365.0000 -144.28227 -136.96533 7.31694 2.75332 -137.28453 988.52569
1370.0000 -145.87895 -137.48546 8.39349 2.74080 -137.47861 956.60321
1375.0000 -146.43906 -138.15268 8.28638 2.74373 -137.43310 994.49810
1380.0000 -145.74379 -137.67840 8.06539 2.71410 -137.89228 976.04043
1385.0000 -145.62619 -137.02597 8.60022 2.73478 -137.57178 986.76685
1390.0000 -146.17524 -137.07180 9.10345 2.79041 -136.70978 1048.88673
1395.0000 -144.65514 -136.10305 8.55209 2.80744 -136.44584 1054.95205
1400.0000 -144.17979 -136.31545 7.86434 2.81069 -136.39553 1020.90322
1405.0000 -146.34100 -137.48404 8.85697 2.81212 -136.37330 1045.77763
1410.0000 -143.56299 -135.85429 7.70870 2.85199 -135.75558 1054.89826
1415.0000 -144.11933 -135.09739 9.02193 2.82947 -136.10458 1040.62272
1420.0000 -145.12252 -138.25270 6.86982 2.78266 -136.82982 1008.70062
1425.0000 -144.40820 -134.86491 9.54328 2.73122 -137.62703 978.91849
1430.0000 -145.16721 -136.34298 8.82422 2.85778 -135.66587 1065.57558
1435.0000 -145.15008 -136.90579 8.24430 2.82211 -136.21856 1037.32190
1440.0000 -144.90339 -136.97630 7.92709 2.78999 -136.71625 1017.20536
1445.0000 -145.36357 -135.78361 9.57996 2.78029 -136.86664 1050.59683
1450.0000 -142.35538 -134.42068 7.93470 2.91183 -134.82821 1165.66309
1455.0000 -144.41391 -136.08428 8.32963 2.88590 -135.23014 1090.15130
1460.0000 -144.39195 -136.84524 7.54671 2.83649 -135.99574 1073.36633
1465.0000 -143.45671 -135.21834 8.23837 2.87418 -135.41171 1083.32210
1470.0000 -144.08026 -135.64761 8.43265 2.86789 -135.50913 1068.66076
1475.0000 -143.75125 -133.91207 9.83918 2.96621 -133.98563 1111.70921
1480.0000 -144.41171 -135.05378 9.35794 2.92807 -134.57662 1111.06889
1485.0000 -142.73808 -135.98426 6.75382 2.85908 -135.64564 1066.79538
1490.0000 -144.24855 -135.20488 9.04368 2.81851 -136.27427 1041.64105
1495.0000 -144.77631 -136.11341 8.66290 2.89208 -135.13423 1118.32923
1500.0000 -144.66979 -136.33577 8.33402 2.81210 -136.37368 1082.47981
FREEZING PROCESS: loop number 7 T-loop= 1007.0000000000000
main_MD> interactions number 7 at Temperature= 1007.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.04652 3.04385 -3.28095
force_rgl> df(natom) -2.27730 0.89216 1.54634
1505.0000 -144.41104 -137.60848 6.80256 2.80638 -136.46229 1042.04488
1510.0000 -144.31707 -137.26911 7.04796 2.75624 -137.23930 1025.13336
1515.0000 -146.81704 -138.59008 8.22696 2.72552 -137.71530 962.72744
1520.0000 -144.48635 -136.86063 7.62572 2.71060 -137.94648 986.46859
1525.0000 -145.52735 -137.26732 8.26003 2.81276 -136.36346 1025.17646
1530.0000 -146.12439 -138.82311 7.30128 2.68743 -138.30558 942.57755
1535.0000 -145.69093 -137.87128 7.81964 2.70874 -137.97535 950.91845
1540.0000 -146.19102 -138.60926 7.58176 2.72279 -137.75764 958.20656
1545.0000 -145.01589 -137.43432 7.58157 2.70329 -138.05980 953.60814
1550.0000 -143.70285 -136.51010 7.19275 2.68693 -138.31324 936.66159
1555.0000 -145.60952 -137.96864 7.64088 2.77102 -137.01021 990.14871
1560.0000 -145.07108 -137.57013 7.50095 2.62581 -139.26039 917.23253
1565.0000 -145.53868 -138.13596 7.40272 2.65224 -138.85092 946.84873
1570.0000 -144.17873 -136.48675 7.69198 2.77271 -136.98399 1042.15866
1575.0000 -143.99175 -137.51782 6.47393 2.80835 -136.43183 1030.64570
1580.0000 -145.19500 -137.54187 7.65313 2.77198 -136.99543 986.28844
1585.0000 -145.90094 -139.87020 6.03073 2.70628 -138.01353 943.32411
1590.0000 -146.40496 -136.98961 9.41534 2.63079 -139.18326 909.50322
1595.0000 -143.76383 -135.83752 7.92632 2.84356 -135.88617 1064.11641
1600.0000 -144.22651 -134.85329 9.37322 2.86854 -135.49906 1053.95057
1605.0000 -145.21786 -134.74520 10.47266 2.92884 -134.56469 1119.93487
1610.0000 -143.55521 -136.50349 7.05172 2.84084 -135.92831 1082.17006
1615.0000 -141.66116 -133.45755 8.20361 2.96231 -134.04599 1157.95904
1620.0000 -143.49123 -134.62604 8.86519 2.92260 -134.66133 1092.42945
1625.0000 -145.56382 -137.31190 8.25191 2.78785 -136.74950 1051.07838
1630.0000 -146.65247 -139.06903 7.58343 2.68127 -138.40109 994.84565
1635.0000 -146.54204 -139.08659 7.45545 2.66540 -138.64696 957.03447
1640.0000 -146.17898 -138.50340 7.67558 2.70741 -137.99588 1006.52977
1645.0000 -144.61164 -138.63474 5.97690 2.69591 -138.17416 959.91461
1650.0000 -145.88540 -137.75795 8.12745 2.73806 -137.52098 1005.18362
1655.0000 -145.42715 -139.07165 6.35549 2.65488 -138.80992 935.15713
1660.0000 -144.02329 -137.75995 6.26334 2.67388 -138.51558 973.86123
1665.0000 -143.63391 -136.28980 7.34411 2.69953 -138.11806 926.08429
1670.0000 -143.68152 -135.15595 8.52557 2.89819 -135.03967 1123.11835
1675.0000 -145.02794 -137.43158 7.59636 2.77548 -136.94119 1016.86957
1680.0000 -145.64890 -135.46183 10.18707 2.77774 -136.90615 1012.30562
1685.0000 -143.14263 -135.36513 7.77750 2.90421 -134.94632 1103.56762
1690.0000 -146.80725 -139.06017 7.74709 2.77652 -136.92497 1037.83135
1695.0000 -145.33863 -138.31994 7.01868 2.71148 -137.93293 938.72073
1700.0000 -145.57225 -137.87109 7.70115 2.71796 -137.83253 942.58678
1705.0000 -144.02581 -136.55226 7.47354 2.72332 -137.74943 970.71404
1710.0000 -144.92291 -136.83724 8.08567 2.80659 -136.45902 1034.51936
1715.0000 -146.98068 -137.73442 9.24626 2.75944 -137.18965 1003.06536
1720.0000 -146.33617 -138.36465 7.97152 2.66885 -138.59350 938.20868
1725.0000 -146.08164 -138.76016 7.32148 2.74024 -137.48723 987.55106
1730.0000 -144.96400 -135.29685 9.66715 2.77429 -136.95957 1043.04780
1735.0000 -144.36058 -136.61889 7.74170 2.84327 -135.89063 1049.47935
1740.0000 -145.59167 -137.18291 8.40877 2.80844 -136.43046 1033.24867
1745.0000 -145.29512 -138.38070 6.91442 2.69829 -138.13723 974.79915
1750.0000 -143.91064 -135.86094 8.04970 2.72982 -137.64860 985.40692
FREEZING PROCESS: loop number 8 T-loop= 982.00000000000000
main_MD> interactions number 8 at Temperature= 982.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -3.14789 -2.55130 -0.02472
force_rgl> df(natom) 1.39246 1.81967 -0.41525
1755.0000 -144.51273 -137.23892 7.27381 2.82615 -136.15592 1056.14552
1760.0000 -144.08983 -136.44456 7.64527 2.80849 -136.42957 1041.25190
1765.0000 -146.53081 -139.85706 6.67375 2.69641 -138.16636 970.45659
1770.0000 -146.46217 -138.24948 8.21269 2.68234 -138.38446 957.76842
1775.0000 -145.56234 -137.51816 8.04418 2.71121 -137.93710 988.22084
1780.0000 -144.83581 -138.02391 6.81190 2.72579 -137.71106 983.48786
1785.0000 -143.34552 -135.36980 7.97571 2.80643 -136.46158 1000.86635
1790.0000 -146.38359 -138.47406 7.90953 2.76513 -137.10159 1010.57580
1795.0000 -146.64359 -138.01119 8.63240 2.68280 -138.37726 965.31515
1800.0000 -146.63349 -139.08060 7.55289 2.69692 -138.15855 962.68219
1805.0000 -144.50521 -137.30305 7.20216 2.68424 -138.35493 959.70614
1810.0000 -145.55293 -137.80599 7.74695 2.70679 -138.00548 948.50816
1815.0000 -143.99229 -137.21350 6.77879 2.76935 -137.03607 996.84833
1820.0000 -144.07405 -135.87991 8.19414 2.78610 -136.77656 1028.14468
1825.0000 -143.08399 -135.12942 7.95457 2.84937 -135.79620 1054.40301
1830.0000 -144.08635 -136.54919 7.53716 2.89596 -135.07414 1046.80412
1835.0000 -144.10013 -136.88329 7.21684 2.76082 -137.16823 981.20129
1840.0000 -145.75896 -137.98078 7.77818 2.75701 -137.22737 1002.55348
1845.0000 -146.09594 -137.41375 8.68219 2.71066 -137.94551 965.82262
1850.0000 -144.74694 -136.69602 8.05092 2.84668 -135.83774 1060.95239
1855.0000 -144.85771 -135.95083 8.90689 2.78001 -136.87087 1041.08516
1860.0000 -145.44748 -138.45222 6.99526 2.80855 -136.42869 1096.63888
1865.0000 -144.92671 -137.56370 7.36301 2.70520 -138.03017 958.60353
1870.0000 -143.69842 -136.00989 7.68853 2.82612 -136.15635 1069.68226
1875.0000 -144.35032 -135.69482 8.65549 2.88249 -135.28287 1069.12048
1880.0000 -145.95040 -138.49696 7.45345 2.78353 -136.81638 1019.42249
1885.0000 -146.16710 -138.14523 8.02187 2.67939 -138.43015 935.41574
1890.0000 -147.37427 -139.24085 8.13342 2.63077 -139.18361 920.65770
1895.0000 -147.48894 -140.01408 7.47486 2.57244 -140.08740 858.29191
1900.0000 -146.27942 -138.71395 7.56547 2.64300 -138.99402 929.98595
1905.0000 -145.70176 -138.60541 7.09635 2.61861 -139.37200 904.75545
1910.0000 -146.63719 -140.22589 6.41130 2.56787 -140.15829 884.81908
1915.0000 -146.45954 -138.99333 7.46621 2.60327 -139.60969 873.14438
1920.0000 -145.90791 -137.51319 8.39472 2.69128 -138.24586 923.88541
1925.0000 -146.46892 -137.87143 8.59749 2.69497 -138.18879 966.13327
1930.0000 -145.45171 -139.09173 6.35998 2.67185 -138.54704 939.04635
1935.0000 -144.49091 -136.72425 7.76665 2.71749 -137.83976 977.75685
1940.0000 -143.13268 -134.83932 8.29336 2.82770 -136.13199 1037.40929
1945.0000 -145.17204 -136.60267 8.56937 2.83181 -136.06824 1070.47864
1950.0000 -144.62042 -136.13226 8.48817 2.78096 -136.85629 1038.07010
1955.0000 -144.50255 -135.57862 8.92393 2.83929 -135.95236 1041.69325
1960.0000 -143.26393 -135.03997 8.22396 2.86432 -135.56452 1086.37025
1965.0000 -143.70755 -135.97266 7.73490 2.86564 -135.54398 1066.93274
1970.0000 -145.67697 -138.09446 7.58251 2.73654 -137.54462 969.60157
1975.0000 -145.47700 -137.24641 8.23059 2.70947 -137.96397 962.88301
1980.0000 -142.91976 -136.05246 6.86730 2.80946 -136.41465 1005.56687
1985.0000 -145.02191 -136.94262 8.07929 2.78134 -136.85027 1005.24795
1990.0000 -146.59299 -139.78014 6.81286 2.65218 -138.85175 929.18636
1995.0000 -144.72003 -137.66860 7.05143 2.67468 -138.50319 964.29347
2000.0000 -145.94891 -138.74544 7.20346 2.72980 -137.64893 976.16431
FREEZING PROCESS: loop number 9 T-loop= 957.00000000000000
main_MD> interactions number 9 at Temperature= 957.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -4.26252 4.57359 2.46455
force_rgl> df(natom) -2.29585 -1.61042 -2.65135
2005.0000 -144.87844 -137.13060 7.74784 2.71920 -137.81318 953.00078
2010.0000 -146.49372 -137.58905 8.90466 2.72575 -137.71179 964.81548
2015.0000 -145.76408 -138.75611 7.00797 2.73109 -137.62894 987.51664
2020.0000 -144.59275 -137.51506 7.07769 2.71841 -137.82550 948.27018
2025.0000 -147.81566 -138.67253 9.14313 2.70899 -137.97146 942.16903
2030.0000 -145.78866 -138.41809 7.37058 2.67037 -138.56984 964.33506
2035.0000 -145.18947 -136.77807 8.41139 2.71795 -137.83259 967.38604
2040.0000 -145.75924 -138.74225 7.01699 2.74526 -137.40944 971.72093
2045.0000 -145.98562 -138.57815 7.40746 2.67444 -138.50687 954.48654
2050.0000 -144.90983 -137.91250 6.99733 2.67643 -138.47602 937.38966
2055.0000 -143.78506 -136.71006 7.07500 2.78739 -136.75652 1020.79285
2060.0000 -146.69080 -138.80603 7.88478 2.66490 -138.65464 922.22405
2065.0000 -144.45774 -136.08381 8.37393 2.73306 -137.59847 1000.75325
2070.0000 -146.36890 -139.64879 6.72011 2.73460 -137.57454 1001.08623
2075.0000 -147.40148 -140.02406 7.37742 2.56685 -140.17407 878.73625
2080.0000 -145.95771 -137.68765 8.27005 2.64295 -138.99488 937.82670
2085.0000 -146.78533 -138.22024 8.56509 2.68604 -138.32709 967.31442
2090.0000 -147.29148 -139.71084 7.58063 2.66663 -138.62783 946.42965
2095.0000 -147.23772 -141.59369 5.64403 2.52712 -140.78976 830.21042
2100.0000 -146.41291 -140.04068 6.37224 2.56420 -140.21514 864.76588
2105.0000 -146.32657 -138.48907 7.83750 2.58566 -139.88253 874.94005
2110.0000 -147.27403 -139.55370 7.72033 2.65394 -138.82446 955.82192
2115.0000 -145.82727 -137.59272 8.23455 2.64422 -138.97513 960.94952
2120.0000 -146.05070 -137.72179 8.32891 2.70331 -138.05948 953.71353
2125.0000 -146.29101 -137.47776 8.81325 2.75156 -137.31184 994.54758
2130.0000 -145.61708 -138.79131 6.82577 2.63986 -139.04278 936.96449
2135.0000 -145.51780 -138.00254 7.51525 2.65315 -138.83675 913.59746
2140.0000 -146.10624 -139.04052 7.06572 2.67409 -138.51233 937.17411
2145.0000 -147.24007 -139.78127 7.45880 2.61348 -139.45143 914.30281
2150.0000 -146.20561 -138.36129 7.84432 2.61230 -139.46977 953.19776
2155.0000 -143.23017 -134.98636 8.24381 2.76769 -137.06186 982.51995
2160.0000 -144.68503 -136.65916 8.02587 2.79626 -136.61919 1005.24513
2165.0000 -143.87833 -136.19005 7.68828 2.78150 -136.84780 1018.33648
2170.0000 -145.83530 -139.53119 6.30411 2.76867 -137.04659 990.75799
2175.0000 -145.35781 -137.72403 7.63379 2.67182 -138.54751 933.31035
2180.0000 -143.62512 -135.87320 7.75192 2.79683 -136.61028 1038.25466
2185.0000 -145.36807 -136.79246 8.57562 2.86937 -135.48617 1087.14785
2190.0000 -143.72836 -136.56747 7.16089 2.78751 -136.75477 1020.25791
2195.0000 -144.86913 -136.64941 8.21972 2.85844 -135.65551 1090.44640
2200.0000 -146.43564 -138.41070 8.02494 2.77225 -136.99114 1014.89385
2205.0000 -146.67421 -139.54296 7.13125 2.64380 -138.98166 928.17641
2210.0000 -146.67595 -139.12008 7.55587 2.64157 -139.01616 964.98489
2215.0000 -146.09209 -138.14328 7.94881 2.63702 -139.08671 895.74209
2220.0000 -145.38457 -137.67788 7.70669 2.74928 -137.34720 1002.61874
2225.0000 -145.89461 -138.27593 7.61868 2.68384 -138.36120 930.76133
2230.0000 -145.64769 -138.67952 6.96817 2.69650 -138.16502 952.99217
2235.0000 -146.49607 -139.41731 7.07875 2.68344 -138.36734 958.79267
2240.0000 -146.06129 -138.71456 7.34674 2.64399 -138.97873 916.81281
2245.0000 -144.33096 -137.15144 7.17952 2.69536 -138.18273 951.09958
2250.0000 -143.28977 -136.22712 7.06264 2.78694 -136.76360 1031.14231
FREEZING PROCESS: loop number 10 T-loop= 932.00000000000000
main_MD> interactions number 10 at Temperature= 932.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.17693 -1.47587 2.42461
force_rgl> df(natom) -0.60218 4.30309 4.12934
2255.0000 -145.25938 -137.21072 8.04865 2.80539 -136.47769 1023.43776
2260.0000 -145.40954 -136.52847 8.88108 2.73827 -137.51777 1003.05865
2265.0000 -145.05322 -138.36864 6.68459 2.78034 -136.86587 1003.81752
2270.0000 -145.63713 -136.61248 9.02465 2.69423 -138.20012 941.11270
2275.0000 -144.25816 -136.22328 8.03489 2.82086 -136.23786 994.00284
2280.0000 -146.19093 -137.76295 8.42798 2.74359 -137.43533 952.97790
2285.0000 -145.19278 -138.12886 7.06392 2.68051 -138.41275 955.41847
2290.0000 -145.01881 -138.35547 6.66334 2.69561 -138.17885 974.92852
2295.0000 -146.82544 -139.64843 7.17701 2.66675 -138.62596 957.00381
2300.0000 -146.35358 -138.89376 7.45982 2.63418 -139.13074 883.47398
2305.0000 -145.54020 -138.66536 6.87484 2.70231 -138.07505 965.25241
2310.0000 -145.63677 -138.47986 7.15691 2.61053 -139.49716 918.02589
2315.0000 -146.72671 -140.78410 5.94261 2.61383 -139.44608 909.51313
2320.0000 -147.80317 -141.28009 6.52307 2.49837 -141.23518 837.49719
2325.0000 -146.64648 -138.86025 7.78623 2.61069 -139.49467 911.68453
2330.0000 -146.82044 -138.74273 8.07772 2.68810 -138.29517 928.72129
2335.0000 -145.98766 -138.21337 7.77430 2.69740 -138.15114 978.08668
2340.0000 -145.35205 -137.20127 8.15078 2.73397 -137.58439 999.13643
2345.0000 -146.08331 -137.77429 8.30903 2.72603 -137.70745 992.87369
2350.0000 -147.41235 -140.09142 7.32093 2.65311 -138.83743 964.44118
2355.0000 -147.25475 -140.96611 6.28864 2.59360 -139.75955 904.10219
2360.0000 -145.47677 -138.69040 6.78637 2.62333 -139.29887 889.59840
2365.0000 -145.84661 -137.97509 7.87152 2.67155 -138.55166 931.57210
2370.0000 -145.04030 -136.95784 8.08246 2.75110 -137.31894 1017.38251
2375.0000 -145.28560 -138.18910 7.09651 2.77545 -136.94162 1025.24719
2380.0000 -144.60668 -136.97765 7.62903 2.72591 -137.70931 980.61146
2385.0000 -145.64684 -137.64657 8.00027 2.76576 -137.09172 1052.34387
2390.0000 -144.88387 -137.28146 7.60241 2.75735 -137.22203 1015.81159
2395.0000 -147.78382 -140.13109 7.65273 2.66084 -138.71752 945.82539
2400.0000 -147.24394 -140.04183 7.20211 2.53670 -140.64133 852.54129
2405.0000 -147.33810 -139.15674 8.18136 2.59365 -139.75872 880.62175
2410.0000 -147.21228 -138.83367 8.37860 2.66515 -138.65086 923.13598
2415.0000 -143.73432 -136.91216 6.82216 2.74449 -137.42139 987.19839
2420.0000 -145.82795 -139.13856 6.68939 2.69837 -138.13609 966.42007
2425.0000 -146.08343 -137.84802 8.23540 2.73958 -137.49744 968.53649
2430.0000 -145.13503 -137.84712 7.28791 2.72227 -137.76575 964.99110
2435.0000 -145.39680 -137.41757 7.97924 2.73497 -137.56894 974.56811
2440.0000 -145.07412 -137.42976 7.64436 2.74706 -137.38148 982.41256
2445.0000 -145.59361 -138.54500 7.04861 2.71757 -137.83858 986.45480
2450.0000 -146.35257 -138.22748 8.12509 2.70675 -138.00613 974.59793
2455.0000 -146.13911 -138.28876 7.85035 2.72122 -137.78194 984.10291
2460.0000 -145.77769 -138.79920 6.97849 2.65355 -138.83059 949.81963
2465.0000 -146.12776 -139.33221 6.79554 2.61254 -139.46608 910.91464
2470.0000 -146.61970 -139.71082 6.90888 2.60417 -139.59568 876.16431
2475.0000 -147.23233 -141.48606 5.74627 2.52624 -140.80338 853.49074
2480.0000 -147.86023 -140.18865 7.67159 2.51954 -140.90720 840.58882
2485.0000 -144.21057 -136.88427 7.32631 2.62675 -139.24587 914.42547
2490.0000 -145.41539 -137.61970 7.79569 2.75310 -137.28801 1002.92536
2495.0000 -146.38773 -138.75010 7.63764 2.70745 -137.99530 972.12216
2500.0000 -146.57951 -137.93935 8.64016 2.62250 -139.31173 907.87822
FREEZING PROCESS: loop number 11 T-loop= 907.00000000000000
main_MD> interactions number 11 at Temperature= 907.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 5.30094 0.28658 3.08953
force_rgl> df(natom) 3.37042 2.52481 7.69590
2505.0000 -146.12547 -139.56230 6.56317 2.66748 -138.61469 962.75617
2510.0000 -146.34136 -138.95668 7.38468 2.61141 -139.48351 882.94882
2515.0000 -145.80401 -139.39884 6.40517 2.56986 -140.12741 877.37900
2520.0000 -146.19622 -139.20465 6.99157 2.64468 -138.96805 922.60018
2525.0000 -146.77831 -138.81333 7.96498 2.61911 -139.36428 908.34511
2530.0000 -146.64749 -140.33757 6.30992 2.57231 -140.08943 872.00112
2535.0000 -148.37528 -140.77828 7.59700 2.56768 -140.16113 896.10141
2540.0000 -147.21523 -139.66966 7.54557 2.56660 -140.17788 911.56717
2545.0000 -145.26820 -137.35856 7.90963 2.69044 -138.25893 978.35632
2550.0000 -146.35606 -139.98541 6.37065 2.61484 -139.43045 946.90135
2555.0000 -147.24931 -139.57857 7.67074 2.57170 -140.09897 914.47311
2560.0000 -146.43654 -139.10917 7.32737 2.55973 -140.28434 871.54072
2565.0000 -146.78261 -139.33580 7.44682 2.62452 -139.28041 907.29764
2570.0000 -147.39993 -140.27981 7.12012 2.57330 -140.07410 892.69098
2575.0000 -146.69800 -139.84739 6.85061 2.55273 -140.39285 857.69486
2580.0000 -146.85777 -139.63526 7.22251 2.55985 -140.28261 880.49016
2585.0000 -146.20588 -139.99890 6.20698 2.56620 -140.18406 866.07163
2590.0000 -147.19295 -140.44184 6.75111 2.53819 -140.61817 845.68905
2595.0000 -147.43677 -139.32109 8.11567 2.58835 -139.84086 902.75373
2600.0000 -146.80740 -141.03010 5.77730 2.54603 -140.49667 876.98297
2605.0000 -145.62880 -139.53044 6.09836 2.56862 -140.14661 872.44395
2610.0000 -145.32050 -138.72280 6.59770 2.66342 -138.67758 941.15242
2615.0000 -148.32787 -140.49906 7.82881 2.58956 -139.82210 902.15684
2620.0000 -147.48155 -140.68727 6.79428 2.54833 -140.46109 835.90216
2625.0000 -146.36054 -138.88970 7.47084 2.58218 -139.93650 909.14078
2630.0000 -146.03044 -140.00924 6.02120 2.63742 -139.08052 935.09460
2635.0000 -147.29520 -140.65120 6.64400 2.53516 -140.66512 858.50562
2640.0000 -147.79342 -141.02129 6.77214 2.53205 -140.71334 848.39013
2645.0000 -146.42494 -139.10048 7.32445 2.57577 -140.03583 872.28092
2650.0000 -147.08759 -140.05329 7.03430 2.61824 -139.37768 867.02235
2655.0000 -145.97331 -138.48998 7.48334 2.65155 -138.86150 938.09830
2660.0000 -146.60822 -140.64489 5.96333 2.64825 -138.91271 942.59272
2665.0000 -146.63212 -140.73305 5.89907 2.50956 -141.06183 847.41197
2670.0000 -148.26404 -140.83877 7.42527 2.54175 -140.56299 845.36311
2675.0000 -149.14803 -142.54378 6.60425 2.46832 -141.70083 796.19374
2680.0000 -148.84679 -142.18436 6.66243 2.40330 -142.70842 738.74866
2685.0000 -148.42395 -141.11699 7.30697 2.50831 -141.08127 840.03491
2690.0000 -147.39219 -141.29764 6.09455 2.50124 -141.19077 818.84475
2695.0000 -146.43391 -140.07177 6.36214 2.50743 -141.09485 814.71753
2700.0000 -147.42025 -141.42507 5.99518 2.53354 -140.69026 845.59994
2705.0000 -146.55910 -139.35636 7.20274 2.58262 -139.92966 891.25789
2710.0000 -146.89217 -139.81300 7.07917 2.62119 -139.33197 914.25793
2715.0000 -148.30167 -141.16297 7.13871 2.58304 -139.92322 884.88028
2720.0000 -146.89458 -139.62689 7.26769 2.58523 -139.88929 907.76461
2725.0000 -147.03117 -139.71463 7.31654 2.58785 -139.84860 891.57844
2730.0000 -146.75787 -139.62827 7.12960 2.63687 -139.08902 909.72838
2735.0000 -145.45625 -137.67607 7.78018 2.65732 -138.77215 912.94414
2740.0000 -146.13032 -139.62706 6.50326 2.64225 -139.00574 888.89012
2745.0000 -145.98409 -140.42225 5.56183 2.56253 -140.24102 864.11428
2750.0000 -148.01039 -141.14233 6.86806 2.54686 -140.48382 872.80530
FREEZING PROCESS: loop number 12 T-loop= 882.00000000000000
main_MD> interactions number 12 at Temperature= 882.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -2.70566 -5.48760 0.80544
force_rgl> df(natom) -0.56134 -0.83087 0.65100
2755.0000 -145.83215 -139.03241 6.79975 2.56605 -140.18651 884.97583
2760.0000 -146.25939 -137.88496 8.37443 2.66804 -138.60596 946.60205
2765.0000 -145.76036 -138.44433 7.31603 2.70851 -137.97885 966.91192
2770.0000 -145.91043 -140.35931 5.55112 2.58843 -139.83973 877.66344
2775.0000 -146.63898 -140.44872 6.19026 2.55946 -140.28862 857.51795
2780.0000 -145.81785 -137.79109 8.02676 2.58795 -139.84704 882.91583
2785.0000 -147.81990 -140.43192 7.38798 2.61546 -139.42074 910.32571
2790.0000 -146.38005 -139.92482 6.45523 2.58834 -139.84112 877.55787
2795.0000 -145.04740 -139.52705 5.52036 2.62171 -139.32390 915.85863
2800.0000 -144.72564 -139.01517 5.71047 2.62532 -139.26804 917.98807
2805.0000 -146.23684 -139.80971 6.42713 2.60167 -139.63444 884.26174
2810.0000 -146.44450 -140.22152 6.22298 2.55138 -140.41373 855.36005
2815.0000 -146.28551 -138.50788 7.77763 2.60073 -139.64913 887.41263
2820.0000 -146.68126 -140.29910 6.38216 2.56671 -140.17630 847.31177
2825.0000 -147.75472 -139.97493 7.77979 2.55415 -140.37079 850.07038
2830.0000 -146.82581 -139.59834 7.22748 2.63794 -139.07239 921.16301
2835.0000 -147.11791 -140.36619 6.75172 2.56436 -140.21272 843.81426
2840.0000 -147.48329 -140.12897 7.35433 2.56544 -140.19593 863.50038
2845.0000 -147.53662 -140.45900 7.07762 2.56822 -140.15284 856.86523
2850.0000 -147.01819 -141.65738 5.36081 2.50355 -141.15497 824.82592
2855.0000 -146.50368 -140.20942 6.29426 2.44862 -142.00617 772.34979
2860.0000 -147.19559 -141.49873 5.69686 2.51503 -140.97711 819.45527
2865.0000 -146.51346 -139.62291 6.89055 2.53910 -140.60408 847.49230
2870.0000 -146.25289 -139.44205 6.81084 2.70280 -138.06736 946.84276
2875.0000 -147.25751 -140.14592 7.11159 2.60691 -139.55337 894.62023
2880.0000 -147.69000 -140.90647 6.78353 2.52228 -140.86471 837.09281
2885.0000 -146.64831 -139.21900 7.42931 2.58680 -139.86493 883.83952
2890.0000 -146.84149 -139.55781 7.28368 2.61396 -139.44398 899.85197
2895.0000 -146.26885 -139.45449 6.81436 2.55198 -140.40445 848.88297
2900.0000 -148.09142 -140.20295 7.88847 2.55015 -140.43279 853.68767
2905.0000 -147.29882 -140.61538 6.68344 2.54681 -140.48460 841.11704
2910.0000 -148.18294 -142.49574 5.68721 2.45814 -141.85864 814.19187
2915.0000 -146.99780 -139.76849 7.22932 2.52568 -140.81199 836.05062
2920.0000 -146.52527 -139.35974 7.16553 2.58278 -139.92722 904.20708
2925.0000 -146.83557 -140.34001 6.49556 2.65058 -138.87654 939.25189
2930.0000 -146.38213 -140.02165 6.36048 2.60242 -139.62284 904.01158
2935.0000 -148.66368 -142.25275 6.41093 2.52027 -140.89586 846.89717
2940.0000 -147.87868 -141.00357 6.87510 2.51171 -141.02844 821.52679
2945.0000 -148.24488 -141.63088 6.61400 2.44990 -141.98627 798.21069
2950.0000 -147.33491 -141.05188 6.28303 2.47629 -141.57736 788.96293
2955.0000 -147.97143 -142.02955 5.94189 2.45637 -141.88603 772.54663
2960.0000 -146.63673 -140.60080 6.03593 2.48782 -141.39868 788.25989
2965.0000 -145.48057 -138.17803 7.30254 2.62390 -139.29000 906.94245
2970.0000 -147.25112 -139.81560 7.43552 2.61457 -139.43452 887.77685
2975.0000 -146.86205 -140.03830 6.82375 2.58504 -139.89214 886.93960
2980.0000 -146.74818 -140.52387 6.22431 2.54898 -140.45105 852.66339
2985.0000 -147.00054 -140.88522 6.11532 2.52892 -140.76189 873.82486
2990.0000 -147.45174 -139.33704 8.11470 2.58916 -139.82828 904.28267
2995.0000 -145.57805 -138.34211 7.23594 2.64412 -138.97676 951.65619
3000.0000 -145.95541 -138.95975 6.99566 2.72856 -137.66813 975.29661
FREEZING PROCESS: loop number 13 T-loop= 857.00000000000000
main_MD> interactions number 13 at Temperature= 857.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.19895 -0.78779 -0.92166
force_rgl> df(natom) -1.00700 3.57146 -0.80077
3005.0000 -146.70434 -140.23942 6.46492 2.57958 -139.97683 858.64896
3010.0000 -147.68919 -141.15406 6.53513 2.52135 -140.87914 863.97673
3015.0000 -148.21521 -141.75864 6.45657 2.41771 -142.48509 782.62790
3020.0000 -148.05715 -140.91393 7.14322 2.47829 -141.54638 803.01879
3025.0000 -147.21619 -141.31794 5.89825 2.53909 -140.60417 845.40816
3030.0000 -148.25161 -143.38056 4.87105 2.46979 -141.67809 801.08342
3035.0000 -147.18357 -141.51571 5.66786 2.42337 -142.39747 770.45959
3040.0000 -147.06973 -140.56460 6.50513 2.45700 -141.87636 787.27551
3045.0000 -144.67562 -137.85530 6.82032 2.61383 -139.44613 916.29603
3050.0000 -146.47293 -139.99704 6.47589 2.64825 -138.91273 909.01553
3055.0000 -145.66534 -138.71259 6.95275 2.61600 -139.41241 892.88707
3060.0000 -147.73470 -139.48808 8.24662 2.67388 -138.51556 939.44317
3065.0000 -147.74406 -141.02891 6.71515 2.54992 -140.43644 833.82469
3070.0000 -147.70251 -140.26139 7.44112 2.54402 -140.52777 867.08241
3075.0000 -145.31720 -138.86822 6.44898 2.57976 -139.97394 883.61689
3080.0000 -145.59583 -139.42837 6.16747 2.61518 -139.42514 887.48332
3085.0000 -147.35768 -139.90835 7.44933 2.62123 -139.33146 888.57308
3090.0000 -148.30267 -140.23980 8.06286 2.59885 -139.67815 881.33804
3095.0000 -148.02441 -139.79402 8.23039 2.55080 -140.42278 825.94197
3100.0000 -146.99192 -140.53188 6.46004 2.54296 -140.54433 848.30899
3105.0000 -148.60247 -142.79250 5.80998 2.45181 -141.95676 793.78570
3110.0000 -149.55224 -144.18510 5.36714 2.36220 -143.34534 732.12043
3115.0000 -149.18938 -142.16261 7.02676 2.41789 -142.48240 772.27641
3120.0000 -147.82748 -141.37280 6.45467 2.44011 -142.13799 781.64557
3125.0000 -148.06986 -141.47072 6.59914 2.45529 -141.90286 826.97073
3130.0000 -148.75139 -141.58288 7.16852 2.50213 -141.17692 821.31412
3135.0000 -148.15590 -141.07632 7.07957 2.51321 -141.00535 826.21150
3140.0000 -146.87380 -140.01889 6.85490 2.57356 -140.07005 851.96707
3145.0000 -146.14994 -139.07888 7.07106 2.60108 -139.64370 888.59788
3150.0000 -146.46848 -138.79104 7.67744 2.62155 -139.32647 915.99813
3155.0000 -146.43387 -139.72591 6.70797 2.62670 -139.24657 917.37705
3160.0000 -147.89884 -140.63388 7.26496 2.53124 -140.72595 886.58238
3165.0000 -145.88980 -139.47239 6.41741 2.58785 -139.84872 883.72764
3170.0000 -144.43477 -137.44011 6.99466 2.65319 -138.83618 933.67883
3175.0000 -145.79477 -139.60029 6.19449 2.67824 -138.44804 970.80256
3180.0000 -145.72872 -138.14697 7.58175 2.70225 -138.07585 980.71384
3185.0000 -147.82273 -138.78773 9.03500 2.68194 -138.39061 959.05154
3190.0000 -146.34536 -138.96597 7.37940 2.61690 -139.39845 882.32451
3195.0000 -147.40655 -140.81671 6.58984 2.52717 -140.78898 828.00280
3200.0000 -146.57462 -140.24099 6.33363 2.55450 -140.36551 833.16402
3205.0000 -146.89575 -139.74296 7.15279 2.57290 -140.08028 887.27288
3210.0000 -149.18557 -141.09150 8.09407 2.54945 -140.44370 908.57237
3215.0000 -147.25246 -140.91166 6.34080 2.52771 -140.78053 831.67370
3220.0000 -147.83031 -142.01971 5.81061 2.44229 -142.10420 765.42769
3225.0000 -148.91612 -141.35949 7.55663 2.47151 -141.65152 803.33395
3230.0000 -147.28890 -141.25851 6.03039 2.47729 -141.56188 781.56421
3235.0000 -147.59738 -140.77614 6.82125 2.50496 -141.13310 806.71000
3240.0000 -147.24761 -140.64176 6.60585 2.54671 -140.48616 848.22290
3245.0000 -147.14643 -139.62200 7.52444 2.56257 -140.24042 849.44243
3250.0000 -144.92561 -136.49264 8.43297 2.68469 -138.34795 954.98775
FREEZING PROCESS: loop number 14 T-loop= 832.00000000000000
main_MD> interactions number 14 at Temperature= 832.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.22375 -2.29016 1.02386
force_rgl> df(natom) -4.17327 1.34669 -3.86919
3255.0000 -147.30583 -138.33501 8.97082 2.72407 -137.73786 968.11401
3260.0000 -146.62281 -139.58572 7.03709 2.64629 -138.94309 886.18462
3265.0000 -145.67011 -138.76363 6.90648 2.61038 -139.49958 877.05933
3270.0000 -145.13851 -138.54070 6.59781 2.63451 -139.12561 908.15600
3275.0000 -146.51306 -139.30144 7.21161 2.65694 -138.77810 892.15610
3280.0000 -147.33287 -140.05270 7.28017 2.59854 -139.68306 856.99068
3285.0000 -148.36824 -141.19678 7.17146 2.56941 -140.13439 860.92105
3290.0000 -148.43140 -140.80750 7.62391 2.48354 -141.46498 802.83652
3295.0000 -145.62285 -140.30867 5.31418 2.58741 -139.85552 870.82322
3300.0000 -146.10206 -139.84021 6.26186 2.57952 -139.97775 890.54609
3305.0000 -147.47303 -140.90208 6.57095 2.52740 -140.78531 834.92490
3310.0000 -148.05539 -141.17973 6.87566 2.51355 -140.99995 817.91129
3315.0000 -148.31053 -142.88326 5.42727 2.44418 -142.07493 764.36837
3320.0000 -148.37381 -142.94178 5.43203 2.42068 -142.43914 766.85609
3325.0000 -147.18189 -141.97038 5.21151 2.42521 -142.36890 773.19463
3330.0000 -146.54003 -141.06184 5.47818 2.51274 -141.01254 840.57618
3335.0000 -147.12287 -140.61238 6.51049 2.53379 -140.68641 847.97412
3340.0000 -148.72092 -142.55038 6.17054 2.50105 -141.19373 826.71488
3345.0000 -148.29017 -141.75114 6.53903 2.49328 -141.31409 791.28293
3350.0000 -147.30430 -141.31448 5.98982 2.45329 -141.93377 777.63303
3355.0000 -149.07168 -141.28255 7.78912 2.48779 -141.39914 833.57332
3360.0000 -148.01945 -141.09578 6.92367 2.49423 -141.29942 829.87702
3365.0000 -148.80581 -143.01873 5.78708 2.46505 -141.75158 774.53417
3370.0000 -148.14943 -142.46516 5.68427 2.41023 -142.60112 767.51134
3375.0000 -147.22702 -141.02725 6.19977 2.46668 -141.72625 776.06395
3380.0000 -147.56362 -141.37285 6.19077 2.50681 -141.10452 850.54310
3385.0000 -146.52971 -140.45396 6.07574 2.48719 -141.40855 816.42035
3390.0000 -146.66700 -139.75698 6.91003 2.62715 -139.23960 905.10704
3395.0000 -148.47771 -141.85324 6.62448 2.53671 -140.64114 851.65288
3400.0000 -148.07315 -141.29325 6.77990 2.46149 -141.80666 827.95180
3405.0000 -148.64482 -142.13982 6.50500 2.42636 -142.35106 782.31763
3410.0000 -148.62984 -141.28376 7.34608 2.48628 -141.42257 807.93908
3415.0000 -148.38173 -140.99887 7.38285 2.49783 -141.24363 839.35392
3420.0000 -146.74679 -139.63309 7.11369 2.52274 -140.85766 856.20629
3425.0000 -146.77578 -139.29058 7.48520 2.58303 -139.92341 887.93961
3430.0000 -147.87253 -141.09344 6.77909 2.51235 -141.01864 834.13726
3435.0000 -147.78057 -142.12627 5.65431 2.50183 -141.18166 816.37553
3440.0000 -147.36418 -141.05655 6.30763 2.51018 -141.05216 850.48393
3445.0000 -145.77878 -139.41579 6.36300 2.59639 -139.71630 897.16141
3450.0000 -148.08800 -141.11311 6.97489 2.51598 -140.96234 855.64424
3455.0000 -147.39847 -140.84408 6.55439 2.51507 -140.97645 843.21705
3460.0000 -147.55665 -141.37514 6.18151 2.49451 -141.29511 820.34695
3465.0000 -147.93937 -141.78948 6.14989 2.52002 -140.89977 843.16757
3470.0000 -147.70903 -142.26423 5.44480 2.50097 -141.19491 801.74008
3475.0000 -147.19532 -140.69870 6.49662 2.46364 -141.77347 775.94577
3480.0000 -146.57288 -139.91852 6.65436 2.58926 -139.82684 886.79692
3485.0000 -146.99998 -141.27952 5.72045 2.48971 -141.36949 820.91639
3490.0000 -147.80491 -141.40715 6.39775 2.45537 -141.90159 793.47675
3495.0000 -147.90765 -141.70934 6.19831 2.45616 -141.88934 787.03467
3500.0000 -148.07569 -141.89390 6.18179 2.44632 -142.04180 790.69510
FREEZING PROCESS: loop number 15 T-loop= 807.00000000000000
main_MD> interactions number 15 at Temperature= 807.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.05409 1.83274 -6.39731
force_rgl> df(natom) 0.89915 0.83136 3.32120
3505.0000 -148.90932 -142.37833 6.53099 2.43120 -142.27612 783.25849
3510.0000 -149.23155 -143.89374 5.33781 2.35804 -143.40978 736.51472
3515.0000 -149.17011 -143.39119 5.77893 2.33927 -143.70060 716.01684
3520.0000 -147.96862 -141.62325 6.34537 2.44550 -142.05455 771.70562
3525.0000 -148.75107 -142.21691 6.53416 2.46583 -141.73946 796.30781
3530.0000 -149.42956 -142.84008 6.58948 2.39715 -142.80370 762.72359
3535.0000 -148.60732 -141.85651 6.75081 2.38796 -142.94621 768.37521
3540.0000 -147.92229 -141.73109 6.19120 2.47894 -141.53630 808.52591
3545.0000 -147.39404 -141.02616 6.36788 2.47314 -141.62615 790.71002
3550.0000 -147.55250 -140.41885 7.13365 2.53718 -140.63380 853.67366
3555.0000 -146.25087 -139.67591 6.57496 2.56204 -140.24859 856.70711
3560.0000 -147.76813 -139.66447 8.10367 2.60225 -139.62554 906.09255
3565.0000 -146.98495 -140.71002 6.27493 2.57088 -140.11164 809.11676
3570.0000 -148.17221 -141.93923 6.23298 2.50408 -141.14675 805.04966
3575.0000 -149.41896 -142.05932 7.35963 2.45719 -141.87329 827.74088
3580.0000 -148.27445 -142.54667 5.72779 2.42032 -142.44465 782.65673
3585.0000 -147.34935 -141.02349 6.32586 2.47456 -141.60423 816.73410
3590.0000 -148.93800 -142.32024 6.61776 2.50457 -141.13924 844.01154
3595.0000 -148.29020 -143.17456 5.11564 2.42763 -142.33146 787.10124
3600.0000 -150.40076 -145.40960 4.99116 2.35022 -143.53098 710.70199
3605.0000 -147.87535 -143.08682 4.78852 2.26399 -144.86718 658.32607
3610.0000 -146.94578 -139.84142 7.10436 2.45719 -141.87342 788.08805
3615.0000 -147.55732 -140.06452 7.49280 2.58618 -139.87450 884.41769
3620.0000 -147.83451 -142.50353 5.33099 2.44665 -142.03667 801.64883
3625.0000 -146.97879 -140.87031 6.10848 2.47113 -141.65737 807.42055
3630.0000 -147.39335 -141.87853 5.51482 2.46839 -141.69984 812.16148
3635.0000 -147.04498 -141.01336 6.03162 2.45429 -141.91825 779.61958
3640.0000 -148.41676 -141.46290 6.95387 2.50269 -141.16825 846.67174
3645.0000 -148.92378 -141.22767 7.69611 2.51588 -140.96388 834.59232
3650.0000 -148.42243 -142.24894 6.17350 2.46369 -141.77262 808.68061
3655.0000 -148.38270 -142.07426 6.30844 2.48558 -141.43342 793.45438
3660.0000 -148.68515 -142.18552 6.49963 2.41620 -142.50854 775.27330
3665.0000 -148.28777 -142.04017 6.24759 2.43809 -142.16938 781.74902
3670.0000 -148.91162 -141.80424 7.10738 2.43164 -142.26935 781.51233
3675.0000 -148.67021 -142.19983 6.47038 2.43159 -142.27009 758.42986
3680.0000 -147.22638 -141.62462 5.60176 2.43656 -142.19302 776.87986
3685.0000 -149.22878 -143.33435 5.89443 2.38912 -142.92815 734.72322
3690.0000 -148.81420 -143.34796 5.46624 2.37644 -143.12469 743.96436
3695.0000 -148.18871 -142.44538 5.74333 2.39986 -142.76181 754.55303
3700.0000 -149.37069 -143.14397 6.22673 2.39492 -142.83836 746.88944
3705.0000 -149.17567 -142.41365 6.76202 2.41766 -142.48589 788.18044
3710.0000 -146.95172 -141.43459 5.51713 2.44007 -142.13868 792.27820
3715.0000 -148.31990 -140.57014 7.74976 2.48540 -141.43615 827.12047
3720.0000 -148.73601 -141.50896 7.22705 2.50185 -141.18130 833.81453
3725.0000 -146.77353 -141.53269 5.24084 2.46002 -141.82955 780.54939
3730.0000 -146.69954 -139.94599 6.75355 2.58343 -139.91709 884.88948
3735.0000 -147.46266 -140.32733 7.13533 2.57484 -140.05028 876.23371
3740.0000 -147.18750 -140.07595 7.11155 2.59570 -139.72704 886.28018
3745.0000 -146.84357 -139.70834 7.13523 2.52801 -140.77589 856.50132
3750.0000 -147.06524 -140.67329 6.39195 2.54766 -140.47147 837.04243
FREEZING PROCESS: loop number 16 T-loop= 782.00000000000000
main_MD> interactions number 16 at Temperature= 782.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.84287 -0.74083 3.08221
force_rgl> df(natom) -5.79225 3.78463 -1.54392
3755.0000 -148.11626 -141.39022 6.72605 2.52232 -140.86405 839.26995
3760.0000 -146.78436 -139.42024 7.36412 2.55321 -140.38540 855.54692
3765.0000 -146.71271 -139.22937 7.48334 2.59722 -139.70341 894.17619
3770.0000 -148.62865 -142.13158 6.49707 2.46915 -141.68800 820.11640
3775.0000 -149.62782 -142.71166 6.91616 2.45367 -141.92793 793.94721
3780.0000 -148.50134 -143.22918 5.27216 2.38798 -142.94580 755.92977
3785.0000 -147.32633 -141.84776 5.47856 2.39555 -142.82855 754.15991
3790.0000 -146.99682 -141.39160 5.60522 2.49305 -141.31771 790.92039
3795.0000 -148.88720 -142.61882 6.26837 2.42864 -142.31583 759.84335
3800.0000 -147.61158 -141.41965 6.19193 2.41755 -142.48761 761.76691
3805.0000 -146.85702 -140.91988 5.93714 2.52189 -140.87071 837.36105
3810.0000 -148.40356 -142.49220 5.91136 2.52620 -140.80402 835.61976
3815.0000 -149.53365 -142.85796 6.67569 2.40105 -142.74336 764.56051
3820.0000 -148.89163 -143.00227 5.88936 2.39568 -142.82646 750.97672
3825.0000 -148.99038 -143.74622 5.24416 2.37373 -143.16669 724.01558
3830.0000 -148.44959 -142.27649 6.17310 2.34279 -143.64604 717.63098
3835.0000 -147.62451 -141.24384 6.38067 2.48284 -141.47590 842.77633
3840.0000 -147.32203 -141.10893 6.21310 2.50698 -141.10183 833.17177
3845.0000 -147.24200 -139.83863 7.40337 2.54657 -140.48835 847.53295
3850.0000 -148.17968 -141.87310 6.30658 2.52563 -140.81282 829.70917
3855.0000 -147.68670 -140.97339 6.71331 2.50191 -141.18037 813.79495
3860.0000 -146.52963 -139.50210 7.02753 2.56019 -140.27724 863.15344
3865.0000 -148.18564 -140.92400 7.26164 2.58592 -139.87854 905.73003
3870.0000 -146.96541 -141.15629 5.80912 2.48462 -141.44827 801.30537
3875.0000 -148.49896 -141.90831 6.59065 2.47238 -141.63805 793.59857
3880.0000 -147.89472 -141.66657 6.22815 2.44851 -142.00791 784.54300
3885.0000 -147.86507 -141.80124 6.06383 2.44393 -142.07884 791.70707
3890.0000 -148.42027 -139.86926 8.55102 2.52551 -140.81474 852.24373
3895.0000 -147.60610 -141.65899 5.94712 2.55846 -140.30411 850.95123
3900.0000 -147.81369 -141.47572 6.33798 2.50422 -141.14457 801.13404
3905.0000 -148.26792 -141.75482 6.51310 2.54035 -140.58466 878.64976
3910.0000 -148.36097 -142.59060 5.77037 2.45653 -141.88358 798.74142
3915.0000 -149.05097 -143.57971 5.47126 2.37220 -143.19038 709.54049
3920.0000 -148.36625 -143.15928 5.20697 2.38100 -143.05407 760.91773
3925.0000 -148.97308 -142.95624 6.01684 2.39388 -142.85447 753.58080
3930.0000 -148.34021 -142.42323 5.91698 2.41388 -142.54453 766.96874
3935.0000 -147.79097 -142.89698 4.89398 2.39997 -142.76008 742.84010
3940.0000 -149.21837 -143.39189 5.82647 2.39088 -142.90088 734.18256
3945.0000 -148.28884 -142.64612 5.64272 2.39799 -142.79065 768.82080
3950.0000 -149.53088 -142.99455 6.53633 2.43290 -142.24972 803.08969
3955.0000 -149.07916 -142.62474 6.45441 2.36874 -143.24394 761.21086
3960.0000 -150.01028 -143.65288 6.35740 2.39857 -142.78180 764.95735
3965.0000 -149.72608 -143.50269 6.22339 2.37333 -143.17289 733.45477
3970.0000 -148.47162 -142.47679 5.99484 2.43587 -142.20377 793.70958
3975.0000 -148.62051 -143.47854 5.14197 2.40037 -142.75379 769.55594
3980.0000 -147.29868 -141.27907 6.01962 2.44142 -142.11772 778.96815
3985.0000 -147.68452 -141.40283 6.28169 2.50883 -141.07317 802.01752
3990.0000 -147.14034 -140.62345 6.51688 2.52439 -140.83201 827.06684
3995.0000 -147.39562 -141.76613 5.62948 2.51193 -141.02515 820.80956
4000.0000 -148.58379 -142.04043 6.54336 2.44462 -142.06819 791.80083
FREEZING PROCESS: loop number 17 T-loop= 757.00000000000000
main_MD> interactions number 17 at Temperature= 757.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 3.94197 -8.07643 -4.94454
force_rgl> df(natom) 0.30303 3.23720 0.15074
4005.0000 -149.54088 -142.81207 6.72881 2.46305 -141.78257 804.60834
4010.0000 -149.20972 -143.65941 5.55030 2.38103 -143.05348 752.58884
4015.0000 -149.44558 -143.73373 5.71185 2.33809 -143.71897 699.86387
4020.0000 -148.41106 -142.47855 5.93251 2.38892 -142.93123 719.33095
4025.0000 -148.99883 -143.12497 5.87386 2.40409 -142.69618 745.59378
4030.0000 -149.14393 -143.01683 6.12709 2.38115 -143.05166 717.55160
4035.0000 -149.63502 -143.48427 6.15075 2.34825 -143.56146 704.29992
4040.0000 -150.04273 -143.89557 6.14716 2.33764 -143.72595 741.55122
4045.0000 -148.76256 -142.76219 6.00037 2.32716 -143.88835 743.42650
4050.0000 -149.17191 -143.28751 5.88440 2.36976 -143.22813 753.53665
4055.0000 -147.12810 -141.99117 5.13693 2.43157 -142.27037 761.61201
4060.0000 -148.39070 -141.81358 6.57712 2.39973 -142.76371 748.06454
4065.0000 -146.92884 -141.23840 5.69044 2.46582 -141.73958 803.93678
4070.0000 -148.70241 -142.85203 5.85038 2.52970 -140.74980 832.95273
4075.0000 -149.77082 -142.87801 6.89282 2.34960 -143.54061 732.38582
4080.0000 -149.32524 -144.11252 5.21273 2.34394 -143.62830 708.06543
4085.0000 -149.35392 -143.37453 5.97939 2.36558 -143.29296 751.80227
4090.0000 -148.76998 -143.67229 5.09769 2.33675 -143.73977 742.84956
4095.0000 -148.69590 -142.98075 5.71514 2.35081 -143.52176 710.94940
4100.0000 -148.97150 -143.15323 5.81827 2.39051 -142.90659 750.82542
4105.0000 -149.07086 -143.30126 5.76960 2.35664 -143.43141 712.40859
4110.0000 -148.45317 -143.51700 4.93617 2.32254 -143.95990 695.80631
4115.0000 -147.87508 -142.02571 5.84938 2.40703 -142.65058 770.99512
4120.0000 -148.05560 -141.87549 6.18011 2.43236 -142.25810 769.35214
4125.0000 -149.28998 -142.86941 6.42057 2.40033 -142.75440 772.03183
4130.0000 -149.18836 -143.55090 5.63746 2.37794 -143.10135 761.62426
4135.0000 -150.07731 -144.38691 5.69040 2.32386 -143.93939 711.93502
4140.0000 -149.95509 -144.97885 4.97625 2.29045 -144.45721 707.68035
4145.0000 -148.68663 -143.66144 5.02519 2.27909 -144.63316 672.85821
4150.0000 -149.79928 -143.12617 6.67312 2.33833 -143.71520 708.26561
4155.0000 -148.73297 -142.84496 5.88800 2.42219 -142.41577 757.83858
4160.0000 -150.10760 -143.30670 6.80090 2.36845 -143.24849 740.37095
4165.0000 -149.58348 -144.25887 5.32462 2.36771 -143.26001 747.41655
4170.0000 -148.63789 -142.51766 6.12024 2.38268 -143.02794 724.29930
4175.0000 -149.54610 -142.81732 6.72877 2.37652 -143.12347 728.76044
4180.0000 -149.59343 -143.22161 6.37182 2.42799 -142.32580 772.87555
4185.0000 -148.73264 -142.76148 5.97116 2.39276 -142.87171 756.61089
4190.0000 -147.42375 -142.02116 5.40259 2.42530 -142.36756 755.51507
4195.0000 -148.41125 -142.67544 5.73581 2.38111 -143.05234 717.67996
4200.0000 -149.55695 -143.19852 6.35843 2.38352 -143.01488 747.23748
4205.0000 -148.57882 -143.46371 5.11512 2.38705 -142.96023 743.71635
4210.0000 -148.21932 -141.27450 6.94482 2.41552 -142.51907 721.34641
4215.0000 -149.53468 -143.62581 5.90888 2.44367 -142.08292 797.60146
4220.0000 -147.92794 -141.94437 5.98357 2.42759 -142.33209 775.20971
4225.0000 -148.90560 -142.37501 6.53059 2.44780 -142.01882 783.78957
4230.0000 -148.81314 -143.37591 5.43723 2.39540 -142.83089 750.09696
4235.0000 -148.36459 -141.85970 6.50489 2.38394 -143.00842 714.08396
4240.0000 -148.66600 -142.71517 5.95083 2.43000 -142.29471 759.68228
4245.0000 -148.24014 -142.30222 5.93792 2.42312 -142.40128 755.97298
4250.0000 -146.90469 -141.03455 5.87014 2.51428 -140.98876 826.33246
FREEZING PROCESS: loop number 18 T-loop= 732.00000000000000
main_MD> interactions number 18 at Temperature= 732.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.63766 -1.13368 -0.34920
force_rgl> df(natom) 0.06343 2.13118 0.71533
4255.0000 -148.67157 -141.15589 7.51568 2.53241 -140.70768 817.82633
4260.0000 -149.43044 -142.26605 7.16439 2.42766 -142.33101 787.73769
4265.0000 -147.86876 -142.36490 5.50386 2.39010 -142.91301 762.72671
4270.0000 -148.84791 -143.89471 4.95320 2.34460 -143.61807 703.66470
4275.0000 -149.98882 -143.62328 6.36554 2.31882 -144.01762 700.22686
4280.0000 -149.52958 -144.00911 5.52047 2.31709 -144.04443 716.61728
4285.0000 -149.40278 -143.58644 5.81635 2.30137 -144.28800 710.46806
4290.0000 -150.51442 -144.29941 6.21500 2.31933 -144.00960 686.91492
4295.0000 -149.59005 -143.54368 6.04637 2.30885 -144.17205 699.34233
4300.0000 -149.36735 -143.77001 5.59735 2.33227 -143.80906 719.88179
4305.0000 -150.46261 -144.20394 6.25867 2.36920 -143.23679 731.07362
4310.0000 -148.23975 -142.49025 5.74950 2.36738 -143.26507 721.26744
4315.0000 -148.37692 -142.99248 5.38445 2.39270 -142.87268 741.20836
4320.0000 -150.14908 -143.33852 6.81055 2.36640 -143.28030 743.52810
4325.0000 -148.54948 -143.74201 4.80748 2.30865 -144.17507 689.09097
4330.0000 -149.13100 -143.24146 5.88955 2.35089 -143.52059 701.47603
4335.0000 -148.73016 -142.38369 6.34647 2.39754 -142.79765 754.88963
4340.0000 -148.19038 -142.05380 6.13659 2.41267 -142.56331 747.70253
4345.0000 -147.64264 -141.91358 5.72906 2.39925 -142.77119 760.35287
4350.0000 -149.15112 -142.41062 6.74050 2.42749 -142.33354 766.65375
4355.0000 -148.95272 -143.30024 5.65248 2.39147 -142.89181 734.45913
4360.0000 -148.77095 -142.22942 6.54154 2.37675 -143.11989 734.55740
4365.0000 -148.05132 -142.80854 5.24278 2.45818 -141.85806 807.08403
4370.0000 -149.73306 -143.50174 6.23132 2.38893 -142.93108 749.98296
4375.0000 -148.54462 -143.86813 4.67650 2.32913 -143.85775 715.47481
4380.0000 -149.78661 -143.96854 5.81807 2.30239 -144.27210 686.91751
4385.0000 -148.54188 -142.64094 5.90094 2.37564 -143.13709 758.44736
4390.0000 -148.74564 -141.94800 6.79764 2.43596 -142.20242 800.67963
4395.0000 -148.64498 -143.26386 5.38113 2.38509 -142.99062 748.73153
4400.0000 -149.54894 -143.25705 6.29190 2.37391 -143.16393 720.21945
4405.0000 -149.60206 -143.34515 6.25691 2.34711 -143.57923 723.80864
4410.0000 -149.58063 -143.52193 6.05871 2.35723 -143.42238 698.70421
4415.0000 -149.21297 -143.47615 5.73682 2.34709 -143.57953 714.53570
4420.0000 -149.62469 -143.13263 6.49207 2.36519 -143.29904 733.84678
4425.0000 -149.05656 -143.12887 5.92770 2.37202 -143.19321 781.54466
4430.0000 -148.69257 -143.74729 4.94528 2.34140 -143.66770 693.38972
4435.0000 -148.35543 -143.16995 5.18547 2.37612 -143.12955 687.42513
4440.0000 -149.70977 -143.54382 6.16595 2.39145 -142.89205 736.72093
4445.0000 -148.77734 -143.05681 5.72053 2.35846 -143.40330 732.18887
4450.0000 -149.74389 -144.19054 5.55335 2.36651 -143.27853 735.27862
4455.0000 -149.46037 -143.43026 6.03011 2.33199 -143.81343 704.59082
4460.0000 -149.61645 -143.64961 5.96683 2.37546 -143.13978 752.74883
4465.0000 -148.81546 -143.23188 5.58359 2.36689 -143.27259 753.79458
4470.0000 -147.18478 -140.25436 6.93042 2.52190 -140.87054 836.62276
4475.0000 -148.29676 -141.34091 6.95586 2.51944 -140.90869 838.63923
4480.0000 -148.30258 -142.94562 5.35697 2.42748 -142.33378 772.22400
4485.0000 -150.37983 -144.82127 5.55855 2.30154 -144.28534 676.82545
4490.0000 -150.31457 -144.93382 5.38075 2.28983 -144.46674 680.14518
4495.0000 -150.55979 -145.65275 4.90704 2.22537 -145.46571 635.60515
4500.0000 -149.39465 -143.35348 6.04117 2.30546 -144.22456 687.36954
FREEZING PROCESS: loop number 19 T-loop= 707.00000000000000
main_MD> interactions number 19 at Temperature= 707.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.30323 -0.32818 -0.94472
force_rgl> df(natom) 1.28869 0.56382 0.88531
4505.0000 -149.88262 -143.91319 5.96944 2.36222 -143.34500 743.17895
4510.0000 -148.49835 -143.86487 4.63348 2.37556 -143.13824 712.15556
4515.0000 -149.99743 -144.46197 5.53546 2.33677 -143.73946 692.25245
4520.0000 -148.22122 -143.17312 5.04810 2.32822 -143.87183 719.42261
4525.0000 -148.83480 -142.98353 5.85127 2.38358 -143.01395 725.44937
4530.0000 -149.66092 -144.01307 5.64784 2.37351 -143.17000 761.52403
4535.0000 -148.26925 -142.18817 6.08108 2.35643 -143.43477 731.11205
4540.0000 -148.67824 -141.82313 6.85511 2.43231 -142.25895 803.04406
4545.0000 -147.98412 -141.78921 6.19490 2.41918 -142.46241 784.44987
4550.0000 -150.56457 -145.14106 5.42350 2.33402 -143.78193 721.40169
4555.0000 -151.47187 -146.02027 5.45159 2.25292 -145.03879 670.69174
4560.0000 -151.20558 -146.62833 4.57725 2.19672 -145.90957 645.65352
4565.0000 -149.63220 -144.76113 4.87107 2.21244 -145.66594 625.09436
4570.0000 -149.99425 -144.99098 5.00328 2.24908 -145.09819 645.87575
4575.0000 -149.73381 -144.44470 5.28911 2.22710 -145.43887 610.86294
4580.0000 -151.05476 -145.94571 5.10906 2.25958 -144.93549 666.30499
4585.0000 -149.71324 -144.58878 5.12446 2.22979 -145.39715 642.22113
4590.0000 -149.55361 -143.65074 5.90287 2.31840 -144.02401 700.25849
4595.0000 -149.09359 -143.71332 5.38027 2.34782 -143.56809 704.36904
4600.0000 -149.32665 -143.97015 5.35651 2.37462 -143.15285 747.17482
4605.0000 -148.99044 -142.98764 6.00279 2.34223 -143.65473 707.34692
4610.0000 -148.20681 -143.23195 4.97486 2.41225 -142.56975 793.79716
4615.0000 -149.04499 -144.15997 4.88503 2.37483 -143.14955 770.84996
4620.0000 -150.27814 -144.68192 5.59622 2.28990 -144.46570 651.90389
4625.0000 -149.23401 -143.17859 6.05542 2.30526 -144.22769 679.00698
4630.0000 -148.76015 -143.48712 5.27303 2.33610 -143.74975 695.07713
4635.0000 -149.05474 -143.68622 5.36852 2.32326 -143.94869 679.27089
4640.0000 -148.70530 -142.71052 5.99478 2.38330 -143.01829 700.79445
4645.0000 -150.45853 -143.75408 6.70445 2.39887 -142.77712 749.38580
4650.0000 -149.16768 -143.73088 5.43680 2.34128 -143.66954 715.04320
4655.0000 -150.00348 -143.78041 6.22307 2.34532 -143.60695 723.68307
4660.0000 -150.24750 -144.17417 6.07333 2.35658 -143.43236 712.64386
4665.0000 -148.87475 -143.10317 5.77158 2.33238 -143.80746 677.06534
4670.0000 -148.73088 -143.38998 5.34089 2.41854 -142.47229 750.13670
4675.0000 -149.92482 -143.47873 6.44609 2.35093 -143.51992 705.90592
4680.0000 -149.75587 -143.84281 5.91305 2.37559 -143.13788 740.61090
4685.0000 -150.26029 -145.30046 4.95983 2.29713 -144.35359 700.04806
4690.0000 -149.40855 -144.95829 4.45026 2.24396 -145.17753 663.80144
4695.0000 -150.30790 -145.17958 5.12832 2.23923 -145.25094 667.20580
4700.0000 -150.05141 -145.04601 5.00540 2.27112 -144.75671 678.29571
4705.0000 -150.47187 -144.50650 5.96537 2.27141 -144.75216 691.89345
4710.0000 -149.33167 -143.89756 5.43411 2.29815 -144.33777 704.20049
4715.0000 -148.12903 -143.01610 5.11293 2.36750 -143.26314 732.51855
4720.0000 -148.82712 -143.24671 5.58041 2.38793 -142.94657 745.08890
4725.0000 -149.17730 -143.20957 5.96773 2.38987 -142.91652 735.68255
4730.0000 -149.59764 -143.80081 5.79683 2.40980 -142.60765 766.24236
4735.0000 -148.98361 -143.23263 5.75098 2.33502 -143.76647 679.10568
4740.0000 -148.80890 -144.41644 4.39246 2.34726 -143.57690 683.89596
4745.0000 -149.38129 -144.00739 5.37390 2.33075 -143.83270 687.91102
4750.0000 -149.25982 -143.89736 5.36246 2.35970 -143.38409 746.96419
FREEZING PROCESS: loop number 20 T-loop= 682.00000000000000
main_MD> interactions number 20 at Temperature= 682.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -2.34315 0.01802 -1.40824
force_rgl> df(natom) 2.13329 1.47570 -0.34079
4755.0000 -148.86812 -143.20415 5.66397 2.35120 -143.51577 738.49513
4760.0000 -148.29643 -143.10444 5.19199 2.35499 -143.45709 722.58833
4765.0000 -149.30398 -143.96778 5.33621 2.34257 -143.64946 690.32115
4770.0000 -147.95699 -142.48399 5.47300 2.37035 -143.21905 710.48401
4775.0000 -148.98006 -143.92130 5.05877 2.39019 -142.91156 760.29564
4780.0000 -150.11408 -144.08654 6.02755 2.31994 -144.00012 722.30865
4785.0000 -149.75897 -143.80111 5.95786 2.29722 -144.35220 705.33671
4790.0000 -149.10988 -143.71091 5.39898 2.31812 -144.02841 705.14702
4795.0000 -148.87846 -143.09188 5.78657 2.40484 -142.68458 757.95340
4800.0000 -148.59377 -143.39349 5.20028 2.36414 -143.31532 731.16425
4805.0000 -149.88420 -144.50752 5.37668 2.35944 -143.38814 725.42628
4810.0000 -149.67836 -143.89396 5.78439 2.29186 -144.43533 690.97692
4815.0000 -148.93308 -143.92363 5.00945 2.29823 -144.33666 696.48542
4820.0000 -149.78632 -144.45165 5.33467 2.30161 -144.28426 695.95700
4825.0000 -149.03091 -143.38167 5.64924 2.31306 -144.10679 680.11175
4830.0000 -150.33340 -145.05820 5.27520 2.30268 -144.26766 642.17422
4835.0000 -149.91185 -144.90230 5.00956 2.24596 -145.14652 627.52116
4840.0000 -150.29777 -144.22553 6.07224 2.28419 -144.55424 680.14301
4845.0000 -149.32991 -143.93405 5.39587 2.30618 -144.21346 689.78784
4850.0000 -149.96784 -145.20422 4.76362 2.30811 -144.18346 675.13023
4855.0000 -150.21584 -144.35457 5.86127 2.26810 -144.80343 684.93329
4860.0000 -150.34718 -144.28731 6.05987 2.29337 -144.41199 685.99127
4865.0000 -149.68690 -144.80288 4.88402 2.24923 -145.09597 654.41112
4870.0000 -149.43198 -144.11694 5.31504 2.27574 -144.68509 671.42400
4875.0000 -149.90832 -143.87211 6.03620 2.33311 -143.79613 727.11427
4880.0000 -149.07962 -143.11287 5.96676 2.38237 -143.03273 740.35834
4885.0000 -148.90789 -142.94017 5.96772 2.34068 -143.67877 711.27819
4890.0000 -149.39024 -144.17812 5.21212 2.33633 -143.74622 675.88177
4895.0000 -149.70226 -144.33926 5.36300 2.29618 -144.36837 675.97289
4900.0000 -150.39266 -145.54874 4.84392 2.26386 -144.86928 675.98888
4905.0000 -150.06214 -145.14739 4.91476 2.22718 -145.43754 628.16666
4910.0000 -149.68089 -144.05898 5.62192 2.27690 -144.66707 648.14530
4915.0000 -148.41565 -143.17108 5.24457 2.33528 -143.76243 683.29220
4920.0000 -149.43604 -144.25989 5.17616 2.36745 -143.26404 732.55083
4925.0000 -150.65492 -143.85870 6.79622 2.29444 -144.39527 681.65370
4930.0000 -149.15707 -143.74988 5.40719 2.31991 -144.00058 709.27252
4935.0000 -150.33308 -144.01839 6.31469 2.36114 -143.36181 741.15081
4940.0000 -149.69206 -143.68013 6.01193 2.36568 -143.29144 747.19603
4945.0000 -150.01669 -145.21063 4.80606 2.32523 -143.91827 701.46127
4950.0000 -150.04238 -143.96432 6.07806 2.27936 -144.62903 691.76454
4955.0000 -149.46799 -144.11016 5.35783 2.28216 -144.58562 652.02929
4960.0000 -150.04862 -143.69279 6.35583 2.30653 -144.20793 678.88952
4965.0000 -149.67761 -143.61567 6.06194 2.38005 -143.06873 735.76490
4970.0000 -149.26505 -144.04886 5.21619 2.37081 -143.21187 721.26702
4975.0000 -150.17888 -144.28182 5.89706 2.30649 -144.20854 709.71756
4980.0000 -149.19222 -144.57912 4.61310 2.28086 -144.60572 685.72350
4985.0000 -149.37661 -144.42919 4.94742 2.28414 -144.55494 670.68753
4990.0000 -150.42861 -145.09315 5.33545 2.27587 -144.68316 680.31434
4995.0000 -149.37793 -143.82156 5.55638 2.29455 -144.39363 689.23364
5000.0000 -149.32296 -143.47878 5.84419 2.38078 -143.05748 752.41509
FREEZING PROCESS: loop number 21 T-loop= 657.00000000000000
main_MD> interactions number 21 at Temperature= 657.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.62869 3.03380 -2.65876
force_rgl> df(natom) -1.93663 0.09965 1.65689
5005.0000 -150.53923 -145.50841 5.03082 2.29682 -144.35838 697.53983
5010.0000 -150.80562 -145.23280 5.57282 2.24050 -145.23126 670.35676
5015.0000 -150.90875 -145.86384 5.04490 2.19639 -145.91467 626.39196
5020.0000 -149.90078 -144.42980 5.47098 2.22104 -145.53271 607.25676
5025.0000 -150.37900 -145.22315 5.15585 2.28933 -144.47454 659.06152
5030.0000 -149.32932 -144.36860 4.96073 2.25467 -145.01163 641.79707
5035.0000 -149.43276 -144.60789 4.82487 2.28775 -144.49894 628.79199
5040.0000 -149.27393 -144.55010 4.72383 2.25275 -145.04133 631.00863
5045.0000 -149.35385 -143.10793 6.24592 2.32059 -143.99014 707.10209
5050.0000 -150.11951 -144.87919 5.24032 2.31141 -144.13232 661.52545
5055.0000 -150.38235 -145.44872 4.93363 2.26464 -144.85708 636.89458
5060.0000 -149.74861 -144.62751 5.12110 2.21470 -145.63100 587.13188
5065.0000 -149.45413 -143.75374 5.70039 2.31687 -144.04769 688.02068
5070.0000 -151.02806 -145.07143 5.95663 2.29848 -144.33275 710.63390
5075.0000 -150.63351 -145.50336 5.13015 2.21178 -145.67626 618.94020
5080.0000 -149.86901 -145.13387 4.73514 2.20282 -145.81511 640.79946
5085.0000 -149.92123 -144.52030 5.40093 2.24286 -145.19469 648.88992
5090.0000 -150.21729 -145.21651 5.00078 2.27749 -144.65796 676.16013
5095.0000 -149.79332 -143.93594 5.85738 2.26708 -144.81925 667.63911
5100.0000 -149.97372 -143.93132 6.04240 2.33961 -143.69546 734.34065
5105.0000 -149.20209 -144.01323 5.18886 2.32515 -143.91947 693.97243
5110.0000 -149.78257 -144.71179 5.07077 2.30901 -144.16963 704.01554
5115.0000 -150.98060 -145.73813 5.24247 2.28035 -144.61371 690.54392
5120.0000 -150.10933 -143.95417 6.15517 2.29860 -144.33084 691.29185
5125.0000 -149.96865 -144.74824 5.22041 2.31277 -144.11136 672.22557
5130.0000 -150.07879 -144.86791 5.21088 2.28779 -144.49839 697.48240
5135.0000 -150.02509 -144.92365 5.10145 2.28560 -144.53230 679.57522
5140.0000 -149.73005 -144.16755 5.56250 2.30054 -144.30086 654.92955
5145.0000 -151.29032 -146.20101 5.08932 2.22676 -145.44416 628.98365
5150.0000 -150.22410 -146.07649 4.14762 2.22086 -145.53546 641.07773
5155.0000 -150.36041 -144.52693 5.83347 2.22040 -145.54272 610.27430
5160.0000 -151.27392 -146.12941 5.14451 2.24898 -145.09975 649.64917
5165.0000 -151.08183 -146.46764 4.61418 2.17767 -146.20483 641.97150
5170.0000 -150.07962 -144.95172 5.12791 2.18228 -146.13342 610.34129
5175.0000 -150.54217 -145.14260 5.39956 2.26415 -144.86469 673.97554
5180.0000 -150.74981 -144.86200 5.88781 2.29905 -144.32395 696.52042
5185.0000 -151.32970 -145.58124 5.74846 2.26391 -144.86848 680.55935
5190.0000 -150.37470 -145.24081 5.13390 2.25848 -144.95250 677.86837
5195.0000 -149.71284 -144.75303 4.95981 2.24642 -145.13943 633.83992
5200.0000 -148.51993 -143.08782 5.43210 2.29333 -144.41261 677.51958
5205.0000 -149.42637 -144.09653 5.32984 2.36304 -143.33230 727.14717
5210.0000 -150.67107 -145.73662 4.93445 2.23627 -145.29680 627.02734
5215.0000 -151.06921 -146.11830 4.95091 2.16145 -146.45610 562.28699
5220.0000 -149.85438 -144.96052 4.89386 2.20591 -145.76726 604.12489
5225.0000 -150.98249 -145.50498 5.47751 2.22336 -145.49675 631.88185
5230.0000 -151.06847 -145.30964 5.75883 2.25912 -144.94260 692.05429
5235.0000 -149.57294 -144.02796 5.54498 2.27498 -144.69693 680.11626
5240.0000 -150.14350 -144.91038 5.23312 2.28574 -144.53009 651.36649
5245.0000 -149.11799 -144.36519 4.75280 2.27394 -144.71295 675.09504
5250.0000 -149.88626 -144.89631 4.98995 2.31443 -144.08551 715.92498
FREEZING PROCESS: loop number 22 T-loop= 632.00000000000000
main_MD> interactions number 22 at Temperature= 632.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.56288 0.28931 0.44637
force_rgl> df(natom) 3.74583 -0.17449 1.46241
5255.0000 -150.49770 -145.00824 5.48945 2.29805 -144.33935 683.30205
5260.0000 -150.54193 -145.37754 5.16438 2.22772 -145.42926 632.20216
5265.0000 -150.72060 -146.06855 4.65204 2.21909 -145.56300 635.54755
5270.0000 -149.89800 -144.94979 4.94821 2.24111 -145.22175 660.10472
5275.0000 -151.46783 -146.44259 5.02524 2.19045 -146.00681 631.10622
5280.0000 -150.15738 -145.45564 4.70174 2.21765 -145.58531 635.62254
5285.0000 -150.67622 -145.94047 4.73575 2.20585 -145.76818 642.24397
5290.0000 -149.73025 -145.42014 4.31011 2.21570 -145.61545 654.39158
5295.0000 -150.24739 -146.08467 4.16272 2.25677 -144.97902 676.62421
5300.0000 -150.44049 -144.77472 5.66577 2.20335 -145.80689 645.47630
5305.0000 -149.71137 -145.20071 4.51066 2.26364 -144.87263 656.74850
5310.0000 -150.03425 -145.97532 4.05893 2.19607 -145.91966 604.92281
5315.0000 -151.69142 -146.18599 5.50543 2.18625 -146.07191 595.51366
5320.0000 -150.74795 -145.94680 4.80115 2.16971 -146.32809 616.09064
5325.0000 -150.77214 -145.84912 4.92302 2.20105 -145.84253 612.76949
5330.0000 -149.09432 -143.96334 5.13098 2.25726 -144.97155 646.37390
5335.0000 -149.80020 -143.93389 5.86631 2.29347 -144.41033 698.06899
5340.0000 -150.36890 -144.99423 5.37467 2.25691 -144.97691 655.24067
5345.0000 -150.82886 -145.88641 4.94245 2.24493 -145.16255 634.55797
5350.0000 -150.67633 -146.42038 4.25595 2.16560 -146.39181 580.02031
5355.0000 -150.35614 -145.19887 5.15727 2.21664 -145.60098 623.62635
5360.0000 -150.60859 -145.31409 5.29450 2.22648 -145.44848 627.44451
5365.0000 -150.51530 -146.29087 4.22443 2.23335 -145.34194 643.58307
5370.0000 -150.90557 -145.82425 5.08132 2.17065 -146.31361 582.62299
5375.0000 -151.68127 -145.57059 6.11068 2.21381 -145.64471 635.79498
5380.0000 -150.68927 -145.30756 5.38171 2.23037 -145.38821 632.84289
5385.0000 -149.99757 -145.90753 4.09004 2.22009 -145.54740 613.91714
5390.0000 -151.21440 -145.90616 5.30823 2.24056 -145.23020 632.82457
5395.0000 -150.31360 -145.79587 4.51773 2.19934 -145.86897 610.44815
5400.0000 -150.34673 -145.60046 4.74627 2.21111 -145.68662 619.26301
5405.0000 -150.41008 -145.80786 4.60222 2.20138 -145.83742 614.82290
5410.0000 -150.70481 -145.73026 4.97455 2.17328 -146.27279 585.17604
5415.0000 -151.17466 -146.40346 4.77120 2.21101 -145.68814 605.44605
5420.0000 -151.16725 -146.88115 4.28610 2.14347 -146.73472 589.80311
5425.0000 -150.38605 -146.30840 4.07764 2.16214 -146.44550 603.74490
5430.0000 -150.81829 -145.76969 5.04860 2.15178 -146.60607 602.24515
5435.0000 -152.19881 -147.02557 5.17324 2.18765 -146.05018 637.08165
5440.0000 -149.48599 -145.06624 4.41976 2.20018 -145.85593 617.67126
5445.0000 -151.18169 -145.26184 5.91985 2.24559 -145.15229 638.42065
5450.0000 -150.66405 -146.09677 4.56728 2.21164 -145.67840 608.78997
5455.0000 -151.31015 -147.26523 4.04491 2.13506 -146.86510 573.74797
5460.0000 -150.09707 -145.91030 4.18677 2.15721 -146.52183 567.87771
5465.0000 -150.24327 -145.34337 4.89990 2.22149 -145.52571 627.07141
5470.0000 -150.99842 -145.29822 5.70019 2.25512 -145.00459 647.62654
5475.0000 -150.80717 -145.30620 5.50096 2.24950 -145.09165 668.64577
5480.0000 -150.02384 -145.70507 4.31877 2.20495 -145.78204 621.57876
5485.0000 -150.37813 -145.37447 5.00366 2.21120 -145.68530 613.10433
5490.0000 -149.34566 -145.08564 4.26002 2.24598 -145.14630 631.59621
5495.0000 -148.69363 -143.98350 4.71013 2.30080 -144.29677 677.28287
5500.0000 -150.33551 -145.60863 4.72688 2.23816 -145.26739 645.86534
FREEZING PROCESS: loop number 23 T-loop= 607.00000000000000
main_MD> interactions number 23 at Temperature= 607.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 5.87474 -4.51353 6.89191
force_rgl> df(natom) 0.39190 -0.03854 0.66503
5505.0000 -150.54137 -145.58446 4.95691 2.23446 -145.32481 646.92892
5510.0000 -150.88093 -146.08584 4.79509 2.16650 -146.37787 591.61073
5515.0000 -150.65527 -146.02904 4.62623 2.19705 -145.90453 601.18008
5520.0000 -150.51048 -145.77043 4.74005 2.20837 -145.72909 612.60810
5525.0000 -150.28543 -145.60007 4.68535 2.21174 -145.67678 613.84394
5530.0000 -150.83071 -146.42637 4.40434 2.17569 -146.23556 609.11891
5535.0000 -151.49088 -146.12605 5.36483 2.18016 -146.16623 617.00167
5540.0000 -151.63115 -146.11216 5.51900 2.16214 -146.44540 600.03500
5545.0000 -149.95203 -145.18222 4.76980 2.19917 -145.87163 620.84792
5550.0000 -149.86127 -144.58250 5.27877 2.23825 -145.26602 640.54356
5555.0000 -151.26612 -146.25696 5.00916 2.23184 -145.36537 651.81659
5560.0000 -151.80301 -146.28176 5.52125 2.19178 -145.98621 617.88478
5565.0000 -150.66371 -146.24494 4.41877 2.16217 -146.44502 597.19556
5570.0000 -151.00140 -145.84953 5.15187 2.19923 -145.87073 638.00611
5575.0000 -150.62000 -146.04398 4.57601 2.20246 -145.82065 617.36830
5580.0000 -151.55369 -146.52437 5.02932 2.18063 -146.15900 621.89676
5585.0000 -151.06694 -146.49520 4.57174 2.15409 -146.57013 579.42976
5590.0000 -150.21049 -145.60533 4.60516 2.19625 -145.91694 607.01022
5595.0000 -150.79638 -146.44630 4.35008 2.19390 -145.95333 628.62545
5600.0000 -150.61415 -146.43535 4.17880 2.17570 -146.23535 606.12527
5605.0000 -151.88211 -147.40392 4.47819 2.12754 -146.98163 571.62602
5610.0000 -151.96406 -146.98313 4.98093 2.13221 -146.90930 623.31669
5615.0000 -151.34895 -146.35634 4.99261 2.16340 -146.42593 626.47919
5620.0000 -151.02050 -146.97894 4.04156 2.16828 -146.35025 627.84240
5625.0000 -151.14617 -145.85145 5.29472 2.12840 -146.96827 586.10666
5630.0000 -151.84091 -146.67445 5.16646 2.20211 -145.82606 648.65597
5635.0000 -150.73348 -146.19795 4.53554 2.19451 -145.94390 623.02770
5640.0000 -151.07714 -145.73068 5.34645 2.18467 -146.09634 596.29619
5645.0000 -149.74953 -144.96735 4.78218 2.23807 -145.26888 625.03800
5650.0000 -150.47324 -145.24662 5.22662 2.24367 -145.18204 636.08151
5655.0000 -150.15958 -144.84207 5.31752 2.27015 -144.77168 686.06495
5660.0000 -150.33664 -145.50015 4.83648 2.23507 -145.31527 631.23201
5665.0000 -149.72509 -144.84747 4.87762 2.20216 -145.82524 605.53241
5670.0000 -150.13012 -145.24769 4.88243 2.25622 -144.98759 647.49604
5675.0000 -151.00324 -145.96027 5.04297 2.21860 -145.57048 622.29749
5680.0000 -151.36448 -145.14997 6.21450 2.21919 -145.56134 632.57545
5685.0000 -149.30070 -144.98492 4.31578 2.23227 -145.35875 660.37208
5690.0000 -150.83169 -145.50511 5.32658 2.27773 -144.65422 688.27623
5695.0000 -151.48858 -146.46476 5.02382 2.17628 -146.22640 591.21492
5700.0000 -150.17714 -144.98105 5.19609 2.22130 -145.52866 647.50416
5705.0000 -150.20976 -145.58951 4.62025 2.26408 -144.86577 675.97020
5710.0000 -151.22930 -146.20005 5.02925 2.22511 -145.46965 656.59825
5715.0000 -150.71016 -145.00447 5.70569 2.20558 -145.77227 631.80101
5720.0000 -151.33907 -146.91062 4.42844 2.19365 -145.95714 646.09931
5725.0000 -151.58782 -146.61803 4.96978 2.13286 -146.89915 588.58332
5730.0000 -151.62068 -146.29566 5.32501 2.16328 -146.42781 606.19020
5735.0000 -151.49802 -146.45569 5.04233 2.16576 -146.38939 623.37611
5740.0000 -151.68245 -147.44256 4.23989 2.14839 -146.65845 574.69735
5745.0000 -151.36173 -146.81535 4.54639 2.13195 -146.91335 579.69418
5750.0000 -150.91378 -146.38793 4.52585 2.13654 -146.84210 587.65184
FREEZING PROCESS: loop number 24 T-loop= 582.00000000000000
main_MD> interactions number 24 at Temperature= 582.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.90918 2.50755 -0.19150
force_rgl> df(natom) 1.99058 0.53588 -0.82387
5755.0000 -151.08206 -146.14854 4.93352 2.16482 -146.40399 577.91178
5760.0000 -150.96586 -146.30644 4.65942 2.16786 -146.35676 623.32317
5765.0000 -151.53568 -146.68987 4.84581 2.16286 -146.43428 594.31172
5770.0000 -151.68284 -146.82925 4.85359 2.15381 -146.57460 579.79622
5775.0000 -151.06571 -146.44759 4.61812 2.13637 -146.84479 565.57872
5780.0000 -151.39375 -147.22755 4.16619 2.13787 -146.82161 573.22697
5785.0000 -151.61788 -146.91366 4.70422 2.12710 -146.98842 547.04438
5790.0000 -152.84457 -148.05802 4.78655 2.10211 -147.37574 601.47147
5795.0000 -151.98090 -148.20467 3.77623 2.07925 -147.72985 559.80221
5800.0000 -151.87278 -147.68913 4.18365 2.07304 -147.82612 547.52891
5805.0000 -151.53339 -146.69906 4.83433 2.10941 -147.26259 581.59105
5810.0000 -151.39203 -146.72946 4.66258 2.17531 -146.24136 624.14596
5815.0000 -151.79645 -146.67607 5.12038 2.12635 -146.99998 573.03725
5820.0000 -151.63831 -147.14359 4.49472 2.10845 -147.27747 564.86930
5825.0000 -152.16323 -147.60227 4.56096 2.10204 -147.37677 598.20538
5830.0000 -152.14598 -146.90227 5.24371 2.12334 -147.04675 619.12221
5835.0000 -152.24624 -147.73292 4.51332 2.07490 -147.79739 557.70478
5840.0000 -152.24848 -147.20820 5.04028 2.09607 -147.46933 573.64360
5845.0000 -152.16127 -148.04680 4.11447 2.07938 -147.72791 573.59829
5850.0000 -152.04487 -146.85274 5.19213 2.10444 -147.33955 592.94107
5855.0000 -151.55133 -147.77040 3.78093 2.09957 -147.41500 560.50844
5860.0000 -150.49581 -146.15958 4.33623 2.10546 -147.32374 556.66775
5865.0000 -150.96713 -146.35336 4.61377 2.18973 -146.01796 581.92891
5870.0000 -151.23147 -146.26979 4.96169 2.21297 -145.65787 612.47021
5875.0000 -150.16704 -145.29773 4.86931 2.23636 -145.29529 616.58446
5880.0000 -150.80104 -146.13708 4.66396 2.20491 -145.78262 604.61406
5885.0000 -150.82600 -146.27868 4.54732 2.19032 -146.00882 595.88451
5890.0000 -151.79120 -147.10872 4.68248 2.14605 -146.69478 583.73487
5895.0000 -152.94812 -148.16305 4.78507 2.09470 -147.49045 574.16282
5900.0000 -152.89380 -148.01723 4.87657 2.02366 -148.59137 529.23831
5905.0000 -152.09799 -146.88466 5.21333 2.07656 -147.77155 553.01731
5910.0000 -152.65544 -148.07613 4.57931 2.11944 -147.10712 596.99298
5915.0000 -153.37085 -149.27407 4.09678 1.99462 -149.04140 517.12827
5920.0000 -152.45941 -147.12360 5.33582 2.02613 -148.55305 548.24622
5925.0000 -151.27226 -146.33413 4.93813 2.12832 -146.96946 607.22163
5930.0000 -151.87723 -147.17789 4.69934 2.10578 -147.31883 573.18353
5935.0000 -151.87308 -147.16959 4.70349 2.09393 -147.50241 541.21430
5940.0000 -150.47047 -147.19744 3.27303 2.10220 -147.37427 546.86344
5945.0000 -151.72148 -147.32975 4.39173 2.12875 -146.96284 583.35624
5950.0000 -151.46797 -146.91282 4.55516 2.10326 -147.35784 563.15746
5955.0000 -151.42610 -146.89058 4.53552 2.14196 -146.75810 594.77650
5960.0000 -151.34740 -146.16046 5.18695 2.17334 -146.27194 634.43794
5965.0000 -152.10840 -148.30222 3.80618 2.10664 -147.30549 565.01710
5970.0000 -151.73231 -147.78127 3.95104 2.09468 -147.49086 555.34203
5975.0000 -150.90562 -146.98551 3.92012 2.10949 -147.26132 568.77153
5980.0000 -150.99555 -147.12892 3.86663 2.15052 -146.62551 578.04865
5985.0000 -151.88268 -147.90060 3.98208 2.11452 -147.18341 556.01489
5990.0000 -151.50584 -147.10513 4.40071 2.12462 -147.02683 549.61365
5995.0000 -152.11397 -147.42215 4.69181 2.09687 -147.45682 545.61937
6000.0000 -151.91307 -147.34215 4.57093 2.06396 -147.96683 551.51907
FREEZING PROCESS: loop number 25 T-loop= 557.00000000000000
main_MD> interactions number 25 at Temperature= 557.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.95434 1.31272 4.33037
force_rgl> df(natom) -0.00743 0.01502 -2.03939
6005.0000 -152.65259 -148.48950 4.16309 2.07343 -147.82018 574.14746
6010.0000 -152.22606 -147.89503 4.33102 2.06084 -148.01516 527.72662
6015.0000 -152.44577 -147.45773 4.98803 2.11591 -147.16185 600.13522
6020.0000 -152.49146 -148.72119 3.77027 2.08070 -147.70739 565.98365
6025.0000 -151.70301 -147.45474 4.24827 2.04617 -148.24253 540.48830
6030.0000 -152.07320 -147.42341 4.64979 2.06324 -147.97800 529.79319
6035.0000 -152.19125 -148.64721 3.54404 2.05428 -148.11684 525.33353
6040.0000 -153.03853 -148.28082 4.75772 2.04586 -148.24740 553.79742
6045.0000 -152.44069 -148.36296 4.07773 2.03885 -148.35592 556.21116
6050.0000 -153.26037 -148.77606 4.48431 2.04271 -148.29621 566.85688
6055.0000 -152.54078 -148.27958 4.26120 2.02031 -148.64319 527.36357
6060.0000 -152.89531 -148.35855 4.53676 2.03694 -148.38562 527.38542
6065.0000 -151.82585 -147.81018 4.01567 2.07033 -147.86821 549.64858
6070.0000 -152.51920 -148.03664 4.48256 2.08157 -147.69399 539.66571
6075.0000 -151.73499 -146.49488 5.24011 2.09915 -147.42161 517.38130
6080.0000 -152.11409 -147.29315 4.82093 2.13493 -146.86709 572.41286
6085.0000 -152.60526 -147.54750 5.05777 2.09698 -147.45514 544.16329
6090.0000 -151.08055 -147.42604 3.65451 2.09224 -147.52856 552.33423
6095.0000 -151.01646 -146.80355 4.21291 2.12091 -147.08436 544.19636
6100.0000 -152.07229 -147.84803 4.22426 2.10878 -147.27239 567.44998
6105.0000 -152.08900 -147.13691 4.95209 2.09531 -147.48112 572.22531
6110.0000 -151.25390 -146.24042 5.01348 2.13082 -146.93080 579.33705
6115.0000 -151.94311 -147.00750 4.93561 2.18339 -146.11609 626.55395
6120.0000 -151.87374 -147.70337 4.17037 2.11928 -147.10958 575.94849
6125.0000 -151.98680 -147.41742 4.56939 2.08443 -147.64966 537.77872
6130.0000 -150.45425 -146.01072 4.44353 2.14179 -146.76087 564.39886
6135.0000 -151.83042 -146.85259 4.97784 2.16993 -146.32468 579.63393
6140.0000 -150.45592 -145.76463 4.69130 2.17867 -146.18928 595.95816
6145.0000 -151.18438 -146.57595 4.60843 2.19040 -146.00751 603.21531
6150.0000 -151.04888 -146.31171 4.73717 2.14076 -146.77683 569.44401
6155.0000 -151.08672 -146.66844 4.41828 2.15850 -146.50185 604.57647
6160.0000 -151.25766 -146.48371 4.77395 2.15427 -146.56736 587.34712
6165.0000 -152.08420 -147.28852 4.79568 2.13733 -146.82989 588.36015
6170.0000 -152.17727 -147.66441 4.51286 2.09002 -147.56309 542.72149
6175.0000 -150.49755 -147.09447 3.40308 2.10701 -147.29978 545.21573
6180.0000 -151.96426 -147.22085 4.74341 2.11247 -147.21511 550.24659
6185.0000 -151.27355 -147.28515 3.98840 2.09701 -147.45478 555.24472
6190.0000 -151.19415 -147.14253 4.05162 2.09187 -147.53438 533.04458
6195.0000 -151.42312 -146.91167 4.51146 2.12074 -147.08699 542.69593
6200.0000 -151.53377 -146.71597 4.81780 2.17487 -146.24820 593.25946
6205.0000 -151.71655 -147.86759 3.84896 2.14135 -146.76757 570.96482
6210.0000 -150.84795 -145.92363 4.92433 2.11768 -147.13436 550.60058
6215.0000 -150.88871 -145.95830 4.93041 2.16006 -146.47767 603.47837
6220.0000 -151.73004 -147.69169 4.03835 2.14690 -146.68154 595.25172
6225.0000 -152.55787 -148.01086 4.54701 2.08275 -147.67569 556.51577
6230.0000 -152.08765 -147.26000 4.82765 2.12307 -147.05087 597.46806
6235.0000 -151.79790 -147.25585 4.54205 2.12186 -147.06962 575.14343
6240.0000 -151.78048 -147.87429 3.90619 2.05541 -148.09938 495.19351
6245.0000 -152.23146 -147.59785 4.63361 2.09374 -147.50538 576.90329
6250.0000 -151.21029 -146.26906 4.94123 2.11687 -147.14690 589.97643
FREEZING PROCESS: loop number 26 T-loop= 532.00000000000000
main_MD> interactions number 26 at Temperature= 532.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.90634 0.49791 -6.62548
force_rgl> df(natom) 0.57526 0.08996 6.96558
6255.0000 -152.53517 -147.96200 4.57317 2.10617 -147.31279 591.30684
6260.0000 -152.95111 -148.52875 4.42236 2.04349 -148.28401 537.78369
6265.0000 -152.81567 -148.72142 4.09426 2.01058 -148.79409 542.09353
6270.0000 -153.01170 -148.77560 4.23610 2.02996 -148.49379 522.04927
6275.0000 -153.14636 -148.91226 4.23410 2.00389 -148.89767 487.42802
6280.0000 -152.31994 -148.17066 4.14927 1.99351 -149.05853 495.71848
6285.0000 -152.20592 -148.25561 3.95031 2.02226 -148.61298 514.11387
6290.0000 -152.66600 -148.47682 4.18918 2.02369 -148.59091 530.77231
6295.0000 -153.32679 -148.40351 4.92328 1.97720 -149.31131 514.37154
6300.0000 -152.81215 -148.12827 4.68387 2.03634 -148.39484 544.67656
6305.0000 -153.33481 -149.01157 4.32324 2.05097 -148.16815 559.92294
6310.0000 -152.95573 -147.73210 5.22363 2.04479 -148.26396 572.29561
6315.0000 -152.09860 -147.16579 4.93280 2.09763 -147.44509 605.31402
6320.0000 -152.00272 -147.75270 4.25002 2.06621 -147.93191 573.28561
6325.0000 -152.47584 -148.07518 4.40066 2.03745 -148.37761 551.63225
6330.0000 -153.56910 -148.80098 4.76813 2.00480 -148.88361 531.59700
6335.0000 -152.85251 -148.81325 4.03926 2.00697 -148.84990 521.93357
6340.0000 -152.43175 -148.32462 4.10714 1.99946 -148.96637 492.95187
6345.0000 -151.88705 -148.46474 3.42231 2.03158 -148.46867 532.14956
6350.0000 -152.45334 -147.58370 4.86964 2.04032 -148.33312 541.51863
6355.0000 -152.36717 -147.43864 4.92853 2.08918 -147.57597 546.47906
6360.0000 -151.47040 -146.68639 4.78401 2.10119 -147.38999 540.90199
6365.0000 -152.18645 -148.05460 4.13184 2.09404 -147.50076 523.87256
6370.0000 -152.31242 -147.94405 4.36837 2.06753 -147.91156 507.76775
6375.0000 -151.73676 -147.55499 4.18178 2.07812 -147.74736 524.19111
6380.0000 -152.17323 -146.97291 5.20032 2.09704 -147.45423 547.09028
6385.0000 -152.22641 -147.23158 4.99483 2.08832 -147.58934 550.29939
6390.0000 -153.03070 -148.05558 4.97512 2.08679 -147.61302 547.68527
6395.0000 -152.64109 -148.58160 4.05949 2.03658 -148.39119 525.94781
6400.0000 -153.14299 -149.18838 3.95462 2.01350 -148.74879 507.05902
6405.0000 -153.56270 -149.86503 3.69766 1.95772 -149.61316 449.63468
6410.0000 -151.84326 -148.34378 3.49948 1.98504 -149.18987 472.30625
6415.0000 -152.47935 -148.39679 4.08255 2.04702 -148.22939 529.39147
6420.0000 -151.88607 -148.32691 3.55915 2.04250 -148.29946 533.78062
6425.0000 -152.09451 -148.42367 3.67084 2.09164 -147.53792 541.69178
6430.0000 -152.50664 -148.66622 3.84042 2.03580 -148.40321 512.14056
6435.0000 -152.94354 -148.46785 4.47569 2.02944 -148.50174 517.24607
6440.0000 -151.78783 -147.37014 4.41769 2.06417 -147.96358 545.28472
6445.0000 -151.71806 -147.97431 3.74375 2.08715 -147.60746 546.37548
6450.0000 -152.98874 -148.33610 4.65264 2.05147 -148.16038 536.48288
6455.0000 -152.04244 -147.63272 4.40972 2.05958 -148.03470 536.81617
6460.0000 -150.97404 -146.48679 4.48725 2.11746 -147.13776 554.26785
6465.0000 -151.43242 -147.20387 4.22855 2.12335 -147.04659 544.86292
6470.0000 -150.67266 -146.53038 4.14228 2.10965 -147.25877 538.34852
6475.0000 -151.56049 -147.68580 3.87469 2.13523 -146.86241 575.04070
6480.0000 -151.71049 -147.72898 3.98151 2.08859 -147.58521 544.61568
6485.0000 -151.49880 -147.50116 3.99764 2.09217 -147.52977 536.10996
6490.0000 -152.05057 -147.71705 4.33352 2.06505 -147.94996 515.85013
6495.0000 -151.80127 -148.14251 3.65876 2.07461 -147.80177 519.91648
6500.0000 -152.75116 -148.85279 3.89837 2.04037 -148.33235 497.18670
FREEZING PROCESS: loop number 27 T-loop= 507.00000000000000
main_MD> interactions number 27 at Temperature= 507.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.36405 2.26248 0.91631
force_rgl> df(natom) -0.63936 -1.65689 -1.71026
6505.0000 -152.61462 -148.95860 3.65601 2.01386 -148.74328 476.11759
6510.0000 -152.86912 -149.39775 3.47137 2.01883 -148.66623 480.55292
6515.0000 -151.98611 -148.66777 3.31834 1.98874 -149.13245 443.30528
6520.0000 -152.64076 -149.50106 3.13971 1.98647 -149.16761 462.04588
6525.0000 -153.53399 -150.03614 3.49786 1.94712 -149.77748 432.87067
6530.0000 -152.55642 -149.03439 3.52203 1.97574 -149.33398 456.04984
6535.0000 -152.83417 -148.82257 4.01160 1.99778 -148.99233 486.10176
6540.0000 -152.69333 -148.69356 3.99978 2.03737 -148.37886 498.44315
6545.0000 -152.32646 -148.86673 3.45973 2.02851 -148.51612 496.82670
6550.0000 -152.97066 -148.86416 4.10650 2.00550 -148.87270 475.57705
6555.0000 -152.51382 -149.14705 3.36677 2.02048 -148.64066 513.60562
6560.0000 -152.79853 -149.53716 3.26137 1.99540 -149.02925 513.80501
6565.0000 -153.75560 -150.18186 3.57373 1.91287 -150.30808 459.28477
6570.0000 -153.92624 -150.76502 3.16122 1.89463 -150.59083 434.64418
6575.0000 -153.89008 -150.47537 3.41471 1.90507 -150.42907 436.66672
6580.0000 -153.18537 -149.89762 3.28774 1.89825 -150.53464 426.56235
6585.0000 -152.87374 -148.76501 4.10872 2.00194 -148.92787 501.21029
6590.0000 -152.85394 -149.03818 3.81576 2.01225 -148.76808 499.12182
6595.0000 -151.94418 -147.81172 4.13247 2.03356 -148.43800 504.13371
6600.0000 -152.76941 -148.68559 4.08383 2.04422 -148.27267 514.12501
6605.0000 -152.12258 -148.19630 3.92628 2.02634 -148.54978 493.33348
6610.0000 -151.78814 -148.81840 2.96975 2.03197 -148.46250 489.57141
6615.0000 -152.47343 -148.36096 4.11247 2.04905 -148.19794 494.56512
6620.0000 -153.50261 -149.40517 4.09745 2.00781 -148.83689 509.26663
6625.0000 -153.50724 -150.35260 3.15464 1.96512 -149.49855 470.84566
6630.0000 -153.60194 -149.15545 4.44649 1.93358 -149.98723 449.31235
6635.0000 -153.16313 -148.91653 4.24660 1.98854 -149.13558 487.16189
6640.0000 -152.59436 -148.68896 3.90539 2.01472 -148.72981 510.02404
6645.0000 -152.96912 -148.95254 4.01658 2.01403 -148.74055 502.86764
6650.0000 -151.77377 -148.39701 3.37677 2.01224 -148.76825 491.12843
6655.0000 -152.14520 -148.03651 4.10869 2.03310 -148.44514 500.87888
6660.0000 -153.49421 -149.43725 4.05697 2.01142 -148.78104 487.81607
6665.0000 -152.99119 -148.59038 4.40081 1.97710 -149.31288 479.21348
6670.0000 -153.39471 -149.51050 3.88422 1.97553 -149.33711 485.21069
6675.0000 -152.57667 -148.98071 3.59596 1.96516 -149.49787 474.40513
6680.0000 -152.26446 -148.12066 4.14379 2.04373 -148.28035 535.70816
6685.0000 -153.22516 -148.82305 4.40211 2.03230 -148.45753 537.04867
6690.0000 -152.63158 -148.48570 4.14589 2.01038 -148.79718 526.92179
6695.0000 -153.32125 -148.67083 4.65041 2.01288 -148.75832 534.29903
6700.0000 -153.42192 -149.04852 4.37340 1.99062 -149.10340 515.79462
6705.0000 -153.08703 -149.16446 3.92257 2.01530 -148.72095 550.31927
6710.0000 -153.26699 -148.76817 4.49882 2.00454 -148.88759 535.62686
6715.0000 -152.43668 -148.03073 4.40595 2.06530 -147.94601 540.77122
6720.0000 -152.78274 -148.47432 4.30841 2.03888 -148.35552 525.46045
6725.0000 -151.28548 -147.53612 3.74935 2.05449 -148.11361 538.29438
6730.0000 -152.37382 -148.46071 3.91310 2.06786 -147.90639 533.30800
6735.0000 -152.72526 -148.78454 3.94072 2.01423 -148.73752 507.04324
6740.0000 -153.56195 -149.69938 3.86257 1.97975 -149.27176 475.45762
6745.0000 -152.44686 -148.72202 3.72484 1.96321 -149.52801 462.50381
6750.0000 -152.67458 -148.70253 3.97205 2.01478 -148.72891 516.98213
FREEZING PROCESS: loop number 28 T-loop= 482.00000000000000
main_MD> interactions number 28 at Temperature= 482.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.41267 -1.31512 0.29434
force_rgl> df(natom) 1.54232 2.86048 4.08482
6755.0000 -154.10568 -149.58761 4.51808 2.01267 -148.76161 535.72699
6760.0000 -153.76125 -150.16471 3.59654 1.94434 -149.82054 490.04372
6765.0000 -153.90069 -150.10221 3.79849 1.93300 -149.99625 468.45225
6770.0000 -153.07518 -149.07391 4.00127 1.94445 -149.81872 451.50931
6775.0000 -152.92850 -149.25619 3.67231 1.98421 -149.20271 498.02400
6780.0000 -153.44361 -149.85858 3.58504 1.95940 -149.58708 479.21077
6785.0000 -153.78998 -150.20058 3.58940 1.93200 -150.01172 449.60399
6790.0000 -152.82739 -148.78938 4.03801 1.95328 -149.68190 462.68726
6795.0000 -152.66274 -148.99361 3.66914 1.98449 -149.19838 472.16034
6800.0000 -152.55383 -148.56562 3.98822 2.03354 -148.43820 514.50822
6805.0000 -153.08095 -149.19085 3.89011 1.99311 -149.06474 496.57395
6810.0000 -153.31948 -148.98686 4.33261 1.99888 -148.97533 509.17333
6815.0000 -152.38600 -148.11826 4.26774 2.02278 -148.60502 520.34134
6820.0000 -152.66568 -149.41569 3.24999 2.01841 -148.67268 528.00176
6825.0000 -153.66427 -149.52492 4.13935 1.96829 -149.44941 493.96771
6830.0000 -153.82466 -149.53313 4.29154 1.96417 -149.51327 483.78579
6835.0000 -153.40661 -149.74517 3.66144 1.94027 -149.88356 471.11090
6840.0000 -153.26343 -149.77710 3.48632 1.94137 -149.86650 469.64788
6845.0000 -153.21039 -149.16268 4.04771 1.95371 -149.67531 482.85544
6850.0000 -152.86064 -149.53384 3.32680 2.00497 -148.88097 519.79914
6855.0000 -153.27765 -149.80141 3.47624 1.97005 -149.42206 492.34365
6860.0000 -152.87871 -149.18301 3.69570 1.95700 -149.62438 473.31135
6865.0000 -152.45368 -148.91213 3.54155 1.98834 -149.13861 480.66084
6870.0000 -152.46996 -149.43162 3.03834 1.99827 -148.98473 488.62433
6875.0000 -152.47812 -148.95945 3.51868 2.00065 -148.94788 468.29049
6880.0000 -152.49511 -148.93621 3.55890 2.01062 -148.79346 480.97770
6885.0000 -152.33460 -148.99779 3.33682 1.97969 -149.27273 434.43097
6890.0000 -153.06963 -148.63027 4.43936 2.00899 -148.81864 468.60880
6895.0000 -152.59442 -148.96111 3.63331 2.02690 -148.54121 495.46991
6900.0000 -152.87859 -148.81878 4.05981 2.02110 -148.63100 501.84063
6905.0000 -153.53714 -149.64926 3.88788 1.98327 -149.21715 486.72194
6910.0000 -152.76340 -149.70661 3.05679 1.96653 -149.47668 458.97735
6915.0000 -153.82389 -150.04832 3.77557 1.96435 -149.51037 442.14580
6920.0000 -153.40751 -149.25665 4.15086 1.93948 -149.89584 437.97033
6925.0000 -153.64212 -149.95032 3.69180 1.94380 -149.82885 451.84780
6930.0000 -152.76809 -149.01801 3.75008 1.98290 -149.22295 487.59349
6935.0000 -153.21339 -149.65219 3.56120 1.98008 -149.26663 477.95365
6940.0000 -153.49679 -150.20746 3.28933 1.93118 -150.02447 447.69580
6945.0000 -153.99719 -150.79760 3.19959 1.94106 -149.87125 454.85998
6950.0000 -154.11824 -150.16479 3.95345 1.90366 -150.45082 438.78586
6955.0000 -153.20621 -149.15442 4.05179 1.95808 -149.60763 484.89546
6960.0000 -153.74022 -150.14112 3.59910 1.93127 -150.02308 463.08800
6965.0000 -153.42158 -149.46281 3.95877 1.95202 -149.70142 481.77823
6970.0000 -154.09003 -150.19046 3.89957 1.91114 -150.33495 442.14901
6975.0000 -153.94711 -150.44973 3.49738 1.92279 -150.15438 449.54431
6980.0000 -154.04101 -150.30712 3.73389 1.90694 -150.40007 437.25091
6985.0000 -153.18704 -149.38807 3.79897 1.92617 -150.10209 456.31978
6990.0000 -153.59133 -150.49504 3.09630 1.93618 -149.94696 458.17468
6995.0000 -153.30522 -149.82216 3.48306 1.92106 -150.18126 460.22579
7000.0000 -153.83053 -149.48796 4.34257 1.97047 -149.41558 508.29219
FREEZING PROCESS: loop number 29 T-loop= 457.00000000000000
main_MD> interactions number 29 at Temperature= 457.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.46247 -2.47774 2.07016
force_rgl> df(natom) -0.97838 -0.41966 -0.28060
7005.0000 -154.21785 -150.57678 3.64107 1.92500 -150.12017 469.51627
7010.0000 -153.69251 -150.61181 3.08069 1.89566 -150.57488 437.57011
7015.0000 -153.63851 -150.01471 3.62381 1.90431 -150.44075 444.23504
7020.0000 -154.21816 -150.48377 3.73439 1.89363 -150.60631 438.85859
7025.0000 -153.62189 -149.82143 3.80046 1.91181 -150.32456 453.60357
7030.0000 -153.24282 -149.45970 3.78313 1.95608 -149.63849 481.65592
7035.0000 -154.07634 -150.85630 3.22004 1.89815 -150.53630 444.70567
7040.0000 -153.34099 -149.23182 4.10917 1.91084 -150.33957 459.38161
7045.0000 -153.99892 -150.17187 3.82705 1.94776 -149.76749 496.54689
7050.0000 -153.65257 -150.08418 3.56839 1.92243 -150.16001 478.11798
7055.0000 -153.65309 -150.25625 3.39684 1.91126 -150.33307 471.73118
7060.0000 -154.39932 -151.18920 3.21012 1.89650 -150.56181 452.36668
7065.0000 -153.98809 -150.32381 3.66428 1.90408 -150.44435 459.44291
7070.0000 -154.38999 -150.88038 3.50960 1.89602 -150.56922 451.36936
7075.0000 -153.95008 -150.45627 3.49380 1.88206 -150.78552 438.82117
7080.0000 -153.67366 -150.46559 3.20807 1.90116 -150.48965 440.29162
7085.0000 -154.43746 -150.92074 3.51672 1.87213 -150.93947 426.17269
7090.0000 -154.01982 -150.17568 3.84413 1.90647 -150.40731 443.91905
7095.0000 -152.97819 -149.12647 3.85172 1.94973 -149.73692 490.82781
7100.0000 -154.06392 -150.16728 3.89664 1.94800 -149.76383 479.00592
7105.0000 -153.76944 -149.95716 3.81228 1.93549 -149.95762 461.14760
7110.0000 -153.64115 -149.18801 4.45314 1.94890 -149.74987 485.59954
7115.0000 -153.92279 -150.60432 3.31847 1.91599 -150.25982 456.89004
7120.0000 -154.10661 -150.49397 3.61264 1.89939 -150.51702 440.49025
7125.0000 -154.37884 -150.26904 4.10980 1.88472 -150.74429 434.22653
7130.0000 -153.98251 -150.25426 3.72825 1.91582 -150.26247 460.01514
7135.0000 -154.66067 -151.08172 3.57894 1.88155 -150.79353 428.72501
7140.0000 -153.36448 -149.96800 3.39648 1.90790 -150.38513 451.66592
7145.0000 -153.64325 -149.99842 3.64483 1.92229 -150.16212 452.84320
7150.0000 -153.49209 -150.22572 3.26637 1.92687 -150.09118 459.35777
7155.0000 -153.91972 -150.48339 3.43633 1.90392 -150.44688 439.57287
7160.0000 -153.80642 -150.50252 3.30390 1.89427 -150.59633 441.15534
7165.0000 -153.88283 -150.60649 3.27634 1.89803 -150.53817 437.99428
7170.0000 -153.83854 -150.18689 3.65165 1.93227 -150.00753 477.54845
7175.0000 -154.08855 -150.20765 3.88090 1.92605 -150.10397 447.50935
7180.0000 -153.83624 -150.31946 3.51677 1.88716 -150.70651 431.36114
7185.0000 -153.39407 -149.93003 3.46404 1.92570 -150.10936 448.62017
7190.0000 -154.36599 -150.66487 3.70112 1.89760 -150.54478 431.00624
7195.0000 -154.63984 -151.38118 3.25866 1.89010 -150.66104 461.37780
7200.0000 -154.13241 -150.59394 3.53847 1.89527 -150.58080 465.70101
7205.0000 -153.62583 -151.07761 2.54822 1.89277 -150.61963 444.18932
7210.0000 -154.46189 -151.37541 3.08649 1.83577 -151.50282 380.30910
7215.0000 -154.08817 -150.59120 3.49696 1.86509 -151.04862 405.04627
7220.0000 -153.96486 -149.95464 4.01022 1.92109 -150.18072 456.43679
7225.0000 -153.50398 -149.56454 3.93944 1.95433 -149.66575 483.33498
7230.0000 -153.69506 -149.03209 4.66296 1.97742 -149.30784 489.75230
7235.0000 -152.54176 -149.65353 2.88823 1.96729 -149.46481 477.86555
7240.0000 -153.24425 -150.17984 3.06441 1.91967 -150.20270 441.48269
7245.0000 -153.62706 -149.37287 4.25419 1.94817 -149.76109 471.24849
7250.0000 -152.95713 -149.66331 3.29381 1.98389 -149.20762 493.28520
FREEZING PROCESS: loop number 30 T-loop= 432.00000000000000
main_MD> interactions number 30 at Temperature= 432.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -2.29189 -0.64708 -3.07120
force_rgl> df(natom) 0.61436 2.70385 0.17803
7255.0000 -153.39063 -149.66881 3.72182 1.94180 -149.85990 458.07530
7260.0000 -154.44733 -150.68851 3.75882 1.93786 -149.92088 474.39565
7265.0000 -154.71961 -150.62712 4.09249 1.88078 -150.80549 448.90524
7270.0000 -155.22125 -151.28729 3.93396 1.88486 -150.74213 452.23494
7275.0000 -154.68309 -151.53989 3.14320 1.85085 -151.26916 419.75212
7280.0000 -155.33645 -152.10852 3.22792 1.82661 -151.64485 397.77008
7285.0000 -155.28583 -151.74772 3.53811 1.83359 -151.53662 404.77145
7290.0000 -154.64451 -151.70791 2.93660 1.81213 -151.86924 387.94149
7295.0000 -155.26987 -152.59262 2.67725 1.80695 -151.94949 382.88676
7300.0000 -154.64364 -151.31197 3.33168 1.80239 -152.02009 375.83490
7305.0000 -154.74674 -151.37818 3.36856 1.87104 -150.95641 439.48185
7310.0000 -154.61260 -151.15377 3.45883 1.86018 -151.12456 429.25167
7315.0000 -154.67237 -151.84290 2.82947 1.84577 -151.34794 417.97859
7320.0000 -154.95888 -151.70560 3.25328 1.81963 -151.75301 391.73791
7325.0000 -154.51390 -150.77950 3.73440 1.85387 -151.22247 426.75205
7330.0000 -154.54218 -151.01829 3.52389 1.88736 -150.70345 457.00179
7335.0000 -154.58916 -150.68603 3.90313 1.89245 -150.62463 465.84774
7340.0000 -154.93517 -151.13695 3.79822 1.86630 -151.02985 436.56063
7345.0000 -154.30279 -151.36316 2.93963 1.85476 -151.20868 429.64979
7350.0000 -155.06662 -151.61540 3.45122 1.84302 -151.39055 417.37005
7355.0000 -153.80633 -150.11288 3.69344 1.87572 -150.88383 438.16534
7360.0000 -154.28850 -150.87965 3.40885 1.91592 -150.26083 475.71317
7365.0000 -153.88576 -150.47069 3.41506 1.92542 -150.11369 456.99783
7370.0000 -152.99510 -150.42859 2.56651 1.91704 -150.24351 436.92541
7375.0000 -153.28873 -149.80576 3.48297 1.91743 -150.23751 433.91485
7380.0000 -154.52054 -150.92779 3.59274 1.89268 -150.62100 435.81436
7385.0000 -154.25337 -151.60132 2.65206 1.85516 -151.20239 414.03049
7390.0000 -154.56561 -150.81906 3.74656 1.85772 -151.16273 417.60861
7395.0000 -154.65574 -151.66959 2.98615 1.84846 -151.30624 405.15373
7400.0000 -154.32240 -150.89769 3.42472 1.85809 -151.15706 418.68400
7405.0000 -154.58145 -151.45230 3.12915 1.85878 -151.14640 414.65690
7410.0000 -154.98126 -151.94777 3.03349 1.84831 -151.30859 409.17593
7415.0000 -154.79703 -151.62946 3.16757 1.82593 -151.65540 396.31841
7420.0000 -154.12782 -150.87913 3.24869 1.83028 -151.58792 405.29645
7425.0000 -154.76652 -151.35920 3.40733 1.85987 -151.12944 430.39497
7430.0000 -155.01016 -151.55208 3.45808 1.83341 -151.53949 405.55336
7435.0000 -154.59223 -150.60894 3.98329 1.87328 -150.92161 441.95276
7440.0000 -153.96253 -150.12291 3.83962 1.92381 -150.13866 470.72294
7445.0000 -154.34886 -150.57532 3.77354 1.88248 -150.77902 449.75052
7450.0000 -154.17730 -150.34246 3.83484 1.86662 -151.02483 444.06801
7455.0000 -154.77202 -151.79678 2.97524 1.85933 -151.13776 432.68834
7460.0000 -154.39645 -151.47844 2.91800 1.84194 -151.40727 411.68441
7465.0000 -154.73015 -151.14956 3.58059 1.84529 -151.35534 416.87511
7470.0000 -154.08460 -150.91067 3.17393 1.86423 -151.06182 432.27950
7475.0000 -154.74216 -151.72529 3.01687 1.84748 -151.32149 409.55327
7480.0000 -154.58756 -150.66257 3.92499 1.84692 -151.33013 418.18214
7485.0000 -154.50666 -151.04024 3.46642 1.89250 -150.62382 458.27826
7490.0000 -154.91155 -151.49559 3.41597 1.84299 -151.39100 412.69046
7495.0000 -154.98483 -151.89671 3.08812 1.83293 -151.54682 407.55141
7500.0000 -154.66285 -150.62685 4.03600 1.86961 -150.97843 440.15546
FREEZING PROCESS: loop number 31 T-loop= 407.00000000000000
main_MD> interactions number 31 at Temperature= 407.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.27521 1.49138 1.86865
force_rgl> df(natom) 0.39603 2.14194 1.89582
7505.0000 -154.94603 -151.78187 3.16416 1.85501 -151.20482 424.32058
7510.0000 -154.72418 -152.11124 2.61294 1.80554 -151.97138 388.59982
7515.0000 -154.66289 -151.49696 3.16592 1.86269 -151.08577 430.88181
7520.0000 -155.03100 -152.04914 2.98185 1.83601 -151.49924 409.83671
7525.0000 -154.60972 -151.44869 3.16103 1.84305 -151.39008 416.93515
7530.0000 -154.51195 -151.80374 2.70822 1.84002 -151.43709 417.36154
7535.0000 -155.09183 -151.55028 3.54156 1.83223 -151.55773 403.85102
7540.0000 -154.74499 -151.45976 3.28523 1.81388 -151.84207 387.77153
7545.0000 -154.29004 -151.35317 2.93686 1.81884 -151.76527 395.52917
7550.0000 -154.39004 -151.15742 3.23262 1.83644 -151.49251 402.62167
7555.0000 -154.58745 -150.93192 3.65553 1.86875 -150.99189 436.51315
7560.0000 -154.30678 -150.95604 3.35074 1.84939 -151.29188 420.34433
7565.0000 -154.47678 -151.14641 3.33037 1.86483 -151.05264 436.36600
7570.0000 -154.74340 -151.23575 3.50765 1.83186 -151.56352 407.65602
7575.0000 -154.67140 -151.65376 3.01763 1.84567 -151.34954 419.31993
7580.0000 -153.83384 -150.30950 3.52435 1.85215 -151.24909 421.95578
7585.0000 -154.89114 -151.27375 3.61739 1.86145 -151.10496 431.38885
7590.0000 -153.72110 -150.47819 3.24291 1.87133 -150.95187 434.07681
7595.0000 -154.26597 -151.28789 2.97808 1.88524 -150.73636 418.93300
7600.0000 -154.21036 -151.02117 3.18919 1.85383 -151.22307 388.22044
7605.0000 -154.37066 -151.36468 3.00598 1.83981 -151.44025 381.00678
7610.0000 -154.28833 -151.35324 2.93509 1.85718 -151.17117 388.74974
7615.0000 -154.25140 -150.43270 3.81870 1.89735 -150.54866 419.35426
7620.0000 -153.46409 -150.27048 3.19361 1.90275 -150.46492 423.46927
7625.0000 -153.55241 -150.44682 3.10559 1.90839 -150.37751 428.84099
7630.0000 -153.50884 -150.59974 2.90910 1.90378 -150.44900 425.60742
7635.0000 -153.18986 -150.45321 2.73665 1.90231 -150.47185 428.90204
7640.0000 -154.47581 -151.26724 3.20858 1.86245 -151.08938 390.43463
7645.0000 -153.89118 -151.56330 2.32788 1.84159 -151.41275 370.18044
7650.0000 -154.48034 -151.12700 3.35334 1.86649 -151.02692 375.06096
7655.0000 -153.92756 -150.54072 3.38684 1.88462 -150.74594 397.75898
7660.0000 -153.75245 -150.46221 3.29023 1.89379 -150.60385 414.27759
7665.0000 -153.75357 -150.47819 3.27538 1.92665 -150.09465 434.04992
7670.0000 -154.13165 -150.48392 3.64773 1.90752 -150.39100 415.90754
7675.0000 -153.36120 -149.92925 3.43196 1.89869 -150.52787 409.20294
7680.0000 -153.38013 -150.55545 2.82469 1.94433 -149.82072 447.80945
7685.0000 -153.61650 -149.69080 3.92570 1.91311 -150.30443 428.00410
7690.0000 -153.64811 -150.08653 3.56158 1.95680 -149.62736 461.60334
7695.0000 -154.44934 -151.31131 3.13803 1.91050 -150.34488 424.54912
7700.0000 -154.25391 -151.01930 3.23461 1.86241 -151.09009 386.45870
7705.0000 -154.08863 -150.66161 3.42702 1.89211 -150.62988 415.40250
7710.0000 -154.29116 -150.70983 3.58133 1.88345 -150.76402 413.90507
7715.0000 -154.36978 -151.03843 3.33135 1.84875 -151.30178 388.87761
7720.0000 -153.56049 -149.98385 3.57664 1.88876 -150.68170 426.90895
7725.0000 -154.30513 -150.45756 3.84757 1.91208 -150.32044 455.33208
7730.0000 -153.96160 -150.77599 3.18561 1.87742 -150.85749 410.38553
7735.0000 -153.76216 -150.60954 3.15262 1.87954 -150.82467 410.58899
7740.0000 -154.76294 -151.20408 3.55886 1.86945 -150.98103 397.89391
7745.0000 -154.09734 -151.14290 2.95444 1.87000 -150.97253 404.34922
7750.0000 -154.72247 -151.23538 3.48709 1.86040 -151.12126 418.12669
FREEZING PROCESS: loop number 32 T-loop= 382.00000000000000
main_MD> interactions number 32 at Temperature= 382.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -5.37822 0.32926 -3.45064
force_rgl> df(natom) -0.60540 -1.71889 0.60748
7755.0000 -155.00103 -152.04601 2.95502 1.82473 -151.67401 402.35196
7760.0000 -154.65595 -151.28263 3.37332 1.83780 -151.47139 406.61054
7765.0000 -155.24339 -152.07064 3.17275 1.83582 -151.50206 404.31646
7770.0000 -154.84354 -152.01554 2.82800 1.80191 -152.02755 380.98689
7775.0000 -155.28057 -152.16580 3.11477 1.80102 -152.04138 385.09042
7780.0000 -155.25623 -152.60356 2.65268 1.78101 -152.35138 359.22363
7785.0000 -155.18808 -152.55655 2.63154 1.76907 -152.53650 346.85868
7790.0000 -155.58965 -151.99660 3.59305 1.76622 -152.58057 345.79667
7795.0000 -155.08786 -152.67889 2.40897 1.79102 -152.19626 367.61802
7800.0000 -154.79292 -152.18160 2.61133 1.77858 -152.38912 351.90574
7805.0000 -155.25652 -151.97135 3.28517 1.78271 -152.32507 359.19838
7810.0000 -154.49206 -151.42663 3.06544 1.82983 -151.59497 402.37645
7815.0000 -154.71048 -151.70252 3.00796 1.81635 -151.80376 393.17419
7820.0000 -155.78700 -152.80696 2.98005 1.78715 -152.25626 367.43619
7825.0000 -154.83980 -152.06778 2.77202 1.77987 -152.36911 362.99843
7830.0000 -155.41691 -152.63495 2.78196 1.78942 -152.22116 369.19094
7835.0000 -154.48734 -151.23751 3.24983 1.78290 -152.32211 360.38798
7840.0000 -155.02784 -151.93121 3.09663 1.83564 -151.50497 412.09902
7845.0000 -155.22465 -151.86687 3.35779 1.82493 -151.67085 397.74325
7850.0000 -154.65985 -151.94251 2.71734 1.79969 -152.06200 377.77158
7855.0000 -155.33933 -152.32287 3.01646 1.77763 -152.40385 357.95369
7860.0000 -155.18215 -152.13011 3.05203 1.80062 -152.04757 378.20045
7865.0000 -155.19682 -152.19571 3.00111 1.80002 -152.05693 372.51419
7870.0000 -154.49732 -151.64297 2.85436 1.82541 -151.66337 399.10424
7875.0000 -155.48926 -152.51571 2.97355 1.81862 -151.76871 391.08998
7880.0000 -155.41033 -152.72519 2.68514 1.76194 -152.64689 339.46873
7885.0000 -155.40471 -152.41413 2.99058 1.78614 -152.27194 369.98903
7890.0000 -155.61745 -152.58348 3.03397 1.77476 -152.44835 357.42358
7895.0000 -155.58857 -152.63368 2.95489 1.77264 -152.48121 352.03307
7900.0000 -154.87001 -151.98342 2.88659 1.79510 -152.13318 374.67366
7905.0000 -154.57069 -151.72093 2.84977 1.83222 -151.55791 406.37159
7910.0000 -154.55798 -152.04828 2.50970 1.81557 -151.81588 386.55103
7915.0000 -155.40201 -152.01088 3.39113 1.82153 -151.72351 399.49873
7920.0000 -154.85984 -151.28054 3.57930 1.84645 -151.33735 415.13700
7925.0000 -154.88003 -151.95840 2.92162 1.83372 -151.53464 409.29509
7930.0000 -154.94455 -152.21817 2.72638 1.79015 -152.20980 366.77318
7935.0000 -155.23178 -152.18535 3.04643 1.78630 -152.26940 361.38189
7940.0000 -153.95616 -150.89766 3.05851 1.82153 -151.72351 396.57758
7945.0000 -154.38465 -151.08511 3.29954 1.87866 -150.83834 443.28656
7950.0000 -155.16496 -151.83494 3.33003 1.85828 -151.15408 431.76182
7955.0000 -155.41473 -152.47302 2.94171 1.76171 -152.65055 343.56198
7960.0000 -155.14079 -152.36424 2.77655 1.77334 -152.47028 354.49121
7965.0000 -155.39937 -152.14169 3.25768 1.79784 -152.09061 371.85724
7970.0000 -155.04154 -151.73866 3.30288 1.81718 -151.79090 390.36583
7975.0000 -155.02941 -152.04047 2.98894 1.82368 -151.69028 397.00256
7980.0000 -154.84175 -151.95580 2.88595 1.81207 -151.87016 386.21446
7985.0000 -155.36350 -152.34811 3.01539 1.79059 -152.20303 370.87930
7990.0000 -154.48966 -151.74111 2.74855 1.80137 -152.03598 379.40624
7995.0000 -154.76863 -151.92552 2.84310 1.80692 -151.94992 382.82843
8000.0000 -155.32955 -152.03840 3.29115 1.78607 -152.27306 363.96502
FREEZING PROCESS: loop number 33 T-loop= 357.00000000000000
main_MD> interactions number 33 at Temperature= 357.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.26724 1.30057 -0.67415
force_rgl> df(natom) 1.18408 -3.48515 -0.03455
8005.0000 -154.82680 -151.42514 3.40165 1.82416 -151.68285 400.93111
8010.0000 -155.42782 -152.29832 3.12951 1.81775 -151.78209 390.79738
8015.0000 -154.62975 -151.71551 2.91424 1.78167 -152.34123 358.12571
8020.0000 -155.25181 -152.84556 2.40626 1.79074 -152.20073 365.84568
8025.0000 -154.34127 -152.04760 2.29367 1.78888 -152.22953 366.97818
8030.0000 -155.57770 -152.20268 3.37502 1.78997 -152.21259 365.31482
8035.0000 -155.44008 -152.96599 2.47409 1.78348 -152.31320 361.13426
8040.0000 -155.44647 -152.37923 3.06724 1.75948 -152.68508 338.74355
8045.0000 -154.98054 -151.72733 3.25322 1.80052 -152.04908 371.67972
8050.0000 -155.14940 -152.10079 3.04861 1.80916 -151.91526 385.22198
8055.0000 -155.17665 -152.04860 3.12805 1.77358 -152.46658 354.58515
8060.0000 -154.77105 -152.19645 2.57460 1.79527 -152.13051 375.48760
8065.0000 -154.94018 -152.00713 2.93305 1.78110 -152.35006 361.11175
8070.0000 -154.66822 -151.30475 3.36346 1.81278 -151.85908 388.24071
8075.0000 -155.38271 -152.53705 2.84566 1.78028 -152.36278 355.83975
8080.0000 -155.22754 -153.01892 2.20861 1.74602 -152.89359 325.62871
8085.0000 -155.80675 -153.58865 2.21810 1.72933 -153.15230 310.68925
8090.0000 -155.22968 -152.63909 2.59059 1.72857 -153.16411 311.98915
8095.0000 -154.76427 -151.87958 2.88470 1.78503 -152.28919 361.04289
8100.0000 -155.03699 -152.14978 2.88721 1.80150 -152.03400 374.32958
8105.0000 -155.48660 -152.78191 2.70469 1.76796 -152.55364 346.03329
8110.0000 -154.72552 -151.93068 2.79484 1.78905 -152.22686 367.66689
8115.0000 -154.80219 -152.18618 2.61601 1.79335 -152.16015 371.79125
8120.0000 -155.14642 -152.33084 2.81557 1.77593 -152.43015 353.94529
8125.0000 -155.54428 -152.19917 3.34511 1.79590 -152.12075 373.61519
8130.0000 -155.53024 -152.88725 2.64299 1.75652 -152.73087 338.54482
8135.0000 -155.09459 -152.31867 2.77592 1.74212 -152.95413 328.01909
8140.0000 -154.74583 -151.66345 3.08239 1.78654 -152.26570 369.08908
8145.0000 -155.44008 -152.59226 2.84781 1.78345 -152.31367 361.03070
8150.0000 -155.24580 -152.13962 3.10618 1.77133 -152.50150 349.61963
8155.0000 -155.67010 -152.87217 2.79793 1.77130 -152.50197 353.84046
8160.0000 -155.46057 -152.52537 2.93520 1.76656 -152.57533 345.63130
8165.0000 -155.23951 -152.70740 2.53210 1.74053 -152.97879 322.18719
8170.0000 -155.22449 -152.75261 2.47188 1.74810 -152.86137 327.56239
8175.0000 -154.82125 -152.35450 2.46675 1.77168 -152.49610 349.58000
8180.0000 -155.65395 -152.52896 3.12499 1.74840 -152.85675 332.08397
8185.0000 -155.30382 -152.66211 2.64171 1.78113 -152.34964 361.90740
8190.0000 -155.13231 -152.04623 3.08608 1.78673 -152.26286 363.66031
8195.0000 -155.71185 -153.02223 2.68962 1.76805 -152.55231 347.53753
8200.0000 -155.30617 -152.58270 2.72347 1.77163 -152.49682 348.85262
8205.0000 -155.21064 -152.22821 2.98243 1.80893 -151.91879 389.10898
8210.0000 -155.67591 -152.77119 2.90471 1.76974 -152.52605 351.52743
8215.0000 -155.20301 -152.54908 2.65393 1.76144 -152.65469 341.45972
8220.0000 -155.24096 -152.56482 2.67614 1.78357 -152.31182 360.89895
8225.0000 -155.48087 -152.95228 2.52859 1.75496 -152.75515 337.20939
8230.0000 -155.86271 -153.11647 2.74624 1.73373 -153.08406 316.76410
8235.0000 -155.42342 -152.29314 3.13027 1.75542 -152.74796 337.74108
8240.0000 -155.66854 -152.81391 2.85463 1.75916 -152.69003 341.85253
8245.0000 -155.14875 -152.29083 2.85792 1.74389 -152.92659 328.67934
8250.0000 -155.15877 -152.41306 2.74571 1.78966 -152.21734 368.10137
FREEZING PROCESS: loop number 34 T-loop= 332.00000000000000
main_MD> interactions number 34 at Temperature= 332.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.83427 -0.09244 -0.92116
force_rgl> df(natom) -2.08415 1.20333 -0.96738
8255.0000 -155.47919 -152.38622 3.09296 1.76833 -152.54792 347.71553
8260.0000 -155.43096 -152.39861 3.03236 1.75912 -152.69065 339.80595
8265.0000 -155.57835 -153.05533 2.52301 1.75140 -152.81026 329.10170
8270.0000 -155.62930 -153.25492 2.37438 1.72980 -153.14505 311.27250
8275.0000 -155.22316 -152.75345 2.46972 1.72518 -153.21663 306.47672
8280.0000 -155.21779 -152.59882 2.61897 1.78391 -152.30652 359.15576
8285.0000 -155.33281 -152.30331 3.02951 1.77570 -152.43378 355.50163
8290.0000 -154.73373 -152.20179 2.53194 1.78059 -152.35801 359.57370
8295.0000 -155.09911 -152.31266 2.78644 1.78664 -152.26418 362.36775
8300.0000 -155.42340 -152.72108 2.70231 1.77568 -152.43399 353.69180
8305.0000 -155.05333 -152.20785 2.84548 1.78610 -152.27263 362.89924
8310.0000 -155.06713 -152.02282 3.04431 1.80268 -152.01569 377.85302
8315.0000 -155.22095 -152.30841 2.91254 1.79975 -152.06106 378.25644
8320.0000 -154.90916 -152.11526 2.79390 1.77880 -152.38575 358.45524
8325.0000 -155.06775 -152.26437 2.80338 1.77741 -152.40726 353.14216
8330.0000 -155.75458 -153.29761 2.45697 1.74570 -152.89867 328.97580
8335.0000 -155.84452 -153.59216 2.25236 1.70552 -153.52129 289.24587
8340.0000 -155.49214 -153.27403 2.21811 1.71214 -153.41870 295.13501
8345.0000 -155.97632 -152.93873 3.03759 1.73219 -153.10804 312.42494
8350.0000 -155.29450 -153.06842 2.22608 1.74054 -152.97865 318.65979
8355.0000 -155.58333 -153.26665 2.31667 1.73496 -153.06497 316.13392
8360.0000 -155.95924 -153.16918 2.79006 1.73054 -153.13359 314.02371
8365.0000 -155.96463 -152.90627 3.05836 1.73977 -152.99051 323.27128
8370.0000 -155.61405 -153.20271 2.41135 1.74909 -152.84616 333.06930
8375.0000 -155.19395 -152.55548 2.63846 1.75746 -152.71631 338.31264
8380.0000 -155.34056 -152.66197 2.67859 1.77482 -152.44745 353.72859
8385.0000 -155.13895 -152.38068 2.75828 1.76384 -152.61751 343.49549
8390.0000 -155.09972 -152.50366 2.59606 1.78138 -152.34567 359.47493
8395.0000 -155.47497 -153.28056 2.19441 1.75046 -152.82480 333.62092
8400.0000 -155.39098 -153.27025 2.12072 1.73252 -153.10287 312.70597
8405.0000 -155.71762 -153.36581 2.35181 1.72472 -153.22377 308.79841
8410.0000 -155.65511 -153.20450 2.45061 1.72517 -153.21681 311.09120
8415.0000 -155.45781 -152.59880 2.85901 1.73810 -153.01633 320.09542
8420.0000 -155.14856 -152.47717 2.67139 1.76468 -152.60446 344.65567
8425.0000 -155.69382 -152.64801 3.04581 1.75910 -152.69104 339.46062
8430.0000 -155.36409 -152.88271 2.48138 1.75228 -152.79660 337.57357
8435.0000 -155.74626 -153.37712 2.36913 1.72148 -153.27389 308.40039
8440.0000 -155.38915 -153.00283 2.38632 1.74384 -152.92744 325.54706
8445.0000 -155.26981 -152.81076 2.45905 1.74364 -152.93056 326.18359
8450.0000 -155.13300 -152.41108 2.72192 1.77295 -152.47636 354.03606
8455.0000 -155.42781 -152.75316 2.67465 1.76918 -152.53483 350.80725
8460.0000 -155.33930 -152.66637 2.67293 1.76110 -152.65999 340.05162
8465.0000 -155.02536 -152.12274 2.90262 1.77746 -152.40643 352.42497
8470.0000 -154.99857 -152.18154 2.81704 1.80244 -152.01937 375.81712
8475.0000 -154.95899 -152.39624 2.56275 1.76635 -152.57865 345.39964
8480.0000 -155.30694 -152.60355 2.70339 1.75201 -152.80082 330.78382
8485.0000 -155.63136 -153.20199 2.42938 1.74327 -152.93622 324.17069
8490.0000 -155.19616 -152.12610 3.07006 1.76178 -152.64936 341.82643
8495.0000 -155.81746 -153.26795 2.54951 1.76208 -152.64479 342.46002
8500.0000 -156.27573 -153.56005 2.71568 1.72769 -153.17765 311.90956
FREEZING PROCESS: loop number 35 T-loop= 307.00000000000000
main_MD> interactions number 35 at Temperature= 307.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.38071 -0.13355 0.19140
force_rgl> df(natom) 2.70380 -0.32448 0.66120
8505.0000 -155.64610 -153.40482 2.24127 1.70092 -153.59257 288.77696
8510.0000 -155.76979 -153.93859 1.83120 1.70236 -153.57021 289.46517
8515.0000 -155.96430 -154.00140 1.96290 1.69268 -153.72028 277.43672
8520.0000 -156.11353 -154.02220 2.09134 1.67039 -154.06565 259.85913
8525.0000 -155.71142 -153.37837 2.33305 1.68806 -153.79185 277.33106
8530.0000 -155.21258 -152.50438 2.70820 1.73379 -153.08323 314.53746
8535.0000 -155.46861 -153.24957 2.21903 1.74244 -152.94915 325.29410
8540.0000 -156.02309 -153.31836 2.70472 1.72494 -153.22024 312.24748
8545.0000 -156.12810 -153.90094 2.22716 1.69796 -153.63837 282.95714
8550.0000 -155.61050 -153.13246 2.47805 1.72115 -153.27906 306.87243
8555.0000 -155.72954 -153.29324 2.43629 1.72014 -153.29474 308.57763
8560.0000 -155.82166 -152.94305 2.87860 1.74576 -152.89767 332.90601
8565.0000 -155.54535 -152.91734 2.62801 1.74570 -152.89855 329.09252
8570.0000 -155.67916 -153.45111 2.22805 1.75095 -152.81722 329.99755
8575.0000 -155.80250 -153.28119 2.52131 1.71338 -153.39944 300.08855
8580.0000 -155.73446 -153.19075 2.54371 1.74424 -152.92119 323.43291
8585.0000 -155.51393 -152.39278 3.12115 1.74658 -152.88500 329.15840
8590.0000 -155.31074 -153.06722 2.24352 1.75343 -152.77876 339.60156
8595.0000 -155.93482 -153.48130 2.45351 1.71702 -153.34311 302.42913
8600.0000 -155.73369 -153.65291 2.08078 1.70340 -153.55410 287.15200
8605.0000 -156.02946 -153.87448 2.15498 1.71519 -153.37145 299.47968
8610.0000 -155.39139 -152.94592 2.44547 1.71100 -153.43629 295.23667
8615.0000 -155.83055 -153.06002 2.77053 1.71836 -153.32223 302.93529
8620.0000 -155.80252 -153.34987 2.45265 1.72544 -153.21250 310.96087
8625.0000 -155.36001 -152.93793 2.42207 1.73805 -153.01710 319.49882
8630.0000 -155.62831 -153.45509 2.17321 1.75000 -152.83198 332.71820
8635.0000 -155.49672 -153.29662 2.20010 1.71364 -153.39546 297.58622
8640.0000 -155.35098 -152.61743 2.73354 1.74951 -152.83952 331.09190
8645.0000 -155.76876 -152.92819 2.84057 1.74818 -152.86025 326.35796
8650.0000 -155.34640 -152.82250 2.52390 1.75413 -152.76793 334.54453
8655.0000 -155.73478 -153.44686 2.28791 1.71467 -153.37949 296.35833
8660.0000 -155.81228 -153.51091 2.30137 1.70326 -153.55624 288.18437
8665.0000 -155.23241 -152.80886 2.42355 1.74085 -152.97376 323.74872
8670.0000 -155.74053 -153.14747 2.59306 1.73993 -152.98801 322.62530
8675.0000 -155.69067 -152.90201 2.78866 1.71692 -153.34461 301.18976
8680.0000 -155.91400 -153.50571 2.40830 1.72440 -153.22875 306.86361
8685.0000 -155.87473 -153.15195 2.72278 1.70920 -153.46425 295.27556
8690.0000 -155.27187 -153.17909 2.09277 1.73298 -153.09577 315.89886
8695.0000 -155.61331 -152.82491 2.78841 1.74716 -152.87607 325.31111
8700.0000 -155.79016 -153.28200 2.50816 1.74998 -152.83232 319.49713
8705.0000 -155.68125 -153.35283 2.32842 1.70745 -153.49128 289.84851
8710.0000 -155.90529 -153.78855 2.11674 1.71581 -153.36183 297.47137
8715.0000 -155.94338 -153.37461 2.56877 1.70678 -153.50179 289.08039
8720.0000 -155.79401 -153.94785 1.84616 1.69261 -153.72137 278.86107
8725.0000 -155.60966 -153.20865 2.40102 1.70058 -153.59775 284.52554
8730.0000 -155.54571 -153.55297 1.99274 1.73729 -153.02895 316.85016
8735.0000 -155.67033 -153.63972 2.03061 1.70220 -153.57264 287.09211
8740.0000 -156.11996 -153.13296 2.98700 1.72241 -153.25951 311.65313
8745.0000 -155.89705 -153.39263 2.50442 1.72279 -153.25366 306.91596
8750.0000 -155.82846 -153.08483 2.74363 1.72017 -153.29429 303.84950
main_MD> EXECUTION TIME: 0 [day], 0 [hour], 14 [min], 49.9723820 [s].
main_MD> Deallocating global variables
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