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nanoparticlesims/growth_Melting_Silver_ICO_3269/freezeSims/run_16/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_16.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 = 16 ntipo2 = 0
read_input> Finish reading input
main_MD> Allocating global variables
main_MD> Number of outputs that will be created: 1600
main_MD> Size of nv and nvoiz: 16 1600
main_MD> Size of nv and nvoiz: 16 1600
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 = 16
main_MD> Consider changing parameter nsiz in module_parameters.f90 for performance
main_MD> collvar_wanted = F
main_MD> INPUT AND POTENTIAL FILE READING IS DONE
main_MD> THERMALIZATION IS STARTING
init> -0.11273599670635548 1.5418427588066663E-002 5.0149228899343257E-003 initial drift of cluster / NP1 for coalescence
init> 0.41789805628362547 0.34132905066584646 0.24341205991666728 scaling for velocity /for coalescence NP1
init.f90 > facguy = 3.5947229105317566E-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) -0.65349 -1.50263 -2.17914
force_rgl> df(natom) -2.74663 -5.81184 13.81162
preparo> THERMALIZATION PROCESS AT 1121.5608447905536
preparo> TOTAL ENERGY, KINETIC EN., POT. ENERGY, DELTA
5000 -32.392345394796457 0.92097297477606022 -33.313318369572521 5.6018358850129469E-004
preparo> END THERMALISATION ON NPAST DEFINE IN PARACLUSTER MODULE
main_MD> Time-loop is starting for freezing
main_MD> Now the computation of EXECUTION TIME starts
main_MD> Running from loop 1 to 32
FREEZING PROCESS: loop number 1 T-loop= 1096.0000000000000
main_MD> interactions number 1 at Temperature= 1096.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.98040 -0.11930 1.12134
force_rgl> df(natom) 0.42511 1.25103 -0.88575
5.0000 -33.81186 -31.51610 2.29575 2.43231 -31.75577 1223.06012
10.0000 -33.13524 -31.01812 2.11711 2.47013 -31.51566 1222.73480
15.0000 -34.78260 -32.62767 2.15493 2.49428 -31.36232 1380.95548
20.0000 -34.51496 -33.02632 1.48863 2.26472 -32.81992 1120.37729
25.0000 -34.92126 -32.59515 2.32611 2.21658 -33.12560 1040.56674
30.0000 -34.33396 -32.13597 2.19800 2.33657 -32.36370 1164.24450
35.0000 -34.97906 -32.72997 2.24909 2.32522 -32.43577 1022.36621
40.0000 -34.99256 -32.73899 2.25357 2.26916 -32.79174 979.45622
45.0000 -34.97200 -33.42730 1.54470 2.22443 -33.07574 1080.70922
50.0000 -34.62221 -32.55230 2.06991 2.27409 -32.76041 1148.62693
55.0000 -34.61909 -32.15643 2.46266 2.32671 -32.42629 1185.56752
60.0000 -34.78687 -32.44980 2.33707 2.36289 -32.19660 1317.86318
65.0000 -34.95447 -32.68459 2.26987 2.29386 -32.63491 1141.17101
70.0000 -34.88406 -31.99005 2.89401 2.33191 -32.39329 1233.48473
75.0000 -35.21809 -32.81676 2.40133 2.30361 -32.57299 1093.50421
80.0000 -34.51394 -32.78440 1.72954 2.27906 -32.72884 1052.13514
85.0000 -35.52338 -33.02037 2.50301 2.22944 -33.04391 1020.18079
90.0000 -34.79238 -32.43906 2.35332 2.26905 -32.79241 1065.57566
95.0000 -34.33466 -32.57414 1.76051 2.34883 -32.28584 1138.41447
100.0000 -35.00011 -32.64067 2.35944 2.34777 -32.29256 1118.00003
105.0000 -34.82131 -32.43760 2.38372 2.28709 -32.67790 1052.19319
110.0000 -34.88008 -32.85049 2.02959 2.24269 -32.95980 932.40773
115.0000 -34.23857 -31.88822 2.35034 2.40475 -31.93078 1240.22878
120.0000 -34.53762 -32.12263 2.41499 2.46364 -31.55685 1331.02748
125.0000 -34.85675 -32.66713 2.18962 2.32667 -32.42655 1071.47654
130.0000 -33.92414 -31.95285 1.97129 2.36734 -32.16831 1183.40248
135.0000 -34.36180 -31.57126 2.79054 2.41898 -31.84042 1230.01550
140.0000 -35.99271 -34.20443 1.78829 2.20306 -33.21143 1044.11896
145.0000 -34.83322 -32.77744 2.05578 2.16720 -33.43911 972.61481
150.0000 -35.60530 -33.26420 2.34110 2.29070 -32.65499 1120.20389
155.0000 -34.70878 -31.29282 3.41596 2.29304 -32.64010 1138.56023
160.0000 -35.29778 -33.42082 1.87697 2.34864 -32.28706 1223.64430
165.0000 -34.88668 -32.83977 2.04690 2.26343 -32.82813 1056.66270
170.0000 -34.29915 -32.17482 2.12433 2.26529 -32.81628 1005.65882
175.0000 -34.23303 -31.44654 2.78649 2.43945 -31.71049 1192.44935
180.0000 -33.48954 -30.95637 2.53317 2.55281 -30.99066 1420.32019
185.0000 -34.04992 -31.80380 2.24612 2.44065 -31.70287 1278.46671
190.0000 -35.12955 -32.90825 2.22130 2.22675 -33.06105 1056.00824
195.0000 -34.65818 -32.60695 2.05124 2.35291 -32.25996 1113.18893
200.0000 -34.19336 -31.41168 2.78168 2.37546 -32.11677 1142.29434
205.0000 -33.98149 -31.45968 2.52180 2.50235 -31.31109 1251.18400
210.0000 -34.71531 -32.25141 2.46391 2.37919 -32.09310 1143.05522
215.0000 -34.71998 -32.92444 1.79553 2.34168 -32.33128 1130.94921
220.0000 -35.35167 -32.95793 2.39374 2.29723 -32.61347 1080.42588
225.0000 -36.66951 -33.91479 2.75472 2.23070 -33.03591 1096.73695
230.0000 -35.11949 -32.41760 2.70188 2.15914 -33.49033 1113.42248
235.0000 -33.93747 -31.82036 2.11711 2.39747 -31.97700 1261.35134
240.0000 -34.90593 -31.80148 3.10445 2.43932 -31.71127 1180.11667
245.0000 -34.27908 -32.34027 1.93881 2.34606 -32.30343 1139.12851
250.0000 -33.66286 -30.52874 3.13412 2.44052 -31.70366 1202.78980
FREEZING PROCESS: loop number 2 T-loop= 1071.0000000000000
main_MD> interactions number 2 at Temperature= 1071.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.80799 -1.30538 0.04997
force_rgl> df(natom) -1.03847 1.70258 0.09713
255.0000 -34.41275 -31.15525 3.25750 2.60061 -30.68718 1466.52178
260.0000 -33.86531 -30.94791 2.91741 2.60048 -30.68800 1366.79200
265.0000 -34.07686 -31.21013 2.86673 2.49421 -31.36273 1325.87522
270.0000 -34.53270 -32.51751 2.01519 2.47694 -31.47242 1381.93564
275.0000 -35.39839 -32.56001 2.83837 2.30004 -32.59562 1028.71713
280.0000 -34.40856 -31.16184 3.24672 2.25998 -32.84999 1045.42867
285.0000 -35.16808 -33.25030 1.91779 2.45022 -31.64210 1324.37089
290.0000 -35.24464 -33.12103 2.12361 2.26740 -32.80293 1171.48774
295.0000 -34.43127 -32.23268 2.19859 2.17281 -33.40349 999.32571
300.0000 -34.40396 -31.23815 3.16581 2.39020 -32.02316 1111.23949
305.0000 -33.58777 -31.59113 1.99665 2.47253 -31.50044 1221.37293
310.0000 -34.26787 -32.08697 2.18090 2.41999 -31.83401 1217.94704
315.0000 -34.77601 -33.12782 1.64819 2.29519 -32.62643 1196.65833
320.0000 -35.91599 -33.76271 2.15328 2.13863 -33.62058 951.99244
325.0000 -35.42670 -33.24793 2.17877 2.14157 -33.60185 1001.02550
330.0000 -35.77435 -33.15803 2.61632 2.27819 -32.73441 1044.03795
335.0000 -34.30683 -32.01188 2.29495 2.34656 -32.30025 1130.47634
340.0000 -34.06677 -32.30940 1.75737 2.31218 -32.51859 1045.70277
345.0000 -34.48299 -32.15902 2.32396 2.41585 -31.86029 1179.54430
350.0000 -34.70359 -31.94371 2.75988 2.39875 -31.96891 1249.64565
355.0000 -35.11810 -32.45198 2.66612 2.40472 -31.93096 1192.91618
360.0000 -35.70416 -33.28989 2.41427 2.24500 -32.94516 963.05745
365.0000 -35.35186 -33.05730 2.29455 2.15951 -33.48796 977.65707
370.0000 -34.77277 -32.95974 1.81302 2.24388 -32.95224 1101.76960
375.0000 -35.05315 -32.36191 2.69125 2.24328 -32.95608 925.00536
380.0000 -35.59332 -32.95361 2.63971 2.27230 -32.77181 1032.49994
385.0000 -35.13444 -32.70231 2.43214 2.25992 -32.85043 1083.36323
390.0000 -35.38157 -32.08549 3.29607 2.28479 -32.69251 1123.75099
395.0000 -34.63298 -31.64681 2.98617 2.31658 -32.49064 1158.41687
400.0000 -34.96889 -32.86544 2.10346 2.36531 -32.18120 1230.45252
405.0000 -34.97236 -31.94402 3.02834 2.33915 -32.34735 1085.00441
410.0000 -34.21683 -32.39776 1.81907 2.35109 -32.27150 1195.97415
415.0000 -34.24979 -32.60745 1.64234 2.35310 -32.25877 1164.79757
420.0000 -35.47018 -32.86958 2.60060 2.25606 -32.87494 1048.01645
425.0000 -34.74890 -32.47059 2.27831 2.33137 -32.39672 1161.19326
430.0000 -34.94829 -33.40356 1.54473 2.23284 -33.02237 993.67231
435.0000 -34.88208 -33.27372 1.60836 2.22292 -33.08531 1001.84268
440.0000 -34.61268 -32.17891 2.43376 2.25906 -32.85584 1030.35022
445.0000 -34.74690 -32.83986 1.90704 2.33061 -32.40154 1072.16548
450.0000 -35.05503 -32.00337 3.05166 2.31386 -32.50788 1187.87729
455.0000 -34.83483 -32.52168 2.31315 2.31515 -32.49973 1148.22965
460.0000 -34.46596 -32.52504 1.94092 2.33623 -32.36583 1212.65359
465.0000 -34.53388 -32.78802 1.74586 2.25635 -32.87307 991.22638
470.0000 -34.80168 -32.73771 2.06397 2.31913 -32.47441 1088.22654
475.0000 -34.75845 -32.45773 2.30072 2.21848 -33.11353 1084.14301
480.0000 -34.98554 -32.48039 2.50515 2.32217 -32.45513 1145.62464
485.0000 -34.26909 -32.57134 1.69775 2.28264 -32.70611 1005.55046
490.0000 -34.94794 -33.02262 1.92532 2.27168 -32.77572 1007.14130
495.0000 -35.37112 -33.41943 1.95169 2.24623 -32.93732 1048.17326
500.0000 -34.48925 -32.18423 2.30502 2.24080 -32.97180 1098.89485
FREEZING PROCESS: loop number 3 T-loop= 1046.0000000000000
main_MD> interactions number 3 at Temperature= 1046.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.06731 -1.45172 2.12631
force_rgl> df(natom) 0.07798 0.80658 1.22003
505.0000 -34.94031 -33.25235 1.68796 2.32438 -32.44109 1133.41307
510.0000 -34.67690 -32.40037 2.27653 2.28658 -32.68112 1087.51873
515.0000 -33.96176 -32.30648 1.65528 2.34365 -32.31873 1056.23106
520.0000 -34.85805 -32.36042 2.49763 2.39732 -31.97794 1124.52380
525.0000 -36.11927 -33.99365 2.12562 2.23331 -33.01935 1096.87373
530.0000 -35.15858 -33.30091 1.85766 2.11573 -33.76592 948.99726
535.0000 -35.07794 -33.60259 1.47536 2.12918 -33.68055 963.77359
540.0000 -35.51253 -32.97022 2.54231 2.18093 -33.35195 1028.91990
545.0000 -35.02289 -32.31796 2.70494 2.28209 -32.70962 1208.55112
550.0000 -34.98999 -32.98910 2.00089 2.25036 -32.91111 1062.43259
555.0000 -35.60078 -33.27376 2.32702 2.23288 -33.02211 1096.56158
560.0000 -35.41208 -32.85469 2.55739 2.19321 -33.27397 983.14196
565.0000 -35.62211 -32.53477 3.08734 2.27913 -32.72841 1152.87810
570.0000 -35.45809 -33.63133 1.82676 2.21685 -33.12385 1048.41688
575.0000 -35.94072 -33.33879 2.60194 2.21232 -33.15264 1000.04221
580.0000 -35.12147 -32.86786 2.25361 2.17842 -33.36790 1069.07386
585.0000 -35.23409 -33.41466 1.81943 2.21890 -33.11086 1025.54783
590.0000 -34.78265 -32.68837 2.09428 2.17934 -33.36202 1003.74631
595.0000 -35.16413 -33.25992 1.90421 2.19862 -33.23961 983.88199
600.0000 -34.46189 -32.12721 2.33468 2.23659 -32.99851 996.71413
605.0000 -34.30798 -31.63835 2.66963 2.43293 -31.75185 1285.44680
610.0000 -34.78771 -32.15204 2.63567 2.44924 -31.64828 1266.07842
615.0000 -34.55308 -32.03658 2.51650 2.38857 -32.03350 1262.60317
620.0000 -35.83925 -33.71779 2.12147 2.25267 -32.89642 1012.25849
625.0000 -34.97343 -33.15653 1.81690 2.15086 -33.54291 987.06945
630.0000 -35.77832 -33.86689 1.91143 2.17170 -33.41060 1002.34789
635.0000 -34.91934 -32.53740 2.38194 2.26600 -32.81177 1091.75508
640.0000 -34.66294 -32.80921 1.85373 2.31401 -32.50697 1090.35727
645.0000 -34.89630 -32.68307 2.21323 2.31092 -32.52657 1233.06736
650.0000 -34.36961 -32.52912 1.84049 2.23784 -32.99062 902.67795
655.0000 -33.97177 -31.61386 2.35791 2.40348 -31.93884 1189.36083
660.0000 -34.65921 -32.34099 2.31822 2.34241 -32.32660 1097.53543
665.0000 -34.71711 -32.86260 1.85451 2.29826 -32.60699 1103.49917
670.0000 -34.74705 -32.41787 2.32919 2.35101 -32.27200 1207.64485
675.0000 -34.76038 -32.80533 1.95505 2.28724 -32.67690 1057.50208
680.0000 -35.49984 -32.72644 2.77341 2.26281 -32.83203 1077.55817
685.0000 -35.25137 -33.22265 2.02872 2.22071 -33.09938 990.31025
690.0000 -35.67488 -33.77083 1.90405 2.08589 -33.95540 833.54948
695.0000 -35.36065 -33.37213 1.98852 2.17023 -33.41988 1022.91434
700.0000 -35.59605 -33.34429 2.25176 2.16990 -33.42202 988.10059
705.0000 -34.99147 -32.97294 2.01853 2.24691 -32.93303 1078.33610
710.0000 -35.83918 -33.36361 2.47557 2.24805 -32.92579 1051.02251
715.0000 -35.56485 -33.33756 2.22729 2.18283 -33.33991 1023.14529
720.0000 -35.82735 -33.46109 2.36626 2.16219 -33.47097 937.60054
725.0000 -35.69072 -33.56292 2.12780 2.13443 -33.64724 939.99018
730.0000 -35.38464 -33.08907 2.29556 2.22490 -33.07275 1120.40833
735.0000 -35.17343 -32.11072 3.06271 2.31275 -32.51498 1054.25392
740.0000 -33.92663 -31.70741 2.21922 2.38615 -32.04886 1216.85944
745.0000 -35.48055 -32.96449 2.51605 2.32885 -32.41274 1161.25719
750.0000 -35.27618 -32.76881 2.50737 2.29186 -32.64757 1170.63825
FREEZING PROCESS: loop number 4 T-loop= 1021.0000000000000
main_MD> interactions number 4 at Temperature= 1021.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -4.75994 1.47358 -0.84679
force_rgl> df(natom) 3.51233 -1.92559 1.47136
755.0000 -35.41012 -32.45033 2.95980 2.33089 -32.39976 1202.82765
760.0000 -35.47129 -33.84856 1.62272 2.18301 -33.33875 999.59750
765.0000 -35.22445 -33.48715 1.73730 2.22891 -33.04729 991.66255
770.0000 -35.12400 -33.01053 2.11347 2.20082 -33.22565 939.83419
775.0000 -35.26364 -33.64112 1.62252 2.18466 -33.32825 931.33663
780.0000 -35.44961 -32.94233 2.50728 2.18579 -33.32110 1033.29111
785.0000 -34.10746 -32.23224 1.87522 2.30355 -32.57335 1128.32040
790.0000 -34.93300 -32.10743 2.82556 2.36227 -32.20053 1154.94442
795.0000 -35.32866 -33.11371 2.21495 2.30450 -32.56733 1209.94914
800.0000 -35.72179 -32.89467 2.82711 2.20923 -33.17223 1060.31760
805.0000 -35.75558 -33.95585 1.79973 2.14993 -33.54878 987.38792
810.0000 -35.99636 -34.26835 1.72801 2.06978 -34.05769 902.99864
815.0000 -36.20692 -33.38790 2.81901 2.16093 -33.47894 966.48475
820.0000 -35.95152 -34.19108 1.76044 2.14231 -33.59716 958.52915
825.0000 -35.74895 -34.10210 1.64685 2.06362 -34.09685 840.99361
830.0000 -35.38711 -32.63198 2.75512 2.19522 -33.26122 982.83069
835.0000 -35.36244 -33.39665 1.96579 2.28234 -32.70805 1176.77762
840.0000 -35.83054 -33.79216 2.03838 2.15401 -33.52291 986.74668
845.0000 -35.32389 -33.67032 1.65357 2.12312 -33.71903 938.31291
850.0000 -35.54529 -33.95169 1.59360 2.06726 -34.07373 847.41210
855.0000 -35.50700 -33.39230 2.11470 2.15001 -33.54831 941.89491
860.0000 -35.01574 -33.02342 1.99232 2.23059 -33.03667 1091.57391
865.0000 -35.45455 -33.80496 1.64959 2.11875 -33.74680 794.15248
870.0000 -35.10971 -33.62404 1.48567 2.19214 -33.28079 915.52952
875.0000 -34.80835 -31.89381 2.91454 2.27142 -32.77741 1071.08476
880.0000 -35.38548 -33.14738 2.23810 2.37499 -32.11972 1160.60989
885.0000 -35.89020 -33.76786 2.12235 2.15792 -33.49806 924.72467
890.0000 -34.17807 -31.59594 2.58213 2.26573 -32.81348 1206.36460
895.0000 -33.64156 -31.39962 2.24194 2.47697 -31.47222 1299.58600
900.0000 -35.97391 -34.71362 1.26030 2.26652 -32.80848 1124.26072
905.0000 -36.55444 -35.37311 1.18133 1.93209 -34.93202 732.52353
910.0000 -36.13181 -34.17580 1.95601 1.97959 -34.63041 769.88089
915.0000 -36.51242 -35.10157 1.41085 2.03161 -34.30008 815.79035
920.0000 -36.21798 -34.27377 1.94421 2.00184 -34.48913 852.58929
925.0000 -35.88330 -34.11798 1.76532 2.04531 -34.21311 885.67445
930.0000 -34.75583 -33.19272 1.56311 2.11130 -33.79406 896.07655
935.0000 -35.36201 -33.70048 1.66153 2.16463 -33.45544 997.97943
940.0000 -35.45449 -32.84229 2.61220 2.25423 -32.88655 1030.11207
945.0000 -34.22931 -32.08198 2.14733 2.26081 -32.84476 1083.18648
950.0000 -35.10954 -33.34656 1.76299 2.26178 -32.83858 1112.84924
955.0000 -36.01479 -33.36247 2.65233 2.16451 -33.45622 1025.31624
960.0000 -35.26958 -32.97860 2.29098 2.25170 -32.90260 1132.67668
965.0000 -35.33519 -33.70077 1.63442 2.14379 -33.58778 1033.21154
970.0000 -35.41263 -32.77677 2.63587 2.17987 -33.35871 1055.54585
975.0000 -35.93670 -33.50207 2.43463 2.17353 -33.39894 983.52953
980.0000 -35.48285 -32.72508 2.75777 2.22074 -33.09918 1095.50819
985.0000 -35.46414 -33.31802 2.14612 2.22706 -33.05907 1154.11567
990.0000 -35.46707 -33.60157 1.86550 2.11100 -33.79601 866.67124
995.0000 -35.84540 -33.92753 1.91787 2.18360 -33.33502 1076.05526
1000.0000 -36.04780 -33.44365 2.60415 2.17709 -33.37634 1032.03707
FREEZING PROCESS: loop number 5 T-loop= 996.00000000000000
main_MD> interactions number 5 at Temperature= 996.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.96988 -5.39641 1.22939
force_rgl> df(natom) 2.84946 -1.26816 0.65152
1005.0000 -36.10881 -33.91644 2.19236 2.16720 -33.43914 907.16544
1010.0000 -35.93251 -33.52211 2.41040 2.13229 -33.66081 916.61732
1015.0000 -34.91326 -33.08360 1.82966 2.12320 -33.71851 868.76242
1020.0000 -34.29957 -32.15282 2.14674 2.32161 -32.45867 1201.20692
1025.0000 -36.42884 -34.12703 2.30182 2.21049 -33.16426 1037.36406
1030.0000 -35.59196 -32.51261 3.07935 2.10652 -33.82442 955.68772
1035.0000 -35.41193 -33.13787 2.27406 2.23431 -33.01299 1044.55922
1040.0000 -35.62307 -32.90518 2.71789 2.23670 -32.99784 1084.04943
1045.0000 -35.79556 -33.78484 2.01072 2.13705 -33.63057 1009.63994
1050.0000 -35.77610 -33.07930 2.69680 2.12712 -33.69363 946.66755
1055.0000 -36.23217 -33.70480 2.52737 2.14772 -33.56284 1029.27079
1060.0000 -34.64921 -33.02564 1.62357 2.11800 -33.75153 921.81344
1065.0000 -35.30073 -32.99365 2.30708 2.28949 -32.66267 1019.60592
1070.0000 -34.74293 -32.63071 2.11222 2.31261 -32.51584 1084.01363
1075.0000 -34.38916 -31.87864 2.51053 2.40228 -31.94649 1128.05771
1080.0000 -35.42401 -33.06868 2.35533 2.19580 -33.25755 1012.49648
1085.0000 -35.12569 -32.78696 2.33873 2.20017 -33.22982 910.90157
1090.0000 -34.92414 -32.74812 2.17602 2.30093 -32.59001 1041.19581
1095.0000 -35.57893 -33.38548 2.19345 2.20702 -33.18630 1037.84359
1100.0000 -35.73445 -34.20823 1.52621 2.04838 -34.19358 866.23378
1105.0000 -35.51586 -33.63265 1.88320 2.14499 -33.58015 929.73019
1110.0000 -36.11948 -34.21872 1.90076 2.15896 -33.49145 966.93385
1115.0000 -35.51340 -33.51232 2.00108 2.07021 -34.05500 834.06971
1120.0000 -36.40455 -34.04220 2.36235 2.08553 -33.95770 902.94319
1125.0000 -36.09451 -34.01103 2.08348 2.07241 -34.04104 917.53258
1130.0000 -34.98481 -33.77226 1.21255 2.09544 -33.89478 904.14025
1135.0000 -35.41179 -33.10048 2.31131 2.18310 -33.33816 933.29319
1140.0000 -35.80607 -33.82170 1.98437 2.12457 -33.70983 969.85038
1145.0000 -34.95594 -32.57736 2.37858 2.20191 -33.21873 1018.54823
1150.0000 -34.64364 -33.11212 1.53152 2.22036 -33.10160 1001.44239
1155.0000 -35.78371 -33.54908 2.23463 2.17494 -33.39001 937.47482
1160.0000 -35.66619 -33.99533 1.67086 2.13001 -33.67526 936.80729
1165.0000 -35.35656 -33.93400 1.42256 2.13374 -33.65159 964.55072
1170.0000 -36.15568 -34.65752 1.49816 2.01759 -34.38911 846.49491
1175.0000 -34.85869 -32.39122 2.46747 2.12044 -33.73605 943.23548
1180.0000 -34.77134 -33.02327 1.74807 2.28411 -32.69678 1064.21944
1185.0000 -35.14976 -32.68454 2.46522 2.27588 -32.74904 983.90537
1190.0000 -34.93430 -33.13745 1.79685 2.20992 -33.16787 1113.83544
1195.0000 -35.69935 -33.51125 2.18810 2.20649 -33.18968 994.01249
1200.0000 -36.32694 -33.62839 2.69855 2.12249 -33.72300 959.75564
1205.0000 -34.84531 -32.43553 2.40979 2.27279 -32.76869 1161.05017
1210.0000 -34.60386 -32.14239 2.46147 2.30624 -32.55630 1147.88933
1215.0000 -34.72358 -33.26356 1.46002 2.28411 -32.69683 1050.54877
1220.0000 -35.60418 -33.82819 1.77600 2.17434 -33.39378 997.36215
1225.0000 -34.37826 -32.19918 2.17908 2.31344 -32.51059 1141.43630
1230.0000 -34.79629 -32.95176 1.84453 2.27456 -32.75746 1075.70075
1235.0000 -33.67950 -32.08648 1.59302 2.27123 -32.77856 1034.26719
1240.0000 -34.60948 -33.10143 1.50805 2.31802 -32.48149 1132.49711
1245.0000 -35.12479 -33.63384 1.49094 2.23087 -33.03484 958.19123
1250.0000 -35.80636 -33.51757 2.28879 2.08623 -33.95329 838.22483
FREEZING PROCESS: loop number 6 T-loop= 971.00000000000000
main_MD> interactions number 6 at Temperature= 971.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.48862 0.25264 0.04340
force_rgl> df(natom) 1.05325 -1.59248 1.05280
1255.0000 -35.58525 -33.39509 2.19016 2.11672 -33.75967 937.41998
1260.0000 -35.61695 -32.83374 2.78322 2.15129 -33.54013 990.64922
1265.0000 -35.64336 -34.38310 1.26026 2.15637 -33.50793 1001.63019
1270.0000 -35.91270 -33.48078 2.43191 2.07420 -34.02966 898.67637
1275.0000 -36.17504 -34.48863 1.68641 2.09635 -33.88901 851.43560
1280.0000 -36.14499 -34.00147 2.14352 2.02110 -34.36684 835.78956
1285.0000 -35.08475 -33.51624 1.56851 2.12588 -33.70151 938.33505
1290.0000 -36.15353 -34.50189 1.65164 2.07055 -34.05284 870.24509
1295.0000 -35.98069 -33.36846 2.61223 2.11994 -33.73922 969.50655
1300.0000 -35.89324 -33.44908 2.44415 2.14161 -33.60160 951.92814
1305.0000 -34.38200 -32.47174 1.91026 2.18977 -33.29581 1047.01614
1310.0000 -35.48899 -33.55432 1.93467 2.18540 -33.32357 1042.62369
1315.0000 -36.44939 -33.82224 2.62715 2.14002 -33.61172 965.89341
1320.0000 -35.25299 -33.52476 1.72823 2.10527 -33.83236 949.38872
1325.0000 -35.93274 -34.82155 1.11119 2.05829 -34.13065 793.87986
1330.0000 -35.30266 -33.90320 1.39947 2.06521 -34.08671 877.94014
1335.0000 -35.31246 -33.14169 2.17077 2.20262 -33.21422 868.60067
1340.0000 -34.40370 -32.88875 1.51495 2.23857 -32.98597 920.51706
1345.0000 -34.79980 -33.18840 1.61140 2.25345 -32.89151 997.89169
1350.0000 -35.17332 -33.45634 1.71698 2.15177 -33.53709 927.44179
1355.0000 -36.21370 -34.37461 1.83908 2.11600 -33.76421 914.48127
1360.0000 -35.93682 -33.74943 2.18740 1.96874 -34.69931 795.93653
1365.0000 -34.60600 -32.79526 1.81074 2.20112 -33.22374 1046.36171
1370.0000 -34.41372 -32.33681 2.07691 2.30424 -32.56899 1082.43604
1375.0000 -35.12070 -32.59997 2.52073 2.27072 -32.78183 997.94354
1380.0000 -35.05668 -31.86770 3.18898 2.35382 -32.25417 1288.26848
1385.0000 -34.23804 -31.70897 2.52908 2.47208 -31.50327 1258.44427
1390.0000 -34.40364 -32.60352 1.80012 2.30426 -32.56889 1021.24299
1395.0000 -35.28158 -33.39179 1.88979 2.23617 -33.00120 957.21784
1400.0000 -35.69404 -33.52195 2.17208 2.19846 -33.24065 1051.39812
1405.0000 -36.06138 -34.32828 1.73310 2.07617 -34.01716 891.28629
1410.0000 -34.76797 -32.76437 2.00361 2.15867 -33.49333 997.02285
1415.0000 -35.06056 -33.54621 1.51435 2.17946 -33.36131 967.11530
1420.0000 -35.88847 -33.47151 2.41696 2.12438 -33.71101 965.02719
1425.0000 -34.93784 -32.70016 2.23767 2.14030 -33.60992 936.82532
1430.0000 -35.60427 -33.98603 1.61824 2.20720 -33.18512 1043.12950
1435.0000 -35.27828 -33.13651 2.14178 2.14825 -33.55947 974.39993
1440.0000 -34.23389 -32.25366 1.98023 2.36148 -32.20553 1141.64871
1445.0000 -35.37175 -33.34701 2.02474 2.38561 -32.05233 1226.20026
1450.0000 -36.00915 -34.02631 1.98284 2.15318 -33.52819 1009.85302
1455.0000 -35.84298 -33.03962 2.80336 2.15492 -33.51714 954.52096
1460.0000 -35.51085 -33.71207 1.79878 2.18727 -33.31169 1086.63475
1465.0000 -35.44099 -33.94897 1.49202 2.13696 -33.63114 1002.05032
1470.0000 -35.66954 -33.15715 2.51239 2.20417 -33.20438 1049.42117
1475.0000 -35.37759 -33.39097 1.98662 2.21362 -33.14439 1067.94764
1480.0000 -35.93108 -34.17309 1.75799 2.15331 -33.52736 999.50786
1485.0000 -35.45085 -33.50119 1.94966 2.06986 -34.05722 883.80247
1490.0000 -35.82508 -33.60231 2.22277 2.16051 -33.48162 1011.68348
1495.0000 -36.11594 -33.62406 2.49187 2.12530 -33.70520 948.18538
1500.0000 -35.09305 -33.10044 1.99261 2.18329 -33.33700 1021.47270
FREEZING PROCESS: loop number 7 T-loop= 946.00000000000000
main_MD> interactions number 7 at Temperature= 946.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.89821 0.88881 -0.01439
force_rgl> df(natom) -0.65862 1.70846 3.27781
1505.0000 -35.48563 -33.25726 2.22837 2.19088 -33.28881 922.58961
1510.0000 -35.67246 -33.53312 2.13934 2.15110 -33.54135 986.31078
1515.0000 -35.26312 -33.02589 2.23724 2.22036 -33.10162 1038.14195
1520.0000 -34.98148 -33.11715 1.86433 2.24674 -32.93408 979.42850
1525.0000 -35.50822 -32.84438 2.66384 2.20838 -33.17767 987.39120
1530.0000 -35.48552 -32.84314 2.64239 2.31518 -32.49950 1115.68908
1535.0000 -34.55912 -32.64049 1.91863 2.24821 -32.92476 1096.97874
1540.0000 -35.21537 -32.64760 2.56777 2.28934 -32.66360 988.97130
1545.0000 -35.18642 -32.83439 2.35203 2.23607 -33.00186 965.84102
1550.0000 -35.10290 -33.12327 1.97962 2.21241 -33.15204 1061.60785
1555.0000 -34.68271 -32.56171 2.12100 2.27033 -32.78430 1083.01356
1560.0000 -35.29424 -33.49365 1.80060 2.22621 -33.06444 1024.71477
1565.0000 -36.01537 -33.93035 2.08502 2.20682 -33.18758 1056.03090
1570.0000 -35.82033 -33.77995 2.04038 2.08297 -33.97394 887.43408
1575.0000 -35.70078 -34.44477 1.25601 2.03079 -34.30531 865.92886
1580.0000 -35.32636 -33.82335 1.50301 2.05771 -34.13433 862.36729
1585.0000 -35.44301 -32.78185 2.66116 2.21066 -33.16316 1083.15116
1590.0000 -35.91161 -34.04327 1.86834 2.11266 -33.78543 848.16338
1595.0000 -35.84421 -34.42266 1.42155 2.01562 -34.40160 820.82889
1600.0000 -36.12181 -34.25784 1.86398 2.02340 -34.35221 788.83413
1605.0000 -35.79145 -33.96540 1.82605 2.10308 -33.84626 914.00651
1610.0000 -35.46004 -33.49438 1.96566 2.12967 -33.67746 796.64972
1615.0000 -35.24265 -33.54435 1.69830 2.13693 -33.63131 836.58657
1620.0000 -34.88159 -32.48471 2.39687 2.20489 -33.19984 1075.65461
1625.0000 -34.95769 -33.29482 1.66287 2.24314 -32.95693 1038.89821
1630.0000 -35.31545 -33.01460 2.30085 2.25717 -32.86785 1020.33822
1635.0000 -36.21998 -34.57177 1.64821 2.08630 -33.95279 907.82129
1640.0000 -36.08665 -34.47913 1.60752 1.97171 -34.68041 772.93034
1645.0000 -35.94854 -33.86279 2.08575 2.04512 -34.21430 819.26561
1650.0000 -35.40425 -33.33152 2.07272 2.18018 -33.35671 1092.39698
1655.0000 -34.65644 -32.74716 1.90929 2.17825 -33.36900 959.88860
1660.0000 -35.70135 -33.71344 1.98791 2.23515 -33.00769 1071.95931
1665.0000 -35.51483 -33.50295 2.01189 2.09685 -33.88582 934.01633
1670.0000 -35.39914 -33.93195 1.46719 2.19642 -33.25363 950.74402
1675.0000 -35.38993 -33.65681 1.73312 2.14673 -33.56914 984.75419
1680.0000 -35.11405 -32.81565 2.29840 2.18893 -33.30115 940.27339
1685.0000 -35.71939 -33.45304 2.26634 2.21036 -33.16511 984.23693
1690.0000 -36.23648 -33.78869 2.44779 2.13641 -33.63467 962.96159
1695.0000 -36.25630 -34.46403 1.79228 2.01045 -34.43442 772.25312
1700.0000 -35.54732 -33.94338 1.60393 2.08787 -33.94285 855.19795
1705.0000 -35.37621 -33.28896 2.08726 2.16189 -33.47283 1041.26734
1710.0000 -35.16900 -33.41179 1.75721 2.21172 -33.15642 1052.03807
1715.0000 -35.76124 -34.43101 1.33023 2.09546 -33.89467 894.05748
1720.0000 -36.55094 -34.23962 2.31132 2.05988 -34.12057 862.31580
1725.0000 -36.16812 -34.93932 1.22880 2.02368 -34.35046 880.33464
1730.0000 -36.15660 -34.28600 1.87060 2.01767 -34.38858 818.70236
1735.0000 -35.77571 -34.11623 1.65948 2.11712 -33.75714 901.09641
1740.0000 -36.04463 -34.08376 1.96088 2.08925 -33.93410 908.62741
1745.0000 -35.87425 -34.00394 1.87030 2.02455 -34.34494 862.99182
1750.0000 -35.45570 -33.96962 1.48608 2.13091 -33.66956 912.98942
FREEZING PROCESS: loop number 8 T-loop= 921.00000000000000
main_MD> interactions number 8 at Temperature= 921.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.12382 -5.71300 -3.56315
force_rgl> df(natom) -2.03202 2.05745 -0.43259
1755.0000 -36.45728 -34.69186 1.76542 2.02500 -34.34208 826.59174
1760.0000 -36.31574 -34.56990 1.74584 2.00823 -34.44851 827.42674
1765.0000 -35.98682 -34.55327 1.43355 2.02567 -34.33780 829.95671
1770.0000 -36.44264 -34.80726 1.63538 1.96109 -34.74788 680.21584
1775.0000 -35.98415 -34.43880 1.54535 2.04664 -34.20467 800.43084
1780.0000 -35.80529 -34.46426 1.34103 1.99823 -34.51205 821.68897
1785.0000 -35.65248 -34.29729 1.35519 2.06245 -34.10427 892.42892
1790.0000 -36.30821 -34.58958 1.71862 2.05983 -34.12088 962.31557
1795.0000 -35.92759 -34.42931 1.49828 1.98351 -34.60548 815.55847
1800.0000 -36.17246 -34.50630 1.66616 1.94837 -34.82863 732.06662
1805.0000 -36.07465 -34.43623 1.63842 2.00142 -34.49178 803.80849
1810.0000 -35.90309 -33.99158 1.91152 2.04673 -34.20406 758.63010
1815.0000 -35.74553 -33.59911 2.14642 2.05758 -34.13520 859.95074
1820.0000 -36.05101 -34.07927 1.97174 2.12601 -33.70068 944.66127
1825.0000 -34.75553 -33.47805 1.27748 2.18619 -33.31855 1006.09324
1830.0000 -35.23830 -33.52722 1.71108 2.16297 -33.46602 985.35457
1835.0000 -35.58612 -33.81230 1.77382 2.13438 -33.64751 889.88565
1840.0000 -36.23209 -33.72029 2.51180 2.07020 -34.05502 885.21894
1845.0000 -36.32607 -34.65024 1.67583 2.04264 -34.23001 865.81531
1850.0000 -35.56748 -33.68032 1.88716 2.02884 -34.31769 809.89120
1855.0000 -35.09619 -33.78495 1.31124 2.05286 -34.16517 875.95849
1860.0000 -34.36465 -32.80012 1.56452 2.22667 -33.06150 916.82074
1865.0000 -36.27031 -34.89758 1.37272 2.10990 -33.80295 924.77084
1870.0000 -36.21230 -34.87804 1.33425 1.95138 -34.80951 771.22144
1875.0000 -35.87685 -34.13978 1.73707 1.99406 -34.53853 751.72408
1880.0000 -36.04924 -34.75841 1.29083 1.99294 -34.54565 829.14419
1885.0000 -35.45126 -33.48052 1.97074 2.06649 -34.07862 930.37352
1890.0000 -34.87789 -32.48618 2.39171 2.29673 -32.61665 1043.75730
1895.0000 -35.66645 -33.44009 2.22637 2.29581 -32.62250 1034.05003
1900.0000 -34.98660 -33.10972 1.87688 2.20741 -33.18383 970.54994
1905.0000 -35.08463 -33.04042 2.04421 2.21158 -33.15734 879.77062
1910.0000 -36.31236 -34.40087 1.91149 2.10111 -33.85875 956.89148
1915.0000 -36.40073 -34.90025 1.50048 2.01471 -34.40740 749.25337
1920.0000 -35.77809 -34.00045 1.77764 1.97335 -34.67003 758.06467
1925.0000 -35.93992 -34.19185 1.74807 2.08477 -33.96252 941.85794
1930.0000 -36.01385 -34.58838 1.42547 2.05932 -34.12410 849.05380
1935.0000 -35.55607 -33.37764 2.17843 2.09874 -33.87385 883.19740
1940.0000 -35.21642 -33.51642 1.70000 2.15716 -33.50291 908.11587
1945.0000 -35.71075 -33.61343 2.09732 2.13478 -33.64502 934.03218
1950.0000 -35.43871 -33.05000 2.38871 2.21602 -33.12918 991.02352
1955.0000 -36.49406 -34.08924 2.40481 2.14588 -33.57454 958.97158
1960.0000 -35.08343 -33.60571 1.47772 2.04902 -34.18954 882.14808
1965.0000 -35.65022 -33.30413 2.34609 2.12932 -33.67967 1078.51572
1970.0000 -35.86811 -33.51364 2.35447 2.11767 -33.75364 964.26280
1975.0000 -35.91355 -33.78557 2.12797 2.10526 -33.83243 900.88059
1980.0000 -35.48237 -34.17203 1.31034 2.11908 -33.74469 919.51629
1985.0000 -35.95623 -33.85389 2.10235 2.05050 -34.18011 804.00393
1990.0000 -36.50764 -34.96309 1.54455 2.06598 -34.08182 908.77996
1995.0000 -36.05251 -34.26663 1.78588 2.01734 -34.39070 845.28980
2000.0000 -35.70806 -34.23136 1.47670 2.04388 -34.22214 831.71971
FREEZING PROCESS: loop number 9 T-loop= 896.00000000000000
main_MD> interactions number 9 at Temperature= 896.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.30369 2.19847 -2.18196
force_rgl> df(natom) -1.88348 -2.51157 -1.60523
2005.0000 -35.88481 -33.96295 1.92185 2.01717 -34.39178 833.91714
2010.0000 -35.41109 -33.98546 1.42563 2.15428 -33.52117 909.17712
2015.0000 -35.40463 -33.33926 2.06537 2.08214 -33.97922 828.59578
2020.0000 -35.90281 -34.12647 1.77634 2.18653 -33.31639 1046.25946
2025.0000 -35.95813 -34.28384 1.67429 2.06321 -34.09942 875.52296
2030.0000 -36.06378 -33.87044 2.19334 2.09469 -33.89957 897.89936
2035.0000 -35.66729 -34.10323 1.56405 2.08885 -33.93661 862.18630
2040.0000 -35.99422 -34.28167 1.71255 2.11460 -33.77310 949.60902
2045.0000 -36.27207 -34.75148 1.52059 2.03434 -34.28273 831.77981
2050.0000 -36.88553 -35.32258 1.56295 1.93558 -34.90986 766.73126
2055.0000 -35.82706 -34.44421 1.38285 1.95673 -34.77553 704.41369
2060.0000 -35.96740 -33.94582 2.02157 2.10144 -33.85667 953.27876
2065.0000 -34.97694 -33.06366 1.91328 2.16492 -33.45363 1040.37078
2070.0000 -35.79200 -34.06469 1.72731 2.09856 -33.87497 880.82400
2075.0000 -36.14249 -34.08886 2.05363 2.10824 -33.81349 912.52311
2080.0000 -36.31552 -34.67055 1.64497 2.01660 -34.39539 850.43067
2085.0000 -35.82435 -33.89589 1.92846 2.01063 -34.43327 806.71893
2090.0000 -34.96908 -33.78873 1.18035 2.09532 -33.89554 880.04378
2095.0000 -36.26883 -34.44777 1.82106 2.04249 -34.23101 841.36421
2100.0000 -36.76388 -35.27297 1.49091 1.98759 -34.57962 782.19900
2105.0000 -36.13820 -34.69120 1.44700 1.93456 -34.91630 709.62694
2110.0000 -36.29495 -34.32681 1.96815 1.97006 -34.69087 743.99359
2115.0000 -36.15378 -34.41429 1.73949 2.06147 -34.11046 866.66399
2120.0000 -35.87355 -34.03542 1.83813 1.99052 -34.56102 776.89812
2125.0000 -35.11390 -33.78875 1.32515 2.16089 -33.47921 989.12163
2130.0000 -35.58448 -32.76766 2.81682 2.13779 -33.62590 821.56572
2135.0000 -34.77767 -32.22035 2.55731 2.20065 -33.22675 1060.66113
2140.0000 -36.23600 -34.26178 1.97421 2.15627 -33.50853 1016.39922
2145.0000 -35.58388 -33.34364 2.24024 2.09020 -33.92805 949.70418
2150.0000 -36.31763 -33.51957 2.79805 2.10524 -33.83253 923.32869
2155.0000 -35.10796 -33.36298 1.74498 2.22972 -33.04214 980.57340
2160.0000 -34.86335 -33.26118 1.60217 2.19680 -33.25119 978.96360
2165.0000 -35.80362 -34.22422 1.57940 2.13136 -33.66671 844.83828
2170.0000 -36.44002 -34.71212 1.72790 2.06705 -34.07503 829.98959
2175.0000 -35.51340 -33.73597 1.77743 2.03747 -34.26288 867.54401
2180.0000 -35.22593 -33.45191 1.77401 2.19620 -33.25502 1027.82602
2185.0000 -36.06407 -33.75514 2.30893 2.19326 -33.27364 1009.46357
2190.0000 -36.16383 -34.68047 1.48336 2.03840 -34.25694 877.83877
2195.0000 -36.36349 -34.62033 1.74316 1.99007 -34.56382 806.00087
2200.0000 -35.54701 -34.01298 1.53403 2.12395 -33.71377 887.45526
2205.0000 -35.87407 -33.75280 2.12127 2.05072 -34.17875 862.75483
2210.0000 -35.62302 -33.38627 2.23676 2.10481 -33.83529 829.78971
2215.0000 -35.98804 -34.26103 1.72701 2.20468 -33.20115 1018.35505
2220.0000 -35.28615 -34.01340 1.27275 2.11091 -33.79653 973.20899
2225.0000 -35.56969 -33.48577 2.08392 2.13709 -33.63035 950.94591
2230.0000 -35.79754 -33.53208 2.26546 2.16502 -33.45297 956.06037
2235.0000 -35.02649 -33.34632 1.68016 2.12073 -33.73422 905.53228
2240.0000 -36.16243 -34.20957 1.95285 2.12957 -33.67809 917.12882
2245.0000 -35.76174 -34.29244 1.46930 2.06895 -34.06300 815.47930
2250.0000 -35.12093 -33.43659 1.68434 2.14386 -33.58736 1033.10021
FREEZING PROCESS: loop number 10 T-loop= 871.00000000000000
main_MD> interactions number 10 at Temperature= 871.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.94317 -2.00338 -1.97108
force_rgl> df(natom) -2.40027 0.14116 1.68895
2255.0000 -36.05001 -33.24477 2.80523 2.14039 -33.60940 1040.81662
2260.0000 -34.12417 -32.56679 1.55738 2.24494 -32.94550 1096.97637
2265.0000 -35.73524 -33.19108 2.54417 2.23419 -33.01378 1174.34508
2270.0000 -35.80342 -33.66363 2.13978 2.22768 -33.05513 942.96965
2275.0000 -35.88044 -34.20770 1.67274 2.07198 -34.04372 919.58407
2280.0000 -35.77482 -33.92451 1.85031 2.04376 -34.22293 888.63893
2285.0000 -36.44034 -34.14035 2.29999 2.01636 -34.39691 792.97058
2290.0000 -35.86931 -33.91871 1.95060 2.13340 -33.65375 980.25074
2295.0000 -35.98319 -33.73956 2.24363 2.11033 -33.80025 934.38042
2300.0000 -35.24577 -33.71328 1.53249 2.15444 -33.52019 997.91032
2305.0000 -34.74951 -32.94158 1.80793 2.14530 -33.57817 859.75377
2310.0000 -35.03527 -32.93387 2.10140 2.24600 -32.93876 1103.91315
2315.0000 -34.72677 -32.69502 2.03176 2.24682 -32.93358 1023.17777
2320.0000 -35.18271 -32.82522 2.35749 2.29596 -32.62154 979.39963
2325.0000 -34.42537 -32.20580 2.21957 2.31951 -32.47203 1102.81243
2330.0000 -36.67478 -34.73224 1.94254 2.17466 -33.39175 970.62974
2335.0000 -36.42712 -34.69301 1.73411 2.03975 -34.24837 866.01012
2340.0000 -35.78061 -34.47333 1.30728 2.03617 -34.27113 727.25783
2345.0000 -36.25211 -34.58244 1.66966 1.97220 -34.67733 763.08138
2350.0000 -35.93781 -33.63636 2.30145 2.07813 -34.00467 866.28878
2355.0000 -35.67041 -33.61189 2.05852 2.12522 -33.70569 925.23423
2360.0000 -35.12842 -32.54713 2.58128 2.22363 -33.08084 1030.66929
2365.0000 -36.36945 -34.77548 1.59396 2.14531 -33.57812 950.49187
2370.0000 -36.33255 -34.66055 1.67200 1.93160 -34.93511 709.27990
2375.0000 -34.73307 -33.33643 1.39664 2.14972 -33.55015 1000.23620
2380.0000 -36.09663 -34.20708 1.88955 2.15715 -33.50293 996.90411
2385.0000 -36.23361 -34.29250 1.94111 2.03582 -34.27336 865.60032
2390.0000 -35.58206 -34.16971 1.41235 2.02041 -34.37120 821.74006
2395.0000 -35.66688 -33.95263 1.71425 2.09227 -33.91494 854.44990
2400.0000 -35.03040 -33.36783 1.66257 2.17723 -33.37547 992.57671
2405.0000 -35.61397 -33.04481 2.56916 2.18337 -33.33645 926.09608
2410.0000 -34.89883 -32.49369 2.40514 2.28488 -32.69193 1140.72894
2415.0000 -35.51879 -33.88459 1.63420 2.14528 -33.57829 893.37602
2420.0000 -35.35909 -33.21501 2.14408 2.16291 -33.46640 934.07450
2425.0000 -36.22391 -33.80862 2.41529 2.14850 -33.55789 901.27104
2430.0000 -36.26438 -34.65908 1.60530 1.98804 -34.57676 728.54237
2435.0000 -36.25617 -34.26943 1.98673 1.97139 -34.68243 750.79619
2440.0000 -35.81752 -34.77899 1.03853 2.02089 -34.36813 790.04660
2445.0000 -35.88899 -34.61540 1.27360 1.98606 -34.58929 780.02366
2450.0000 -36.40680 -35.12622 1.28058 1.99315 -34.54426 790.34153
2455.0000 -36.16666 -34.45768 1.70899 1.97235 -34.67638 805.99998
2460.0000 -35.35109 -33.58311 1.76798 2.05627 -34.14351 846.91797
2465.0000 -35.82402 -33.63257 2.19145 2.11611 -33.76356 919.31271
2470.0000 -35.37909 -33.40790 1.97119 2.14692 -33.56790 1004.03759
2475.0000 -35.88483 -34.36821 1.51662 2.09219 -33.91543 821.36646
2480.0000 -35.60657 -33.43765 2.16892 2.07064 -34.05224 887.39209
2485.0000 -35.78103 -34.47760 1.30344 2.05323 -34.16278 884.07688
2490.0000 -36.08004 -34.12319 1.95684 2.02237 -34.35874 849.04328
2495.0000 -35.81391 -33.57291 2.24100 2.07549 -34.02145 877.18066
2500.0000 -36.24052 -34.07852 2.16200 2.03192 -34.29813 840.04211
FREEZING PROCESS: loop number 11 T-loop= 846.00000000000000
main_MD> interactions number 11 at Temperature= 846.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.73228 -0.92380 -2.65444
force_rgl> df(natom) 1.16068 -0.32686 -0.25597
2505.0000 -35.35766 -33.79463 1.56303 2.04767 -34.19809 830.31939
2510.0000 -35.10988 -33.47171 1.63817 2.11167 -33.79175 866.35502
2515.0000 -35.99571 -34.25334 1.74237 2.07263 -34.03959 901.22642
2520.0000 -35.25119 -33.83441 1.41678 2.12715 -33.69343 1021.78742
2525.0000 -35.60242 -33.99958 1.60284 2.14124 -33.60394 916.53953
2530.0000 -36.03088 -34.63095 1.39993 2.00994 -34.43769 783.78724
2535.0000 -36.34014 -34.39047 1.94967 1.99676 -34.52139 801.25813
2540.0000 -36.36798 -35.45076 0.91722 1.94830 -34.82906 715.91039
2545.0000 -36.11393 -34.24645 1.86748 1.99019 -34.56309 754.69999
2550.0000 -36.13560 -34.30738 1.82822 2.05760 -34.13508 837.98960
2555.0000 -35.70943 -33.33175 2.37768 2.03090 -34.30461 850.12269
2560.0000 -35.59992 -33.65228 1.94764 2.13587 -33.63806 956.84084
2565.0000 -35.51336 -33.85642 1.65694 2.11350 -33.78013 941.18121
2570.0000 -35.45067 -33.91216 1.53851 2.04091 -34.24103 820.94864
2575.0000 -35.15995 -33.80718 1.35277 2.10542 -33.83139 839.47042
2580.0000 -36.08036 -34.62583 1.45453 2.11758 -33.75423 920.19567
2585.0000 -35.86788 -34.33568 1.53220 2.01369 -34.41386 791.52627
2590.0000 -35.15314 -33.47667 1.67648 2.02952 -34.31333 849.68411
2595.0000 -36.13607 -34.04012 2.09594 2.07293 -34.03771 950.51656
2600.0000 -36.27727 -34.50160 1.77567 2.08852 -33.93874 908.47724
2605.0000 -35.57528 -33.52579 2.04950 2.03106 -34.30357 822.19468
2610.0000 -36.04791 -34.29986 1.74805 2.03447 -34.28193 798.98986
2615.0000 -35.74217 -34.03860 1.70357 2.02556 -34.33848 794.96640
2620.0000 -36.10540 -33.74346 2.36194 2.13230 -33.66075 957.55876
2625.0000 -36.14407 -34.60290 1.54116 2.00935 -34.44139 814.61376
2630.0000 -36.53762 -34.69629 1.84134 2.01231 -34.42262 842.95150
2635.0000 -36.24729 -34.72478 1.52252 1.95855 -34.76396 723.25724
2640.0000 -36.39343 -34.16278 2.23065 2.00539 -34.46657 794.33571
2645.0000 -35.63331 -33.53630 2.09701 2.09732 -33.88282 922.15246
2650.0000 -35.55332 -33.60325 1.95007 2.13416 -33.64894 934.03744
2655.0000 -36.48134 -33.93185 2.54949 2.10792 -33.81557 862.18929
2660.0000 -36.12100 -34.77135 1.34965 1.98902 -34.57048 788.81875
2665.0000 -35.60341 -34.12774 1.47568 2.02485 -34.34302 808.34224
2670.0000 -35.01483 -33.31394 1.70089 2.07612 -34.01748 849.04145
2675.0000 -35.54219 -33.67302 1.86917 2.14302 -33.59270 961.75555
2680.0000 -35.56263 -33.15005 2.41259 2.14568 -33.57576 960.32719
2685.0000 -35.28960 -33.55382 1.73579 2.15449 -33.51984 963.80189
2690.0000 -35.41995 -34.00931 1.41064 2.09605 -33.89093 888.92981
2695.0000 -36.02450 -35.17277 0.85173 1.98254 -34.61167 744.45702
2700.0000 -36.69014 -34.94981 1.74033 1.89929 -35.14027 676.34412
2705.0000 -36.25655 -34.81767 1.43888 1.96951 -34.69440 858.26717
2710.0000 -35.85200 -34.22406 1.62794 2.01333 -34.41616 790.11236
2715.0000 -36.30587 -34.44434 1.86153 1.96023 -34.75333 746.21488
2720.0000 -36.10149 -34.00601 2.09548 2.08705 -33.94808 1000.12134
2725.0000 -35.84420 -34.15416 1.69005 2.09730 -33.88296 922.11397
2730.0000 -35.60125 -33.54151 2.05974 2.12747 -33.69140 942.42559
2735.0000 -35.91202 -34.46072 1.45130 2.05159 -34.17323 822.83441
2740.0000 -36.50266 -34.31054 2.19212 1.99051 -34.56103 816.25303
2745.0000 -35.54052 -33.56195 1.97857 2.08583 -33.95577 928.37545
2750.0000 -35.74432 -33.67746 2.06686 2.17032 -33.41931 943.46904
FREEZING PROCESS: loop number 12 T-loop= 821.00000000000000
main_MD> interactions number 12 at Temperature= 821.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.48941 -2.13679 2.12911
force_rgl> df(natom) 0.37814 -0.32960 0.66783
2755.0000 -35.97970 -34.00488 1.97482 2.05946 -34.12324 862.72809
2760.0000 -35.80547 -34.39426 1.41121 2.01235 -34.42239 845.91096
2765.0000 -36.33312 -34.65945 1.67366 1.99771 -34.51536 811.91531
2770.0000 -36.29976 -34.54065 1.75911 2.01595 -34.39954 806.61197
2775.0000 -35.72432 -34.70524 1.01908 2.01652 -34.39591 753.68433
2780.0000 -36.43638 -35.08327 1.35311 1.95150 -34.80875 684.22423
2785.0000 -36.53951 -34.99219 1.54733 1.88378 -35.23875 632.65702
2790.0000 -36.83527 -34.55064 2.28464 1.96051 -34.75157 758.78408
2795.0000 -35.91371 -34.13121 1.78249 2.03504 -34.27833 830.03482
2800.0000 -36.66220 -35.63330 1.02890 2.00414 -34.47451 862.66127
2805.0000 -36.67328 -35.09538 1.57790 1.84843 -35.46319 610.37962
2810.0000 -36.60299 -35.03523 1.56776 1.90442 -35.10771 692.12821
2815.0000 -36.83168 -35.45612 1.37556 1.89862 -35.14451 677.51807
2820.0000 -36.78480 -34.91289 1.87191 1.86413 -35.36351 646.14026
2825.0000 -36.07433 -34.31980 1.75453 1.98533 -34.59394 840.45773
2830.0000 -36.10925 -33.92269 2.18655 2.03605 -34.27188 801.29045
2835.0000 -36.02509 -34.48539 1.53970 2.04186 -34.23499 856.75915
2840.0000 -36.23191 -34.89560 1.33631 1.96606 -34.71627 726.16332
2845.0000 -36.46986 -34.56826 1.90160 1.95075 -34.81348 748.15632
2850.0000 -36.18188 -34.67576 1.50612 2.03016 -34.30931 871.59684
2855.0000 -35.93299 -34.36427 1.56872 2.01190 -34.42522 802.98469
2860.0000 -36.02212 -34.38462 1.63749 2.01558 -34.40186 783.55588
2865.0000 -36.53510 -35.07323 1.46187 1.93189 -34.93328 737.50869
2870.0000 -36.32617 -34.56961 1.75656 1.92499 -34.97710 691.14120
2875.0000 -36.31783 -34.59889 1.71894 1.97635 -34.65094 772.43970
2880.0000 -36.70456 -35.10558 1.59898 1.95720 -34.77254 772.34501
2885.0000 -35.85313 -34.05554 1.79759 2.02309 -34.35415 787.30700
2890.0000 -35.59164 -33.87638 1.71526 2.02311 -34.35404 763.11443
2895.0000 -35.65514 -34.14988 1.50526 2.02429 -34.34659 817.28091
2900.0000 -36.37972 -34.62198 1.75774 2.01450 -34.40872 799.14347
2905.0000 -36.60871 -34.89331 1.71541 1.95125 -34.81032 733.26031
2910.0000 -35.32482 -33.68916 1.63566 2.02551 -34.33882 783.01800
2915.0000 -36.43354 -34.29029 2.14325 2.01182 -34.42573 841.25992
2920.0000 -36.07069 -34.28136 1.78934 2.05441 -34.15529 896.10445
2925.0000 -36.60255 -34.56468 2.03787 2.02322 -34.35333 786.54703
2930.0000 -36.92491 -34.94693 1.97798 1.96042 -34.75211 737.85784
2935.0000 -36.03613 -34.70446 1.33168 2.00996 -34.43754 814.14421
2940.0000 -36.26411 -34.55102 1.71310 1.98246 -34.61214 791.71166
2945.0000 -36.67043 -35.37453 1.29591 1.93305 -34.92592 771.26263
2950.0000 -36.44634 -34.40058 2.04576 1.94741 -34.83472 752.47515
2955.0000 -35.73215 -34.16202 1.57014 2.12085 -33.73341 935.77063
2960.0000 -36.11611 -34.67183 1.44428 2.01569 -34.40118 837.77778
2965.0000 -36.54625 -34.95295 1.59330 1.94494 -34.85040 736.49965
2970.0000 -36.08224 -34.69950 1.38274 1.97150 -34.68179 742.20546
2975.0000 -36.67550 -35.47726 1.19824 1.90000 -35.13578 678.12967
2980.0000 -35.86052 -34.34717 1.51335 1.98204 -34.61481 767.97133
2985.0000 -35.49954 -33.68889 1.81065 2.08949 -33.93260 865.91819
2990.0000 -36.37265 -33.94911 2.42354 2.07137 -34.04759 848.84239
2995.0000 -36.48252 -34.48512 1.99740 2.11629 -33.76242 910.37644
3000.0000 -35.34845 -33.54986 1.79859 2.05704 -34.13863 826.16158
FREEZING PROCESS: loop number 13 T-loop= 796.00000000000000
main_MD> interactions number 13 at Temperature= 796.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.94085 -2.75324 0.14709
force_rgl> df(natom) -1.14048 1.28572 -0.13636
3005.0000 -34.83581 -33.18043 1.65538 2.16411 -33.45876 905.93077
3010.0000 -35.53174 -34.22620 1.30554 2.12735 -33.69215 948.53682
3015.0000 -36.28982 -34.60017 1.68965 1.91839 -35.01899 693.98954
3020.0000 -35.97308 -34.70812 1.26496 2.04269 -34.22972 849.83943
3025.0000 -35.99299 -34.11643 1.87656 2.01616 -34.39821 842.29307
3030.0000 -36.16462 -35.13276 1.03186 1.93706 -34.90043 737.15745
3035.0000 -36.56880 -35.62167 0.94712 1.88803 -35.21179 648.22390
3040.0000 -36.89040 -35.00253 1.88787 1.87982 -35.26387 665.77335
3045.0000 -35.96561 -33.58900 2.37661 2.00110 -34.49378 777.64459
3050.0000 -36.07941 -34.21400 1.86541 2.12015 -33.73790 905.89073
3055.0000 -36.15229 -34.58092 1.57138 2.00077 -34.49592 800.63554
3060.0000 -35.58904 -34.47270 1.11634 2.01210 -34.42398 709.36220
3065.0000 -35.95695 -34.68020 1.27675 2.04887 -34.19050 882.69247
3070.0000 -36.29943 -34.57812 1.72131 1.91179 -35.06089 691.67270
3075.0000 -36.82364 -34.83260 1.99104 1.95636 -34.77787 760.85719
3080.0000 -35.93367 -34.36841 1.56527 1.98578 -34.59106 736.30656
3085.0000 -36.38961 -34.66530 1.72431 2.04799 -34.19610 847.87280
3090.0000 -36.25347 -34.67418 1.57929 1.95402 -34.79273 691.17800
3095.0000 -36.65510 -34.40396 2.25114 2.03362 -34.28731 804.46582
3100.0000 -35.89647 -34.20133 1.69514 2.10914 -33.80779 898.55904
3105.0000 -35.47856 -34.20658 1.27198 2.04360 -34.22392 777.50819
3110.0000 -35.92974 -34.21833 1.71141 2.05960 -34.12238 781.42178
3115.0000 -36.62686 -35.10728 1.51959 1.94810 -34.83033 724.03969
3120.0000 -35.21377 -33.78624 1.42754 2.00946 -34.44072 773.89839
3125.0000 -36.09229 -34.57755 1.51474 2.13119 -33.66781 881.97262
3130.0000 -36.63849 -34.96904 1.66945 1.96936 -34.69533 752.61992
3135.0000 -36.30662 -34.82240 1.48423 2.00531 -34.46707 825.35480
3140.0000 -36.29543 -34.56747 1.72796 1.99158 -34.55424 846.23297
3145.0000 -35.75060 -34.28045 1.47014 1.95225 -34.80397 831.22085
3150.0000 -35.87504 -34.71477 1.16027 2.00018 -34.49966 785.89576
3155.0000 -35.84488 -34.33821 1.50667 2.00743 -34.45364 784.25154
3160.0000 -36.40759 -35.09066 1.31694 1.95792 -34.76797 734.27527
3165.0000 -35.99345 -34.66956 1.32389 1.97329 -34.67036 802.03944
3170.0000 -36.15265 -34.66980 1.48285 1.94163 -34.87142 758.44661
3175.0000 -36.24259 -34.51596 1.72663 1.98174 -34.61674 893.06662
3180.0000 -36.11484 -34.13667 1.97818 1.99491 -34.53308 921.44553
3185.0000 -36.49600 -34.72054 1.77546 2.00999 -34.43735 853.73883
3190.0000 -35.62042 -33.61994 2.00048 2.01461 -34.40804 821.31746
3195.0000 -36.46460 -34.43543 2.02917 2.08021 -33.99148 920.29860
3200.0000 -35.80987 -34.39046 1.41942 2.03601 -34.27214 859.32281
3205.0000 -36.25130 -34.86715 1.38414 1.98648 -34.58665 690.48177
3210.0000 -36.37183 -34.92368 1.44815 1.91142 -35.06325 718.41171
3215.0000 -36.49515 -34.23870 2.25644 1.96378 -34.73075 759.47094
3220.0000 -36.28882 -34.50028 1.78854 2.10337 -33.84445 958.59687
3225.0000 -35.80712 -33.71503 2.09208 2.06085 -34.11442 885.05731
3230.0000 -35.81593 -33.92701 1.88892 2.08099 -33.98657 827.56194
3235.0000 -35.43419 -34.15630 1.27789 2.05026 -34.18164 830.43017
3240.0000 -35.95011 -34.58106 1.36905 1.98628 -34.58793 794.16241
3245.0000 -36.43436 -34.71464 1.71972 1.95998 -34.75491 772.81570
3250.0000 -36.36723 -34.92906 1.43816 1.98388 -34.60312 835.27464
FREEZING PROCESS: loop number 14 T-loop= 771.00000000000000
main_MD> interactions number 14 at Temperature= 771.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.26632 -0.23520 1.75198
force_rgl> df(natom) -4.10057 -3.66985 -2.33943
3255.0000 -36.78616 -34.91026 1.87590 1.91457 -35.04323 691.05092
3260.0000 -36.36000 -35.17938 1.18062 1.94209 -34.86851 721.96636
3265.0000 -36.79487 -35.71248 1.08239 1.88653 -35.22129 670.22877
3270.0000 -36.62609 -35.61996 1.00612 1.80123 -35.76288 575.59899
3275.0000 -36.40501 -34.78760 1.61741 1.89395 -35.17414 641.99815
3280.0000 -36.29287 -34.66689 1.62598 1.95931 -34.75916 696.83968
3285.0000 -35.67597 -34.33440 1.34156 1.96875 -34.69924 749.80904
3290.0000 -36.60947 -35.04351 1.56596 1.96041 -34.75219 745.92344
3295.0000 -36.05846 -34.90664 1.15182 1.94091 -34.87602 688.34311
3300.0000 -35.94693 -34.26531 1.68162 2.00513 -34.46824 793.62454
3305.0000 -36.28864 -34.46673 1.82191 1.96686 -34.71123 782.61281
3310.0000 -36.25972 -34.77900 1.48072 1.96431 -34.72738 767.14790
3315.0000 -35.91588 -34.82644 1.08944 1.94102 -34.87530 713.47827
3320.0000 -36.04930 -34.47450 1.57480 1.96429 -34.72756 706.35802
3325.0000 -36.55022 -34.61650 1.93372 1.91441 -35.04427 706.14858
3330.0000 -35.92569 -34.43322 1.49247 1.95812 -34.76670 771.79709
3335.0000 -36.50064 -34.77954 1.72110 1.93530 -34.91162 740.75844
3340.0000 -36.41579 -35.12171 1.29409 1.92638 -34.96823 742.86383
3345.0000 -36.53424 -35.25158 1.28266 1.89893 -35.14254 678.99554
3350.0000 -35.64022 -34.09472 1.54550 1.96733 -34.70826 740.87595
3355.0000 -35.91988 -34.01088 1.90900 2.09123 -33.92151 888.76862
3360.0000 -36.32539 -34.74382 1.58157 2.03113 -34.30315 829.84944
3365.0000 -36.26675 -34.13543 2.13131 1.96476 -34.72455 755.38047
3370.0000 -35.48203 -33.69650 1.78553 2.12035 -33.73661 949.83636
3375.0000 -35.01416 -33.44029 1.57387 2.14918 -33.55359 894.65364
3380.0000 -36.56309 -34.59323 1.96986 2.10899 -33.80872 874.43735
3385.0000 -36.54153 -34.81175 1.72978 1.92870 -34.95349 744.40474
3390.0000 -36.97507 -35.63750 1.33757 1.88665 -35.22052 689.60286
3395.0000 -36.65630 -35.07798 1.57832 1.92570 -34.97255 705.86142
3400.0000 -36.18380 -34.75394 1.42985 1.95401 -34.79279 764.11826
3405.0000 -35.66717 -33.86994 1.79723 2.02357 -34.35111 796.08949
3410.0000 -35.59654 -34.28549 1.31105 2.07694 -34.01224 829.73149
3415.0000 -36.32524 -34.13790 2.18734 2.07879 -34.00051 942.07673
3420.0000 -35.77719 -34.25681 1.52038 2.04172 -34.23590 836.52274
3425.0000 -36.13801 -34.62614 1.51187 1.99678 -34.52126 785.89194
3430.0000 -35.71182 -33.84582 1.86599 2.05196 -34.17089 850.43495
3435.0000 -36.16656 -34.04278 2.12378 2.11983 -33.73994 944.05845
3440.0000 -35.71324 -34.01819 1.69505 2.06105 -34.11317 877.63418
3445.0000 -35.40461 -33.20932 2.19529 2.14922 -33.55331 929.11685
3450.0000 -35.97604 -34.30609 1.66995 2.14954 -33.55129 976.86028
3455.0000 -36.44444 -34.83441 1.61004 1.95263 -34.80158 771.85265
3460.0000 -36.42191 -35.02193 1.39998 1.93345 -34.92336 693.26455
3465.0000 -36.22180 -34.90362 1.31819 1.96784 -34.70499 746.93966
3470.0000 -36.37763 -34.77713 1.60051 1.91579 -35.03549 697.92343
3475.0000 -36.36116 -34.38096 1.98020 1.98397 -34.60255 756.29622
3480.0000 -36.68518 -35.66144 1.02374 1.96301 -34.73563 740.96163
3485.0000 -36.71177 -35.45720 1.25457 1.80544 -35.73618 539.88692
3490.0000 -36.27451 -34.89875 1.37576 1.85416 -35.42684 577.83956
3495.0000 -36.04845 -34.46431 1.58414 1.93099 -34.93898 692.43766
3500.0000 -36.13508 -34.62488 1.51021 1.93223 -34.93107 751.57517
FREEZING PROCESS: loop number 15 T-loop= 746.00000000000000
main_MD> interactions number 15 at Temperature= 746.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.66914 -1.57386 0.35993
force_rgl> df(natom) -1.94580 2.59844 1.16492
3505.0000 -35.83051 -34.09611 1.73440 2.02712 -34.32857 808.20127
3510.0000 -36.29589 -33.80659 2.48930 2.09740 -33.88236 933.16302
3515.0000 -35.87211 -34.39686 1.47524 2.11515 -33.76966 924.16628
3520.0000 -36.06830 -34.58374 1.48456 2.00222 -34.48670 731.43442
3525.0000 -36.02106 -34.16881 1.85224 2.02246 -34.35816 813.64799
3530.0000 -35.80002 -33.94402 1.85600 2.03588 -34.27299 819.03029
3535.0000 -36.51009 -34.62047 1.88963 2.03676 -34.26735 856.07152
3540.0000 -36.17018 -34.70234 1.46784 1.98448 -34.59932 799.57936
3545.0000 -36.64562 -34.82791 1.81771 1.93796 -34.89473 752.22536
3550.0000 -36.19010 -34.35831 1.83179 1.96548 -34.71997 848.65183
3555.0000 -36.01236 -34.30348 1.70888 2.02186 -34.36202 832.54386
3560.0000 -35.96588 -34.28257 1.68331 2.07608 -34.01770 845.60615
3565.0000 -35.84421 -34.27568 1.56853 2.04423 -34.21994 823.16823
3570.0000 -36.43805 -34.70048 1.73758 2.05043 -34.18056 826.85324
3575.0000 -36.60384 -35.74390 0.85994 1.85183 -35.44160 647.49161
3580.0000 -36.94060 -35.88598 1.05461 1.84130 -35.50849 605.86523
3585.0000 -36.81484 -35.76895 1.04589 1.81171 -35.69638 559.39207
3590.0000 -36.75779 -35.39461 1.36318 1.82552 -35.60866 571.57208
3595.0000 -36.40875 -35.24258 1.16617 1.86842 -35.33630 652.90300
3600.0000 -35.71596 -33.78972 1.92624 1.94583 -34.84473 740.72821
3605.0000 -36.15660 -33.62578 2.53082 2.11258 -33.78594 979.84231
3610.0000 -35.52844 -34.24589 1.28255 2.05105 -34.17666 862.88136
3615.0000 -36.50421 -35.11730 1.38691 1.98188 -34.61584 821.50935
3620.0000 -35.88978 -34.44103 1.44874 1.96905 -34.69734 775.33181
3625.0000 -36.08233 -34.22074 1.86159 2.03322 -34.28984 823.91777
3630.0000 -36.09708 -34.48434 1.61274 2.05277 -34.16569 853.63759
3635.0000 -36.51230 -35.05335 1.45896 1.93996 -34.88201 661.30760
3640.0000 -36.00082 -34.67999 1.32083 1.96409 -34.72878 773.41135
3645.0000 -36.34304 -34.72332 1.61971 1.97764 -34.64278 784.15118
3650.0000 -36.32279 -34.63032 1.69247 1.91443 -35.04416 662.17247
3655.0000 -35.68379 -34.36150 1.32229 2.04892 -34.19017 837.80913
3660.0000 -35.58477 -34.09410 1.49067 2.08986 -33.93022 895.90036
3665.0000 -36.25233 -34.22742 2.02491 2.06381 -34.09561 840.43023
3670.0000 -36.10757 -34.63733 1.47024 2.00716 -34.45531 794.08288
3675.0000 -36.50069 -35.36222 1.13848 1.89088 -35.19368 642.39949
3680.0000 -36.42577 -34.61936 1.80641 1.89764 -35.15077 611.57615
3685.0000 -36.30862 -35.13729 1.17133 1.93011 -34.94459 691.44823
3690.0000 -36.39429 -35.27444 1.11985 1.90966 -35.07443 686.42959
3695.0000 -36.67405 -35.26516 1.40888 1.91479 -35.04182 679.09301
3700.0000 -36.14188 -34.77267 1.36921 1.88138 -35.25395 657.02956
3705.0000 -36.78708 -34.57468 2.21239 1.97997 -34.62800 769.41072
3710.0000 -36.32256 -35.24649 1.07607 1.90407 -35.10991 673.63001
3715.0000 -36.83138 -35.04821 1.78318 1.93706 -34.90045 718.96624
3720.0000 -36.30358 -35.03470 1.26888 1.89934 -35.13995 717.02293
3725.0000 -36.88359 -35.03514 1.84845 1.89336 -35.17794 687.62048
3730.0000 -37.16285 -35.93402 1.22883 1.78726 -35.85160 550.33976
3735.0000 -36.13427 -34.66690 1.46738 1.82868 -35.58861 590.07177
3740.0000 -35.68725 -34.39602 1.29124 1.95719 -34.77264 692.10409
3745.0000 -36.36966 -34.69644 1.67322 1.97098 -34.68507 739.04406
3750.0000 -36.76014 -34.57936 2.18078 1.93989 -34.88247 739.26208
FREEZING PROCESS: loop number 16 T-loop= 721.00000000000000
main_MD> interactions number 16 at Temperature= 721.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.88197 0.35491 -1.06924
force_rgl> df(natom) 0.83603 -1.45709 -1.92319
3755.0000 -36.62647 -35.07246 1.55401 1.96471 -34.72489 758.63780
3760.0000 -35.95436 -34.33751 1.61685 1.98135 -34.61922 779.75929
3765.0000 -36.08204 -34.28953 1.79251 1.98294 -34.60911 781.01030
3770.0000 -35.77789 -34.27636 1.50154 2.08064 -33.98873 858.17372
3775.0000 -36.58224 -34.68401 1.89824 1.99526 -34.53088 795.98772
3780.0000 -36.37147 -34.39684 1.97462 1.99073 -34.55966 873.89519
3785.0000 -36.59029 -35.03215 1.55814 2.03481 -34.27974 878.20425
3790.0000 -36.19664 -35.16451 1.03213 1.94147 -34.87245 700.05285
3795.0000 -36.20341 -34.65747 1.54595 1.93361 -34.92235 708.84060
3800.0000 -36.08693 -34.33764 1.74929 1.98888 -34.57142 810.60415
3805.0000 -36.52027 -35.09629 1.42398 1.95825 -34.76590 763.60110
3810.0000 -36.49204 -34.85562 1.63642 1.96337 -34.73339 698.38243
3815.0000 -36.72160 -35.38626 1.33534 1.88164 -35.25233 690.59297
3820.0000 -37.06272 -35.97658 1.08615 1.86603 -35.35142 638.61997
3825.0000 -36.29098 -35.38321 0.90777 1.81836 -35.65410 576.41782
3830.0000 -36.97501 -35.24373 1.73128 1.86110 -35.38278 609.59514
3835.0000 -36.33601 -34.82316 1.51285 1.87056 -35.32271 591.12405
3840.0000 -36.38054 -34.82651 1.55403 1.95575 -34.78178 725.58274
3845.0000 -35.83247 -33.85318 1.97929 2.05459 -34.15416 858.22108
3850.0000 -35.89982 -34.01768 1.88214 2.05282 -34.16540 861.69433
3855.0000 -36.20974 -34.96593 1.24381 2.00847 -34.44701 837.69260
3860.0000 -36.77995 -35.46235 1.31760 1.89121 -35.19157 663.71100
3865.0000 -36.69559 -35.07060 1.62499 1.87538 -35.29206 644.68062
3870.0000 -36.60686 -34.88587 1.72099 1.91459 -35.04310 704.35433
3875.0000 -36.23649 -34.39768 1.83881 1.92704 -34.96406 718.88017
3880.0000 -37.04457 -35.34088 1.70370 1.94432 -34.85434 774.47714
3885.0000 -36.02210 -34.86358 1.15852 1.90535 -35.10180 679.11227
3890.0000 -35.77259 -34.77389 0.99870 1.93318 -34.92507 683.78366
3895.0000 -36.30010 -34.84792 1.45218 1.99192 -34.55212 762.87187
3900.0000 -36.24536 -35.04687 1.19849 1.99193 -34.55206 759.51015
3905.0000 -36.44742 -35.07791 1.36950 1.89150 -35.18972 657.41042
3910.0000 -36.69230 -35.01172 1.68058 1.94545 -34.84719 730.55116
3915.0000 -36.51652 -34.96365 1.55288 1.92540 -34.97448 729.82330
3920.0000 -36.52234 -35.19157 1.33078 1.91818 -35.02029 710.47078
3925.0000 -35.78417 -34.31343 1.47074 1.98731 -34.58140 758.38076
3930.0000 -35.31961 -33.67464 1.64497 2.02249 -34.35800 796.33250
3935.0000 -35.77100 -33.86217 1.90883 2.10827 -33.81329 857.69529
3940.0000 -36.27955 -34.57087 1.70868 2.08891 -33.93627 878.98228
3945.0000 -35.97156 -34.34462 1.62694 2.01362 -34.41431 804.97395
3950.0000 -35.34118 -33.59508 1.74610 2.04471 -34.21692 875.10184
3955.0000 -35.84936 -34.08893 1.76042 2.13189 -33.66332 944.52198
3960.0000 -36.73099 -35.35120 1.37978 2.00539 -34.46656 787.81985
3965.0000 -36.66454 -35.18766 1.47688 1.88042 -35.26006 643.03573
3970.0000 -36.90465 -35.84796 1.05669 1.85854 -35.39903 634.50221
3975.0000 -36.58328 -35.35594 1.22734 1.86817 -35.33785 608.93309
3980.0000 -36.90501 -35.41592 1.48909 1.84364 -35.49363 611.38463
3985.0000 -36.67517 -35.14025 1.53492 1.86963 -35.32858 625.66275
3990.0000 -36.47483 -35.01513 1.45970 1.94701 -34.83726 733.24746
3995.0000 -36.62689 -35.39185 1.23504 1.93124 -34.93737 719.57559
4000.0000 -36.28506 -35.06663 1.21843 1.90056 -35.13218 697.87999
FREEZING PROCESS: loop number 17 T-loop= 696.00000000000000
main_MD> interactions number 17 at Temperature= 696.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -8.78801 0.37925 -0.12591
force_rgl> df(natom) 1.13663 -0.84111 0.71667
4005.0000 -36.91486 -35.61296 1.30190 1.87349 -35.30410 722.07354
4010.0000 -36.66946 -35.06502 1.60445 1.81652 -35.66580 586.80940
4015.0000 -36.48793 -34.95852 1.52941 1.90460 -35.10652 652.25931
4020.0000 -36.91239 -35.51237 1.40003 1.86803 -35.33874 632.66327
4025.0000 -36.75395 -35.18091 1.57304 1.89252 -35.18328 648.99287
4030.0000 -36.74428 -35.65838 1.08590 1.87356 -35.30365 616.28848
4035.0000 -36.86736 -35.68569 1.18166 1.84369 -35.49328 572.35387
4040.0000 -36.60970 -35.48653 1.12317 1.83247 -35.56455 593.55113
4045.0000 -37.07842 -36.05521 1.02321 1.82423 -35.61688 613.78921
4050.0000 -36.91535 -35.34710 1.56825 1.84061 -35.51283 618.90752
4055.0000 -36.86135 -34.89837 1.96298 1.86994 -35.32661 611.68928
4060.0000 -36.28433 -34.66572 1.61861 1.96232 -34.74007 706.20579
4065.0000 -35.92175 -34.52305 1.39870 1.99283 -34.54632 714.14135
4070.0000 -36.60010 -35.58906 1.01104 1.95356 -34.79566 666.91764
4075.0000 -36.64014 -35.54295 1.09720 1.83681 -35.53700 609.48289
4080.0000 -37.01847 -35.19302 1.82544 1.87063 -35.32221 649.03910
4085.0000 -36.60405 -35.36401 1.24004 1.88140 -35.25386 646.11330
4090.0000 -37.00498 -35.63412 1.37086 1.85029 -35.45136 613.18508
4095.0000 -36.62542 -35.17684 1.44858 1.89028 -35.19747 649.28729
4100.0000 -36.39163 -35.24060 1.15103 1.92494 -34.97741 704.51319
4105.0000 -36.71747 -35.13697 1.58050 1.88249 -35.24693 639.92414
4110.0000 -36.28379 -34.36290 1.92089 1.87586 -35.28903 654.33591
4115.0000 -36.43661 -35.57529 0.86132 1.87396 -35.30112 671.81800
4120.0000 -36.50666 -35.20061 1.30605 1.89634 -35.15897 700.65334
4125.0000 -36.53715 -35.12772 1.40944 1.88999 -35.19934 648.42273
4130.0000 -35.74728 -34.29194 1.45534 2.01637 -34.39685 770.33717
4135.0000 -35.78636 -34.28052 1.50584 2.05504 -34.15131 882.74259
4140.0000 -36.34057 -35.33183 1.00874 1.96759 -34.70656 718.40926
4145.0000 -36.05937 -34.55616 1.50321 1.92226 -34.99441 665.67493
4150.0000 -36.86434 -35.06089 1.80344 1.95133 -34.80981 745.47723
4155.0000 -36.82496 -35.70188 1.12308 1.84776 -35.46746 631.17526
4160.0000 -36.64182 -35.39762 1.24420 1.78440 -35.86974 532.79086
4165.0000 -36.79867 -35.23495 1.56372 1.86291 -35.37125 664.97843
4170.0000 -36.74499 -34.75334 1.99165 1.94050 -34.87857 779.46465
4175.0000 -35.78173 -34.56819 1.21354 1.97628 -34.65139 784.58734
4180.0000 -36.30468 -34.63142 1.67326 1.98165 -34.61732 764.33904
4185.0000 -36.93111 -35.05198 1.87913 1.87958 -35.26540 640.18960
4190.0000 -36.20725 -34.54213 1.66512 1.99613 -34.52539 800.77750
4195.0000 -35.98962 -34.06566 1.92396 1.95878 -34.76250 758.02651
4200.0000 -36.15528 -35.03284 1.12244 2.02344 -34.35197 879.56295
4205.0000 -36.73917 -35.27399 1.46518 1.87646 -35.28520 642.51118
4210.0000 -37.27790 -35.76024 1.51766 1.86962 -35.32864 633.00909
4215.0000 -36.80994 -35.35941 1.45053 1.82346 -35.62175 641.79860
4220.0000 -36.66213 -35.41381 1.24832 1.91094 -35.06631 724.00913
4225.0000 -36.27036 -35.29584 0.97451 1.85797 -35.40262 625.02235
4230.0000 -36.72918 -35.16687 1.56231 1.88425 -35.23574 672.48938
4235.0000 -36.49867 -34.63484 1.86383 1.99415 -34.53796 764.72154
4240.0000 -36.64229 -34.76008 1.88221 2.02065 -34.36965 779.05576
4245.0000 -36.24779 -34.48486 1.76294 2.02148 -34.36439 806.22054
4250.0000 -35.98103 -34.55455 1.42647 1.97356 -34.66870 694.99196
FREEZING PROCESS: loop number 18 T-loop= 671.00000000000000
main_MD> interactions number 18 at Temperature= 671.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -2.24648 0.66565 -0.25878
force_rgl> df(natom) 0.05238 4.46354 -0.81856
4255.0000 -36.59097 -35.00121 1.58977 1.94988 -34.81902 746.26650
4260.0000 -36.40220 -35.13978 1.26242 1.90115 -35.12843 688.28424
4265.0000 -36.49331 -35.02349 1.46982 1.88275 -35.24530 655.40504
4270.0000 -36.52876 -34.88631 1.64245 1.92259 -34.99232 735.76322
4275.0000 -37.02214 -35.50355 1.51858 1.87118 -35.31875 699.50313
4280.0000 -37.02312 -35.69059 1.33253 1.83942 -35.52044 614.99394
4285.0000 -36.64620 -34.87293 1.77327 1.89600 -35.16115 688.01288
4290.0000 -35.77658 -34.22631 1.55027 1.96248 -34.73902 754.02066
4295.0000 -35.35118 -34.29381 1.05737 1.99520 -34.53129 709.51574
4300.0000 -35.00537 -33.26383 1.74154 2.09767 -33.88064 789.46523
4305.0000 -35.89815 -33.86866 2.02949 2.15171 -33.53749 899.80068
4310.0000 -36.23555 -34.60011 1.63544 2.06977 -34.05776 761.73195
4315.0000 -36.61358 -35.07909 1.53448 1.96319 -34.73449 717.02865
4320.0000 -36.51330 -35.05051 1.46279 1.91233 -35.05743 679.01783
4325.0000 -36.41061 -34.69257 1.71804 1.92864 -34.95387 700.21422
4330.0000 -36.17957 -34.84236 1.33721 1.97415 -34.66491 745.54182
4335.0000 -36.01364 -35.07285 0.94079 1.95628 -34.77839 773.54535
4340.0000 -36.79837 -34.83814 1.96023 1.87306 -35.30680 622.26968
4345.0000 -36.24812 -35.24759 1.00053 1.97473 -34.66122 807.40590
4350.0000 -36.91964 -35.18732 1.73232 1.84961 -35.45569 607.71336
4355.0000 -36.26292 -34.89471 1.36821 1.95155 -34.80844 733.94425
4360.0000 -36.63026 -34.70026 1.93000 1.94675 -34.83891 741.04752
4365.0000 -35.93236 -34.53004 1.40233 1.96719 -34.70915 757.04143
4370.0000 -36.52539 -34.55915 1.96624 1.97127 -34.68322 755.28593
4375.0000 -36.33246 -34.35559 1.97687 2.02235 -34.35888 861.75493
4380.0000 -36.08984 -34.40182 1.68802 2.02475 -34.34366 849.77160
4385.0000 -36.23141 -34.39329 1.83813 2.00519 -34.46783 779.67137
4390.0000 -36.35723 -35.18029 1.17694 1.94605 -34.84332 719.20534
4395.0000 -36.88333 -35.68233 1.20100 1.87915 -35.26812 591.97291
4400.0000 -36.74676 -35.56655 1.18021 1.84553 -35.48160 592.05181
4405.0000 -36.38878 -35.12439 1.26440 1.85058 -35.44958 618.45426
4410.0000 -36.88883 -35.62085 1.26798 1.93285 -34.92719 658.54357
4415.0000 -36.56485 -35.27727 1.28759 1.86126 -35.38174 630.75124
4420.0000 -36.81784 -35.82472 0.99312 1.82419 -35.61709 581.49318
4425.0000 -36.95922 -36.04149 0.91773 1.79524 -35.80096 563.68860
4430.0000 -36.46123 -35.31750 1.14373 1.84047 -35.51373 599.79470
4435.0000 -35.54411 -33.83040 1.71371 1.95861 -34.76362 742.76943
4440.0000 -36.56974 -34.91314 1.65660 1.98900 -34.57063 788.72403
4445.0000 -36.12508 -34.60464 1.52043 1.95540 -34.78397 785.19444
4450.0000 -36.55719 -34.86442 1.69277 1.93182 -34.93370 731.94967
4455.0000 -36.30614 -34.49202 1.81412 1.91440 -35.04430 792.38460
4460.0000 -36.63891 -34.96229 1.67662 1.94863 -34.82697 791.68753
4465.0000 -36.67042 -35.14201 1.52841 1.92246 -34.99316 690.09774
4470.0000 -36.31619 -35.03069 1.28549 1.86623 -35.35017 623.16923
4475.0000 -37.25303 -35.55853 1.69450 1.89114 -35.19200 656.87159
4480.0000 -37.03060 -35.48513 1.54547 1.82848 -35.58986 567.46431
4485.0000 -36.56323 -35.67670 0.88653 1.80165 -35.76023 548.90546
4490.0000 -36.25959 -34.86961 1.38998 1.89194 -35.18691 644.75358
4495.0000 -36.30520 -35.19337 1.11183 1.93875 -34.88974 747.69509
4500.0000 -36.96910 -35.50080 1.46830 1.84905 -35.45929 591.59046
FREEZING PROCESS: loop number 19 T-loop= 646.00000000000000
main_MD> interactions number 19 at Temperature= 646.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.45390 -1.05241 1.99052
force_rgl> df(natom) 0.03470 0.47171 -0.01637
4505.0000 -37.48938 -35.94569 1.54369 1.76481 -35.99416 511.45738
4510.0000 -36.91420 -35.82860 1.08560 1.78673 -35.85497 520.04445
4515.0000 -36.78048 -35.16774 1.61274 1.82932 -35.58457 611.04733
4520.0000 -36.12070 -34.88534 1.23537 1.96688 -34.71107 786.46182
4525.0000 -36.49704 -35.02269 1.47435 1.93012 -34.94447 737.99737
4530.0000 -36.15058 -34.60563 1.54495 1.93829 -34.89262 728.69602
4535.0000 -36.54006 -35.51712 1.02294 1.89186 -35.18743 639.63867
4540.0000 -37.02088 -35.62696 1.39392 1.82288 -35.62545 582.61155
4545.0000 -36.52998 -35.00203 1.52795 1.87146 -35.31699 638.57471
4550.0000 -36.91018 -35.17707 1.73311 1.91409 -35.04631 693.03547
4555.0000 -36.59100 -35.21276 1.37825 1.89356 -35.17666 671.67072
4560.0000 -36.52967 -35.40739 1.12228 1.88247 -35.24706 643.22901
4565.0000 -36.54149 -35.50311 1.03838 1.80846 -35.71699 524.65810
4570.0000 -36.70301 -35.50754 1.19547 1.82340 -35.62216 574.72873
4575.0000 -36.84608 -35.33245 1.51363 1.88535 -35.22874 700.97919
4580.0000 -36.66014 -35.85467 0.80547 1.84095 -35.51067 597.11653
4585.0000 -37.01123 -35.82749 1.18374 1.80691 -35.72683 561.51686
4590.0000 -36.87649 -35.62994 1.24655 1.85691 -35.40934 621.15855
4595.0000 -37.23723 -35.72077 1.51646 1.77066 -35.95701 493.22907
4600.0000 -36.54882 -35.24551 1.30331 1.81620 -35.66784 558.68966
4605.0000 -36.76007 -35.66862 1.09145 1.83118 -35.57275 597.97396
4610.0000 -37.23190 -35.83255 1.39935 1.77053 -35.95783 510.81258
4615.0000 -36.94643 -35.70247 1.24396 1.82269 -35.62666 566.22762
4620.0000 -36.67005 -35.14300 1.52704 1.83567 -35.54425 587.61505
4625.0000 -36.43855 -35.04421 1.39434 1.90098 -35.12955 675.41526
4630.0000 -36.82074 -35.94656 0.87418 1.87169 -35.31552 596.99267
4635.0000 -36.11869 -34.62929 1.48940 1.87796 -35.27570 671.55236
4640.0000 -37.01439 -35.66291 1.35148 1.86846 -35.33602 657.80329
4645.0000 -36.62462 -35.48005 1.14456 1.79658 -35.79245 540.38394
4650.0000 -36.34164 -35.02140 1.32024 1.87619 -35.28696 650.36757
4655.0000 -36.41165 -35.01425 1.39740 1.91356 -35.04964 656.27729
4660.0000 -36.86361 -35.85872 1.00490 1.85299 -35.43423 621.64646
4665.0000 -36.86963 -35.63704 1.23259 1.81220 -35.69323 603.55963
4670.0000 -36.41234 -34.86098 1.55136 1.82534 -35.60979 581.84603
4675.0000 -36.69187 -35.11440 1.57747 1.96906 -34.69727 817.34668
4680.0000 -36.46906 -35.27636 1.19270 1.90844 -35.08215 729.42746
4685.0000 -36.35588 -35.05903 1.29685 1.91441 -35.04427 684.97980
4690.0000 -36.75378 -35.31422 1.43957 1.88263 -35.24606 658.35571
4695.0000 -36.21360 -34.97919 1.23441 1.89411 -35.17314 680.54157
4700.0000 -35.93358 -35.01846 0.91513 1.95075 -34.81350 731.14640
4705.0000 -36.74786 -35.28750 1.46036 1.92523 -34.97553 696.42628
4710.0000 -36.59813 -35.50557 1.09256 1.90519 -35.10278 705.62568
4715.0000 -36.72773 -34.87080 1.85692 1.87475 -35.29607 672.15069
4720.0000 -36.20075 -34.94481 1.25594 1.94786 -34.83187 697.23785
4725.0000 -35.90046 -34.60428 1.29618 1.95958 -34.75745 745.86764
4730.0000 -36.18848 -34.43415 1.75434 2.02901 -34.31661 762.45217
4735.0000 -36.55704 -34.98076 1.57628 1.99436 -34.53660 774.76606
4740.0000 -36.52107 -34.83198 1.68909 1.96480 -34.72429 763.66004
4745.0000 -36.49792 -35.04397 1.45395 1.90959 -35.07484 653.44093
4750.0000 -36.92469 -35.55011 1.37458 1.86675 -35.34690 635.54827
FREEZING PROCESS: loop number 20 T-loop= 621.00000000000000
main_MD> interactions number 20 at Temperature= 621.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.31043 -0.96276 2.32360
force_rgl> df(natom) 1.24633 -3.83517 1.41257
4755.0000 -36.74695 -35.75442 0.99253 1.80113 -35.76356 549.02831
4760.0000 -37.04769 -35.86521 1.18248 1.82092 -35.63785 583.94571
4765.0000 -36.34617 -34.63702 1.70915 1.88391 -35.23790 685.05217
4770.0000 -36.78087 -35.36871 1.41216 1.91206 -35.05915 699.97678
4775.0000 -35.94473 -34.67609 1.26864 1.90513 -35.10318 667.34754
4780.0000 -36.14054 -34.48320 1.65734 1.95303 -34.79900 702.57711
4785.0000 -36.41937 -34.94457 1.47480 1.95364 -34.79516 629.48832
4790.0000 -36.71183 -35.24932 1.46251 1.92751 -34.96110 692.19201
4795.0000 -36.25036 -34.87881 1.37155 1.91891 -35.01570 688.76582
4800.0000 -35.99220 -34.23396 1.75824 2.03866 -34.25529 832.92846
4805.0000 -36.14638 -34.62670 1.51968 2.03029 -34.30847 819.64901
4810.0000 -37.29037 -35.40044 1.88993 1.88709 -35.21774 637.96928
4815.0000 -36.85363 -35.91595 0.93768 1.79742 -35.78712 549.59717
4820.0000 -36.51817 -35.11574 1.40243 1.82921 -35.58526 581.35530
4825.0000 -36.76029 -35.04391 1.71638 1.89936 -35.13979 666.22516
4830.0000 -36.77761 -35.52071 1.25689 1.87786 -35.27635 711.03764
4835.0000 -36.11727 -35.05168 1.06559 1.91181 -35.06079 657.99065
4840.0000 -36.49250 -35.54343 0.94907 1.88015 -35.26182 644.98085
4845.0000 -37.23468 -35.78082 1.45386 1.82347 -35.62171 584.83070
4850.0000 -37.16200 -36.07088 1.09112 1.78337 -35.87632 520.53686
4855.0000 -36.88554 -35.60077 1.28477 1.77054 -35.95774 542.73746
4860.0000 -36.53131 -35.06757 1.46374 1.86992 -35.32675 665.51834
4865.0000 -36.85426 -35.82831 1.02594 1.85401 -35.42775 587.68111
4870.0000 -37.05677 -35.66286 1.39392 1.78772 -35.84867 532.54606
4875.0000 -36.42933 -35.45039 0.97894 1.84396 -35.49160 524.51796
4880.0000 -37.04242 -36.08415 0.95826 1.78159 -35.88761 529.70966
4885.0000 -37.11256 -36.17891 0.93364 1.77139 -35.95236 481.15643
4890.0000 -36.67756 -35.52804 1.14952 1.81682 -35.66389 572.65699
4895.0000 -37.04518 -35.76663 1.27855 1.84266 -35.49987 595.73354
4900.0000 -36.98297 -35.73976 1.24321 1.80897 -35.71375 561.04137
4905.0000 -36.58976 -35.57080 1.01897 1.79221 -35.82014 551.93059
4910.0000 -36.56007 -35.24233 1.31773 1.82277 -35.62612 605.96960
4915.0000 -37.00464 -35.70569 1.29895 1.82349 -35.62158 602.19552
4920.0000 -36.80877 -36.08115 0.72762 1.79024 -35.83267 519.88755
4925.0000 -36.55128 -35.20055 1.35074 1.79676 -35.79126 543.95036
4930.0000 -36.18692 -34.78036 1.40656 1.97601 -34.65314 719.32628
4935.0000 -36.36612 -35.06566 1.30045 1.96008 -34.75429 777.07646
4940.0000 -36.99924 -35.27911 1.72013 1.85796 -35.40272 594.29125
4945.0000 -36.04539 -34.45504 1.59035 1.90970 -35.07419 670.89665
4950.0000 -36.49504 -34.74560 1.74944 1.96489 -34.72373 753.36918
4955.0000 -36.64879 -35.13110 1.51768 1.91679 -35.02914 732.50815
4960.0000 -36.28470 -35.29841 0.98629 1.89810 -35.14782 664.60045
4965.0000 -36.40370 -35.06460 1.33910 1.95860 -34.76367 708.68740
4970.0000 -36.31922 -34.49984 1.81938 1.92946 -34.94870 727.86416
4975.0000 -35.92630 -33.62073 2.30557 2.05092 -34.17744 901.01694
4980.0000 -37.01724 -35.10442 1.91283 1.98065 -34.62365 806.33925
4985.0000 -36.86224 -34.96093 1.90131 1.93837 -34.89214 752.16951
4990.0000 -36.68580 -35.27067 1.41513 1.84702 -35.47213 598.66724
4995.0000 -36.73460 -35.59691 1.13768 1.87788 -35.27624 655.18924
5000.0000 -35.92639 -34.93638 0.99001 1.86223 -35.37560 623.44802
FREEZING PROCESS: loop number 21 T-loop= 596.00000000000000
main_MD> interactions number 21 at Temperature= 596.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.76330 -0.34048 1.78238
force_rgl> df(natom) 4.08837 1.82617 -0.48896
5005.0000 -36.70125 -35.12682 1.57443 1.91785 -35.02239 701.89205
5010.0000 -36.48002 -35.23448 1.24554 1.91471 -35.04238 705.80727
5015.0000 -36.74401 -35.42336 1.32066 1.89582 -35.16228 666.94792
5020.0000 -36.59371 -35.01017 1.58354 1.91677 -35.02925 687.12067
5025.0000 -36.78498 -35.30619 1.47879 1.85077 -35.44831 611.05145
5030.0000 -37.02721 -35.77259 1.25463 1.85546 -35.41857 596.49090
5035.0000 -37.17165 -35.95787 1.21378 1.83448 -35.55176 572.62145
5040.0000 -36.93210 -35.81096 1.12114 1.75234 -36.07332 484.86752
5045.0000 -36.54894 -35.28952 1.25942 1.81218 -35.69339 556.84540
5050.0000 -36.26960 -35.07718 1.19242 1.94392 -34.85689 744.31492
5055.0000 -37.10904 -35.72174 1.38731 1.85016 -35.45225 579.20464
5060.0000 -36.35202 -34.99949 1.35253 1.87108 -35.31939 649.63210
5065.0000 -36.96951 -35.30140 1.66811 1.88402 -35.23720 640.28678
5070.0000 -37.21999 -36.02864 1.19135 1.82686 -35.60016 577.89284
5075.0000 -37.00352 -36.35913 0.64439 1.77089 -35.95552 534.01698
5080.0000 -36.89674 -35.69272 1.20402 1.77098 -35.95495 510.46172
5085.0000 -36.94314 -36.03752 0.90562 1.79094 -35.82827 558.74038
5090.0000 -37.13344 -36.23587 0.89757 1.74944 -36.09176 486.02233
5095.0000 -37.16126 -36.08138 1.07988 1.73925 -36.15646 471.11812
5100.0000 -37.44446 -36.46828 0.97619 1.76630 -35.98467 496.08284
5105.0000 -37.21340 -36.17848 1.03492 1.72274 -36.26128 443.67043
5110.0000 -36.77961 -35.29677 1.48283 1.77680 -35.91804 550.59915
5115.0000 -37.08954 -36.10316 0.98638 1.81167 -35.69661 568.66225
5120.0000 -36.96730 -35.88575 1.08155 1.77358 -35.93848 503.71995
5125.0000 -36.97233 -35.80629 1.16605 1.78439 -35.86981 539.65230
5130.0000 -36.38761 -35.32272 1.06489 1.87217 -35.31244 663.50360
5135.0000 -37.04385 -36.02080 1.02304 1.81287 -35.68899 575.99566
5140.0000 -36.70749 -35.66557 1.04193 1.81367 -35.68388 588.00795
5145.0000 -36.99340 -36.05944 0.93396 1.81289 -35.68887 534.54992
5150.0000 -36.86948 -35.70728 1.16220 1.80603 -35.73240 552.45756
5155.0000 -37.10026 -35.83499 1.26527 1.80883 -35.71462 550.41895
5160.0000 -36.47860 -35.10257 1.37603 1.87818 -35.27432 655.23523
5165.0000 -36.52839 -35.52053 1.00786 1.81055 -35.70371 522.20478
5170.0000 -36.71657 -35.18705 1.52952 1.88054 -35.25934 608.94056
5175.0000 -36.89919 -35.69011 1.20908 1.82456 -35.61474 587.82703
5180.0000 -37.06963 -35.90378 1.16585 1.80300 -35.75165 572.36822
5185.0000 -37.15045 -35.84816 1.30229 1.77688 -35.91749 527.99033
5190.0000 -37.16470 -36.45369 0.71102 1.77001 -35.96113 505.73979
5195.0000 -37.04395 -35.92487 1.11907 1.73554 -36.18002 459.46158
5200.0000 -36.74747 -35.39559 1.35188 1.80778 -35.72133 599.59048
5205.0000 -37.17762 -36.33931 0.83831 1.81254 -35.69107 577.52328
5210.0000 -37.11791 -36.31132 0.80659 1.71334 -36.32096 430.77525
5215.0000 -37.14083 -35.99064 1.15019 1.74681 -36.10842 465.11405
5220.0000 -37.09713 -35.73378 1.36336 1.80262 -35.75407 569.23261
5225.0000 -36.83072 -35.51078 1.31994 1.81796 -35.65665 585.71373
5230.0000 -37.20983 -36.13046 1.07937 1.82859 -35.58920 567.20203
5235.0000 -37.12571 -36.16781 0.95790 1.77228 -35.94674 515.47425
5240.0000 -36.36151 -35.57116 0.79035 1.75949 -36.02794 466.48009
5245.0000 -36.65905 -35.60188 1.05716 1.80660 -35.72877 522.99890
5250.0000 -36.71069 -35.35182 1.35887 1.79551 -35.79923 538.22223
FREEZING PROCESS: loop number 22 T-loop= 571.00000000000000
main_MD> interactions number 22 at Temperature= 571.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.96411 -0.89419 0.38493
force_rgl> df(natom) 2.04510 -1.04590 4.74491
5255.0000 -35.69842 -34.93556 0.76286 1.89524 -35.16601 556.96373
5260.0000 -35.62815 -34.40088 1.22727 1.91499 -35.04059 570.79378
5265.0000 -36.38718 -35.08271 1.30447 1.98299 -34.60879 721.96238
5270.0000 -37.13570 -35.24348 1.89222 1.86625 -35.35005 645.53238
5275.0000 -36.38560 -35.28529 1.10031 1.86169 -35.37902 627.17877
5280.0000 -37.03490 -35.92716 1.10774 1.81605 -35.66883 556.98290
5285.0000 -37.04764 -35.84758 1.20006 1.78688 -35.85399 559.29557
5290.0000 -36.82683 -35.22467 1.60217 1.82874 -35.58824 628.87925
5295.0000 -36.65780 -35.42466 1.23314 1.81848 -35.65336 603.76303
5300.0000 -36.86516 -35.45282 1.41234 1.87908 -35.26859 646.44935
5305.0000 -37.10947 -35.87458 1.23489 1.83620 -35.54083 594.17720
5310.0000 -36.87494 -35.26150 1.61344 1.83403 -35.55461 629.52590
5315.0000 -36.52031 -35.02488 1.49544 1.87672 -35.28359 637.17964
5320.0000 -36.47437 -35.26163 1.21274 1.88921 -35.20426 628.00880
5325.0000 -35.70659 -34.75174 0.95485 1.88837 -35.20960 589.31014
5330.0000 -36.25773 -34.96704 1.29068 1.91874 -35.01677 690.03339
5335.0000 -36.59745 -35.11968 1.47778 1.91685 -35.02877 714.14169
5340.0000 -36.79860 -35.81648 0.98212 1.88299 -35.24376 640.46339
5345.0000 -36.94454 -35.85165 1.09290 1.79677 -35.79125 545.02512
5350.0000 -37.05339 -35.57931 1.47407 1.79799 -35.78350 538.16472
5355.0000 -37.04190 -35.82770 1.21420 1.83715 -35.53481 607.91976
5360.0000 -37.00298 -35.85576 1.14722 1.80657 -35.72901 560.03908
5365.0000 -36.97075 -35.87030 1.10045 1.77160 -35.95102 517.78314
5370.0000 -37.14960 -36.03310 1.11650 1.76481 -35.99415 510.84710
5375.0000 -36.90475 -35.72378 1.18098 1.77426 -35.93416 524.91437
5380.0000 -36.55701 -35.60215 0.95486 1.81608 -35.66858 557.55239
5385.0000 -37.12087 -36.05967 1.06120 1.80890 -35.71422 554.86878
5390.0000 -37.04739 -35.63798 1.40941 1.78698 -35.85341 530.53573
5395.0000 -36.81128 -35.79772 1.01356 1.79680 -35.79101 545.47910
5400.0000 -36.85340 -35.95838 0.89502 1.81532 -35.67345 596.86953
5405.0000 -37.07422 -35.80310 1.27111 1.76264 -36.00791 511.53331
5410.0000 -37.15307 -35.74689 1.40618 1.77799 -35.91049 514.74950
5415.0000 -36.32584 -35.10998 1.21586 1.82866 -35.58874 555.74338
5420.0000 -36.67192 -35.64319 1.02873 1.86103 -35.38320 608.56817
5425.0000 -36.45781 -35.59332 0.86448 1.81720 -35.66151 534.05753
5430.0000 -36.88499 -35.83210 1.05289 1.78805 -35.84657 533.80006
5435.0000 -37.15803 -36.01930 1.13873 1.78478 -35.86735 464.10707
5440.0000 -36.95340 -35.84492 1.10848 1.76427 -35.99760 495.47508
5445.0000 -37.02833 -35.77449 1.25384 1.77420 -35.93452 502.47241
5450.0000 -37.33006 -36.25248 1.07758 1.78553 -35.86262 532.29571
5455.0000 -37.00118 -36.30426 0.69693 1.70034 -36.40351 414.07306
5460.0000 -37.21712 -36.30866 0.90846 1.71880 -36.28633 417.65392
5465.0000 -36.89452 -35.99939 0.89512 1.71511 -36.30975 410.59997
5470.0000 -36.81619 -35.58023 1.23596 1.80889 -35.71425 601.91954
5475.0000 -37.01179 -35.90414 1.10766 1.79272 -35.81695 540.91320
5480.0000 -36.73094 -35.36359 1.36735 1.81773 -35.65811 577.46439
5485.0000 -37.14897 -36.24562 0.90336 1.79829 -35.78159 543.02405
5490.0000 -36.84685 -35.95969 0.88716 1.75466 -36.05858 488.35638
5495.0000 -36.79395 -35.77060 1.02335 1.81425 -35.68022 575.28422
5500.0000 -36.82880 -35.70230 1.12650 1.83766 -35.53156 549.76780
FREEZING PROCESS: loop number 23 T-loop= 546.00000000000000
main_MD> interactions number 23 at Temperature= 546.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.16919 1.72821 -1.21607
force_rgl> df(natom) -0.17929 -2.25907 1.19928
5505.0000 -36.77443 -35.81642 0.95801 1.80891 -35.71414 594.90202
5510.0000 -37.08924 -36.24619 0.84305 1.76479 -35.99428 493.24440
5515.0000 -37.24389 -36.19202 1.05187 1.73206 -36.20209 451.26382
5520.0000 -37.15235 -35.87466 1.27768 1.75262 -36.07156 491.85940
5525.0000 -37.02280 -35.99869 1.02411 1.77018 -35.96007 495.82144
5530.0000 -37.34554 -36.18532 1.16022 1.78365 -35.87453 519.65167
5535.0000 -37.20454 -36.37402 0.83052 1.74043 -36.14897 451.44250
5540.0000 -36.26710 -35.09380 1.17330 1.80885 -35.71454 558.31173
5545.0000 -37.11730 -35.70393 1.41337 1.84155 -35.50687 651.10740
5550.0000 -36.91175 -35.87234 1.03941 1.79847 -35.78040 556.53759
5555.0000 -36.63864 -35.26766 1.37097 1.85605 -35.41483 621.77131
5560.0000 -36.93956 -35.75199 1.18756 1.81721 -35.66145 577.04370
5565.0000 -37.32671 -36.55507 0.77164 1.76309 -36.00508 480.14526
5570.0000 -36.94834 -35.70853 1.23981 1.76264 -36.00794 509.83630
5575.0000 -37.25434 -35.80746 1.44688 1.81488 -35.67623 604.39881
5580.0000 -37.05897 -36.12974 0.92923 1.78136 -35.88909 529.02010
5585.0000 -37.05600 -36.21384 0.84216 1.73429 -36.18792 441.31091
5590.0000 -37.10408 -36.08627 1.01781 1.73065 -36.21103 438.40329
5595.0000 -36.94015 -35.77173 1.16842 1.75373 -36.06451 469.70269
5600.0000 -37.29077 -36.20960 1.08117 1.76696 -35.98047 506.00907
5605.0000 -37.13434 -36.15416 0.98018 1.70405 -36.37994 414.26459
5610.0000 -36.51380 -35.40591 1.10789 1.80024 -35.76917 534.64694
5615.0000 -37.15244 -35.79021 1.36223 1.82395 -35.61864 583.35548
5620.0000 -36.88000 -35.43900 1.44100 1.84830 -35.46401 604.46803
5625.0000 -36.14543 -35.11053 1.03490 1.86368 -35.36640 622.82755
5630.0000 -36.79772 -35.51590 1.28182 1.83752 -35.53246 613.27188
5635.0000 -37.22026 -36.17510 1.04516 1.77891 -35.90463 520.48268
5640.0000 -36.77423 -35.91226 0.86197 1.77463 -35.93178 508.87257
5645.0000 -36.27060 -35.15585 1.11475 1.86210 -35.37642 666.63787
5650.0000 -36.94390 -36.06500 0.87889 1.82516 -35.61097 574.47666
5655.0000 -36.76354 -34.97363 1.78991 1.84331 -35.49569 622.56684
5660.0000 -36.87327 -35.93430 0.93897 1.81513 -35.67463 597.82675
5665.0000 -36.99793 -36.28380 0.71414 1.69657 -36.42746 404.35190
5670.0000 -36.79349 -35.93190 0.86159 1.79109 -35.82730 501.11180
5675.0000 -37.06952 -36.09038 0.97914 1.75122 -36.08041 476.28137
5680.0000 -37.10647 -35.88153 1.22494 1.76966 -35.96336 538.79920
5685.0000 -36.96511 -35.63850 1.32662 1.79823 -35.78197 554.20353
5690.0000 -36.67531 -36.01669 0.65862 1.74338 -36.13022 466.28026
5695.0000 -36.71571 -35.70275 1.01296 1.81028 -35.70543 551.16511
5700.0000 -36.93881 -35.79316 1.14565 1.80391 -35.74591 553.15957
5705.0000 -36.61352 -35.38766 1.22586 1.79415 -35.80784 518.64299
5710.0000 -37.23921 -36.11197 1.12724 1.80270 -35.75356 544.13918
5715.0000 -36.98721 -35.39810 1.58911 1.80482 -35.74011 570.54015
5720.0000 -36.73725 -35.59731 1.13994 1.83209 -35.56694 595.69437
5725.0000 -37.15774 -35.82054 1.33721 1.82231 -35.62905 571.19795
5730.0000 -37.04504 -35.89946 1.14557 1.83568 -35.54414 618.31221
5735.0000 -36.77638 -35.67713 1.09926 1.80737 -35.72392 541.93098
5740.0000 -36.58949 -35.57015 1.01934 1.84478 -35.48636 629.50645
5745.0000 -36.73708 -35.55943 1.17764 1.81304 -35.68792 537.54769
5750.0000 -36.72191 -35.55138 1.17053 1.83316 -35.56015 600.85012
FREEZING PROCESS: loop number 24 T-loop= 521.00000000000000
main_MD> interactions number 24 at Temperature= 521.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.86391 1.32050 0.40715
force_rgl> df(natom) -0.13418 -0.56877 -1.46171
5755.0000 -36.97807 -36.08869 0.88938 1.74654 -36.11014 469.63616
5760.0000 -36.83688 -35.92998 0.90690 1.78576 -35.86110 545.84689
5765.0000 -36.66918 -35.48305 1.18613 1.83341 -35.55859 588.30533
5770.0000 -36.72841 -35.78044 0.94798 1.79513 -35.80164 559.18166
5775.0000 -37.06086 -36.18731 0.87354 1.79214 -35.82065 539.54773
5780.0000 -37.36582 -36.33902 1.02679 1.73729 -36.16891 476.93671
5785.0000 -36.94125 -36.28645 0.65480 1.68735 -36.48602 398.51170
5790.0000 -36.82593 -35.50103 1.32490 1.76972 -35.96297 520.00408
5795.0000 -36.66190 -35.52113 1.14077 1.88085 -35.25732 710.85079
5800.0000 -36.63634 -35.61121 1.02512 1.82647 -35.60266 567.72774
5805.0000 -37.02284 -35.84295 1.17989 1.78287 -35.87950 556.59439
5810.0000 -37.07822 -36.09549 0.98273 1.75896 -36.03133 486.34713
5815.0000 -36.50161 -35.46572 1.03589 1.80115 -35.76341 564.05803
5820.0000 -37.01496 -35.65277 1.36219 1.84693 -35.47273 615.09004
5825.0000 -36.69223 -35.62740 1.06483 1.82337 -35.62233 565.24018
5830.0000 -36.85093 -36.02374 0.82719 1.77649 -35.92002 503.04485
5835.0000 -37.19870 -36.02200 1.17670 1.75190 -36.07614 477.80800
5840.0000 -37.16984 -35.99580 1.17404 1.77120 -35.95361 515.31255
5845.0000 -37.24119 -36.18152 1.05967 1.74212 -36.13824 447.40490
5850.0000 -36.77323 -35.83857 0.93466 1.75685 -36.04472 485.04012
5855.0000 -36.76473 -35.50052 1.26421 1.81946 -35.64717 571.61312
5860.0000 -36.78778 -35.75939 1.02839 1.81011 -35.70655 537.51454
5865.0000 -36.87090 -35.57655 1.29435 1.80686 -35.72713 555.02286
5870.0000 -36.61995 -35.33051 1.28943 1.84977 -35.45471 627.40695
5875.0000 -36.39466 -35.65280 0.74185 1.83056 -35.57669 568.63586
5880.0000 -37.10306 -36.04915 1.05392 1.76281 -36.00687 485.75037
5885.0000 -36.97470 -35.83203 1.14268 1.76040 -36.02216 525.15725
5890.0000 -36.65626 -35.58846 1.06780 1.82636 -35.60334 572.59311
5895.0000 -36.72307 -35.63570 1.08738 1.82392 -35.61884 584.57335
5900.0000 -36.76420 -35.28593 1.47827 1.85262 -35.43661 599.80355
5905.0000 -36.89409 -35.71293 1.18116 1.81094 -35.70124 561.25267
5910.0000 -37.06138 -36.07464 0.98674 1.78563 -35.86196 546.59503
5915.0000 -37.25840 -36.32264 0.93577 1.75520 -36.05518 483.42261
5920.0000 -37.09102 -35.93069 1.16033 1.75462 -36.05885 474.41423
5925.0000 -36.85638 -35.58165 1.27473 1.80006 -35.77030 576.60688
5930.0000 -37.05011 -35.89440 1.15571 1.76132 -36.01629 497.57783
5935.0000 -37.15535 -35.99384 1.16151 1.77215 -35.94754 501.24945
5940.0000 -37.25856 -36.44129 0.81727 1.70538 -36.37149 416.92071
5945.0000 -36.80389 -35.86817 0.93572 1.73261 -36.19864 446.27213
5950.0000 -36.87012 -36.09599 0.77413 1.76979 -35.96253 487.65782
5955.0000 -36.94491 -35.92174 1.02317 1.76438 -35.99691 481.40317
5960.0000 -37.01887 -35.75661 1.26226 1.76056 -36.02116 465.22927
5965.0000 -36.86330 -36.03298 0.83032 1.77485 -35.93040 511.81608
5970.0000 -36.82054 -35.71726 1.10328 1.79125 -35.82624 539.18395
5975.0000 -36.58350 -35.45853 1.12497 1.84816 -35.46492 601.83619
5980.0000 -36.19597 -35.17384 1.02212 1.84734 -35.47011 618.65754
5985.0000 -36.88264 -35.24503 1.63761 1.87985 -35.26371 630.38031
5990.0000 -36.59655 -35.31331 1.28324 1.86489 -35.35871 617.53750
5995.0000 -37.08659 -35.98748 1.09912 1.82818 -35.59177 582.29075
6000.0000 -37.17606 -36.72731 0.44875 1.71987 -36.27951 450.25498
FREEZING PROCESS: loop number 25 T-loop= 496.00000000000000
main_MD> interactions number 25 at Temperature= 496.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.41858 1.23989 0.77238
force_rgl> df(natom) -0.19362 2.41602 1.63079
6005.0000 -36.93084 -35.85620 1.07464 1.76101 -36.01828 517.27262
6010.0000 -36.80055 -35.53579 1.26476 1.80833 -35.71781 553.35406
6015.0000 -37.34576 -36.00570 1.34006 1.79250 -35.81836 515.06608
6020.0000 -37.08902 -36.37906 0.70996 1.74434 -36.12414 474.91859
6025.0000 -37.14539 -36.56098 0.58441 1.68881 -36.47675 367.43406
6030.0000 -36.74531 -35.73240 1.01291 1.71448 -36.31370 430.12750
6035.0000 -37.11742 -35.99103 1.12639 1.77876 -35.90560 518.82972
6040.0000 -37.18300 -36.00373 1.17927 1.75320 -36.06789 475.83607
6045.0000 -37.14284 -36.24732 0.89553 1.72496 -36.24721 419.64125
6050.0000 -37.31701 -36.57422 0.74279 1.70551 -36.37071 404.51258
6055.0000 -37.04662 -35.92570 1.12093 1.74547 -36.11699 476.48573
6060.0000 -37.27713 -36.40610 0.87104 1.72219 -36.26478 451.99598
6065.0000 -37.30814 -36.38313 0.92501 1.70447 -36.37727 413.07436
6070.0000 -37.34869 -35.66155 1.68715 1.77574 -35.92473 527.53636
6075.0000 -36.98876 -36.04129 0.94748 1.81269 -35.69015 578.58347
6080.0000 -37.13459 -36.20527 0.92932 1.75406 -36.06240 467.50830
6085.0000 -36.90207 -35.99580 0.90628 1.71598 -36.30419 433.48698
6090.0000 -36.77280 -35.58578 1.18703 1.77613 -35.92228 532.07408
6095.0000 -36.65475 -35.73413 0.92062 1.80069 -35.76636 506.19952
6100.0000 -36.68328 -35.25914 1.42414 1.82659 -35.60190 619.94844
6105.0000 -36.90510 -35.77745 1.12765 1.83624 -35.54062 607.87983
6110.0000 -37.44912 -36.52245 0.92666 1.72121 -36.27101 422.33766
6115.0000 -37.13071 -36.21413 0.91658 1.71519 -36.30925 436.99965
6120.0000 -37.27178 -36.39004 0.88174 1.72354 -36.25623 448.67475
6125.0000 -37.28434 -36.36018 0.92417 1.67643 -36.55534 378.94775
6130.0000 -36.49874 -35.42700 1.07174 1.79167 -35.82359 531.99004
6135.0000 -36.91316 -35.64074 1.27242 1.86750 -35.34214 647.13013
6140.0000 -36.77584 -36.01253 0.76331 1.80121 -35.76303 579.97292
6145.0000 -37.15157 -35.72605 1.42551 1.79441 -35.80620 525.61838
6150.0000 -37.07238 -36.26477 0.80762 1.74597 -36.11380 456.68730
6155.0000 -37.18224 -36.10379 1.07845 1.72592 -36.24111 440.76767
6160.0000 -37.20644 -36.33290 0.87354 1.75504 -36.05619 490.80323
6165.0000 -37.01854 -35.44843 1.57011 1.72542 -36.24429 453.40531
6170.0000 -37.16545 -36.34288 0.82257 1.75305 -36.06883 494.49492
6175.0000 -36.91687 -35.80886 1.10801 1.76519 -35.99174 483.91880
6180.0000 -36.84508 -35.71186 1.13321 1.79067 -35.82998 528.46341
6185.0000 -37.04354 -36.21108 0.83246 1.78380 -35.87356 524.04882
6190.0000 -36.87894 -35.80010 1.07884 1.77965 -35.89994 528.01461
6195.0000 -37.18329 -35.91211 1.27119 1.78603 -35.85940 537.93497
6200.0000 -37.01281 -35.73486 1.27796 1.81152 -35.69758 573.47678
6205.0000 -37.12658 -36.48217 0.64441 1.73062 -36.21124 438.17401
6210.0000 -37.23463 -36.05106 1.18357 1.73447 -36.18679 450.60629
6215.0000 -37.28790 -36.40735 0.88055 1.75222 -36.07409 490.21938
6220.0000 -37.13156 -35.96588 1.16569 1.73766 -36.16656 456.40616
6225.0000 -37.31417 -36.08226 1.23192 1.78041 -35.89507 522.48810
6230.0000 -36.68222 -35.58561 1.09661 1.77584 -35.92409 497.34147
6235.0000 -36.77858 -35.37968 1.39890 1.83253 -35.56417 603.83779
6240.0000 -37.14770 -36.51360 0.63410 1.77960 -35.90025 535.91665
6245.0000 -37.16018 -36.03408 1.12610 1.74474 -36.12161 473.12673
6250.0000 -36.96195 -35.97847 0.98348 1.73561 -36.17956 438.03999
FREEZING PROCESS: loop number 26 T-loop= 471.00000000000000
main_MD> interactions number 26 at Temperature= 471.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.20838 1.25002 -1.60191
force_rgl> df(natom) -2.01864 1.11711 -0.60084
6255.0000 -37.01299 -36.14414 0.86884 1.74349 -36.12952 495.23735
6260.0000 -37.11311 -36.29226 0.82085 1.72307 -36.25922 430.92718
6265.0000 -37.13427 -36.22998 0.90428 1.73640 -36.17457 465.54629
6270.0000 -37.33166 -36.29298 1.03868 1.72683 -36.23530 441.71793
6275.0000 -37.25373 -36.26315 0.99057 1.71321 -36.32180 420.48724
6280.0000 -37.42668 -36.35238 1.07430 1.70907 -36.34808 420.78731
6285.0000 -37.16317 -35.93672 1.22645 1.71549 -36.30731 437.50221
6290.0000 -37.30987 -36.37140 0.93847 1.72242 -36.26332 459.83665
6295.0000 -37.24287 -35.90925 1.33363 1.71065 -36.33802 414.70481
6300.0000 -37.42833 -36.44108 0.98724 1.70069 -36.40129 409.10146
6305.0000 -37.25054 -36.17052 1.08002 1.70399 -36.38036 408.89135
6310.0000 -37.07280 -36.10365 0.96915 1.77201 -35.94844 529.58225
6315.0000 -37.00167 -36.19097 0.81070 1.72905 -36.22121 396.20191
6320.0000 -37.16528 -36.23539 0.92989 1.73583 -36.17815 456.50034
6325.0000 -37.05397 -36.14355 0.91043 1.73156 -36.20528 459.99810
6330.0000 -36.83184 -36.02498 0.80686 1.78893 -35.84102 556.44248
6335.0000 -37.15963 -35.87404 1.28559 1.75931 -36.02905 513.54973
6340.0000 -37.05606 -36.22074 0.83532 1.74248 -36.13595 469.81589
6345.0000 -37.19161 -36.07848 1.11313 1.73262 -36.19856 445.65761
6350.0000 -37.14806 -36.08299 1.06507 1.75869 -36.03300 468.49064
6355.0000 -37.20998 -36.51889 0.69108 1.71701 -36.29769 413.83049
6360.0000 -36.98552 -36.17971 0.80581 1.70468 -36.37595 407.91483
6365.0000 -37.23773 -36.22807 1.00966 1.73209 -36.20188 453.50650
6370.0000 -36.78050 -35.86629 0.91421 1.73185 -36.20341 438.58023
6375.0000 -37.05816 -36.14030 0.91785 1.72097 -36.27254 458.21063
6380.0000 -37.38580 -36.62949 0.75630 1.69976 -36.40720 417.09528
6385.0000 -37.34516 -36.36705 0.97811 1.65284 -36.70514 341.70825
6390.0000 -36.97110 -35.88373 1.08737 1.74384 -36.12729 486.99041
6395.0000 -37.29177 -36.31192 0.97985 1.76207 -36.01154 497.95931
6400.0000 -37.14063 -36.35299 0.78764 1.71465 -36.31266 429.41866
6405.0000 -37.14033 -36.40854 0.73179 1.70042 -36.40299 424.38041
6410.0000 -36.99513 -35.81180 1.18333 1.73190 -36.20315 455.38261
6415.0000 -37.30488 -36.03641 1.26848 1.78971 -35.83602 534.22359
6420.0000 -37.19706 -36.45170 0.74536 1.70527 -36.37223 405.87227
6425.0000 -37.20690 -36.14937 1.05753 1.71440 -36.31425 431.88447
6430.0000 -37.00833 -36.13198 0.87635 1.75975 -36.02626 474.23029
6435.0000 -37.16651 -36.30232 0.86419 1.76582 -35.98775 487.06420
6440.0000 -37.12182 -36.31098 0.81084 1.70956 -36.34496 414.39597
6445.0000 -37.31441 -36.33135 0.98306 1.71344 -36.32033 393.88054
6450.0000 -37.04830 -36.01858 1.02971 1.71412 -36.31602 442.57740
6455.0000 -37.14536 -36.24606 0.89929 1.74015 -36.15075 471.70206
6460.0000 -36.98824 -36.02482 0.96343 1.73689 -36.17143 479.49033
6465.0000 -37.12511 -35.98767 1.13744 1.77223 -35.94702 503.47279
6470.0000 -36.81800 -35.90770 0.91030 1.75721 -36.04244 507.19840
6475.0000 -37.42464 -36.74599 0.67865 1.70705 -36.36088 414.23198
6480.0000 -37.24486 -36.35387 0.89099 1.68481 -36.50210 373.08720
6485.0000 -36.89901 -36.17043 0.72858 1.75663 -36.04608 467.13167
6490.0000 -37.12643 -36.01798 1.10845 1.74755 -36.10375 463.84225
6495.0000 -37.09064 -36.07276 1.01788 1.74233 -36.13687 455.27630
6500.0000 -37.15332 -36.27550 0.87782 1.76619 -35.98537 451.82440
FREEZING PROCESS: loop number 27 T-loop= 446.00000000000000
main_MD> interactions number 27 at Temperature= 446.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.49253 -0.48958 2.64277
force_rgl> df(natom) 1.58128 -2.37415 -0.76440
6505.0000 -37.29404 -36.48341 0.81062 1.71418 -36.31567 413.38886
6510.0000 -37.21132 -36.51483 0.69649 1.67441 -36.56816 383.55489
6515.0000 -36.93949 -36.17051 0.76898 1.67593 -36.55848 375.92539
6520.0000 -37.13508 -36.30490 0.83018 1.71378 -36.31816 444.91111
6525.0000 -37.15448 -36.11727 1.03721 1.74272 -36.13443 445.50856
6530.0000 -37.07248 -36.22277 0.84971 1.72410 -36.25266 420.42842
6535.0000 -37.18399 -36.17693 1.00706 1.73419 -36.18855 462.91575
6540.0000 -37.05736 -36.35629 0.70107 1.71230 -36.32755 432.08130
6545.0000 -37.22276 -36.34185 0.88091 1.72687 -36.23504 460.17004
6550.0000 -37.09618 -36.01534 1.08084 1.72335 -36.25744 421.04732
6555.0000 -36.95383 -36.06986 0.88397 1.71864 -36.28729 433.16416
6560.0000 -37.05344 -36.21117 0.84227 1.74304 -36.13239 468.79947
6565.0000 -37.00555 -36.15978 0.84577 1.75056 -36.08466 465.65875
6570.0000 -37.04922 -36.18952 0.85970 1.72077 -36.27379 442.57758
6575.0000 -37.04737 -36.20855 0.83882 1.73472 -36.18522 447.05531
6580.0000 -37.46219 -36.79135 0.67084 1.67359 -36.57339 363.14210
6585.0000 -37.51924 -36.92549 0.59375 1.67740 -36.54914 367.00413
6590.0000 -37.20228 -36.48264 0.71964 1.64523 -36.75344 310.81312
6595.0000 -37.19424 -36.59424 0.60000 1.66822 -36.60747 337.28272
6600.0000 -37.00773 -36.25589 0.75184 1.69992 -36.40620 386.16454
6605.0000 -37.26462 -36.30425 0.96037 1.72949 -36.21845 455.20078
6610.0000 -37.39868 -36.33876 1.05992 1.71867 -36.28714 436.80788
6615.0000 -37.29082 -36.25669 1.03413 1.71150 -36.33265 432.58743
6620.0000 -37.10315 -35.74789 1.35525 1.77021 -35.95984 525.60124
6625.0000 -37.00005 -36.08322 0.91683 1.77851 -35.90716 524.83029
6630.0000 -37.36897 -36.03894 1.33003 1.75814 -36.03651 474.51587
6635.0000 -37.01408 -36.11374 0.90034 1.76024 -36.02315 480.22561
6640.0000 -36.96866 -36.35701 0.61165 1.73751 -36.16751 465.25292
6645.0000 -36.74772 -35.76359 0.98413 1.72023 -36.27719 414.42628
6650.0000 -36.83560 -36.07187 0.76373 1.78651 -35.85638 523.72546
6655.0000 -37.14945 -36.05788 1.09157 1.74021 -36.15034 454.18223
6660.0000 -36.98102 -35.93155 1.04948 1.76690 -35.98090 508.65336
6665.0000 -37.33405 -36.11989 1.21416 1.75037 -36.08583 500.96895
6670.0000 -36.90044 -36.02196 0.87848 1.75129 -36.08000 469.55359
6675.0000 -37.46653 -36.77056 0.69596 1.69889 -36.41271 441.23750
6680.0000 -37.20452 -36.01881 1.18571 1.67924 -36.53746 384.52835
6685.0000 -37.08169 -36.32145 0.76024 1.75695 -36.04405 485.27675
6690.0000 -37.08843 -36.31583 0.77260 1.72783 -36.22899 458.76943
6695.0000 -37.05196 -35.66785 1.38411 1.75313 -36.06832 488.33833
6700.0000 -36.89778 -35.89911 0.99866 1.79584 -35.79711 544.18719
6705.0000 -36.64883 -35.63431 1.01452 1.79274 -35.81682 524.31611
6710.0000 -37.06702 -36.16740 0.89962 1.76571 -35.98841 497.40069
6715.0000 -37.11527 -36.26357 0.85170 1.73690 -36.17137 456.97371
6720.0000 -37.13899 -36.35712 0.78187 1.71173 -36.33119 398.40760
6725.0000 -37.33164 -36.62419 0.70744 1.72106 -36.27197 454.30888
6730.0000 -37.14533 -36.12526 1.02007 1.68406 -36.50687 402.24382
6735.0000 -37.10122 -36.09802 1.00321 1.73034 -36.21301 476.21546
6740.0000 -37.16086 -36.16027 1.00059 1.71387 -36.31760 431.45729
6745.0000 -37.44513 -36.50828 0.93684 1.71601 -36.30402 421.78734
6750.0000 -37.11349 -36.34344 0.77006 1.69450 -36.44060 417.92071
FREEZING PROCESS: loop number 28 T-loop= 421.00000000000000
main_MD> interactions number 28 at Temperature= 421.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.49613 -1.87958 -0.10532
force_rgl> df(natom) 0.90966 0.97299 -9.31823
6755.0000 -37.47642 -36.66426 0.81216 1.68049 -36.52956 382.35628
6760.0000 -37.28810 -36.30342 0.98468 1.68906 -36.47513 378.14131
6765.0000 -37.57271 -36.90239 0.67032 1.68348 -36.51058 372.20275
6770.0000 -37.42869 -36.33159 1.09711 1.64429 -36.75938 324.45736
6775.0000 -37.47329 -36.63188 0.84141 1.69459 -36.44006 416.50027
6780.0000 -37.10839 -36.34422 0.76417 1.69861 -36.41448 424.75483
6785.0000 -37.40211 -36.77585 0.62626 1.69776 -36.41988 411.88136
6790.0000 -37.19087 -36.24128 0.94959 1.66256 -36.64343 350.43128
6795.0000 -37.28498 -36.51432 0.77067 1.73464 -36.18573 472.70255
6800.0000 -37.22561 -36.75109 0.47453 1.65525 -36.68985 339.66113
6805.0000 -37.48366 -36.55443 0.92923 1.67045 -36.59332 356.02600
6810.0000 -37.21703 -36.62543 0.59160 1.66435 -36.63202 358.91211
6815.0000 -37.34543 -36.41421 0.93122 1.70539 -36.37147 429.67426
6820.0000 -37.37233 -36.49758 0.87475 1.67028 -36.59440 353.31763
6825.0000 -37.25581 -36.37971 0.87609 1.70850 -36.35169 429.87760
6830.0000 -37.38970 -36.52886 0.86084 1.69994 -36.40604 422.95479
6835.0000 -37.16997 -36.60663 0.56334 1.67715 -36.55074 376.66964
6840.0000 -37.27067 -36.50240 0.76827 1.68185 -36.52091 410.02899
6845.0000 -37.26191 -36.53944 0.72246 1.68798 -36.48202 392.03130
6850.0000 -37.13725 -36.19641 0.94084 1.72743 -36.23148 442.22577
6855.0000 -37.47904 -36.63848 0.84057 1.69966 -36.40783 405.42846
6860.0000 -37.30981 -36.56903 0.74078 1.66726 -36.61356 366.54976
6865.0000 -37.23621 -36.48296 0.75325 1.68879 -36.47688 393.06977
6870.0000 -37.33673 -36.49175 0.84498 1.71120 -36.33453 417.39274
6875.0000 -36.94919 -36.04305 0.90614 1.72399 -36.25337 443.76295
6880.0000 -37.16182 -36.19539 0.96643 1.76530 -35.99103 492.67785
6885.0000 -37.35152 -36.26867 1.08285 1.73340 -36.19362 458.07635
6890.0000 -37.12811 -36.44431 0.68380 1.71697 -36.29791 415.98312
6895.0000 -37.02748 -36.18571 0.84178 1.72718 -36.23309 447.98405
6900.0000 -37.00116 -35.96126 1.03990 1.75421 -36.06147 481.51061
6905.0000 -37.58116 -36.92341 0.65775 1.68762 -36.48426 385.57143
6910.0000 -37.08623 -36.37317 0.71306 1.66377 -36.63575 355.70895
6915.0000 -37.13359 -36.20916 0.92442 1.69019 -36.46799 379.24671
6920.0000 -37.17096 -36.29108 0.87987 1.71536 -36.30811 432.35731
6925.0000 -37.07754 -36.18863 0.88892 1.72031 -36.27673 441.91997
6930.0000 -37.21170 -36.47956 0.73214 1.71442 -36.31412 415.38874
6935.0000 -37.11919 -36.01759 1.10160 1.72521 -36.24562 451.96862
6940.0000 -37.47042 -36.71239 0.75803 1.69886 -36.41290 406.08256
6945.0000 -37.35742 -36.42339 0.93403 1.69011 -36.46845 389.90982
6950.0000 -37.40059 -36.56709 0.83350 1.69033 -36.46710 423.61415
6955.0000 -37.38634 -36.88163 0.50471 1.66314 -36.63970 358.88586
6960.0000 -36.89176 -36.17506 0.71670 1.65667 -36.68078 350.98136
6965.0000 -37.34257 -36.34210 1.00047 1.74406 -36.12589 477.65499
6970.0000 -36.96012 -35.74298 1.21714 1.75202 -36.07534 479.00288
6975.0000 -37.50661 -36.59080 0.91581 1.72735 -36.23204 435.04275
6980.0000 -37.38061 -36.34576 1.03484 1.70340 -36.38411 415.06986
6985.0000 -37.19509 -36.03854 1.15655 1.69088 -36.46357 376.96215
6990.0000 -36.81714 -36.12494 0.69220 1.70848 -36.35180 420.70531
6995.0000 -37.25474 -36.31259 0.94216 1.74274 -36.13427 480.77181
7000.0000 -37.58067 -36.42859 1.15208 1.71252 -36.32617 416.13828
FREEZING PROCESS: loop number 29 T-loop= 396.00000000000000
main_MD> interactions number 29 at Temperature= 396.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.44793 -1.13750 0.00062
force_rgl> df(natom) 0.45258 0.51955 0.82055
7005.0000 -37.35455 -36.15381 1.20074 1.70899 -36.34856 455.50598
7010.0000 -36.94852 -36.01423 0.93429 1.74197 -36.13918 482.34593
7015.0000 -37.13193 -36.16709 0.96483 1.68879 -36.47685 375.08699
7020.0000 -37.25840 -36.64299 0.61541 1.71182 -36.33059 405.39021
7025.0000 -37.42078 -36.49804 0.92274 1.66577 -36.62300 356.17419
7030.0000 -37.25858 -36.67209 0.58649 1.66498 -36.62805 383.53882
7035.0000 -37.33086 -36.75401 0.57686 1.65309 -36.70355 341.36020
7040.0000 -37.34083 -36.70828 0.63255 1.63929 -36.79118 321.90147
7045.0000 -37.27204 -36.41771 0.85433 1.68653 -36.49121 393.74315
7050.0000 -37.26336 -36.55365 0.70971 1.68211 -36.51926 384.94667
7055.0000 -37.10405 -36.09011 1.01395 1.67912 -36.53826 362.11596
7060.0000 -37.05591 -36.26490 0.79100 1.71315 -36.32219 424.57472
7065.0000 -37.33713 -36.57434 0.76279 1.66382 -36.63537 356.68216
7070.0000 -37.48657 -36.73618 0.75039 1.66799 -36.60893 364.43005
7075.0000 -37.50113 -36.87166 0.62947 1.65719 -36.67751 338.32448
7080.0000 -37.28855 -36.54626 0.74229 1.65049 -36.72001 344.54265
7085.0000 -37.03749 -36.17330 0.86420 1.71423 -36.31531 409.92558
7090.0000 -37.23029 -36.63670 0.59359 1.68475 -36.50248 379.23553
7095.0000 -37.37256 -36.50702 0.86555 1.69549 -36.43432 390.43993
7100.0000 -37.07589 -36.21623 0.85967 1.71134 -36.33369 416.79652
7105.0000 -37.34547 -36.54326 0.80221 1.68359 -36.50987 375.43009
7110.0000 -37.43066 -36.59013 0.84053 1.67372 -36.57257 345.16965
7115.0000 -37.17803 -36.60239 0.57564 1.66491 -36.62846 357.60648
7120.0000 -37.52550 -36.68893 0.83658 1.67042 -36.59346 374.29982
7125.0000 -37.51132 -36.69212 0.81920 1.66900 -36.60249 373.95733
7130.0000 -37.19244 -36.36662 0.82582 1.68028 -36.53086 376.92095
7135.0000 -37.35233 -36.61438 0.73794 1.70957 -36.34492 415.97823
7140.0000 -36.99078 -36.07224 0.91853 1.72994 -36.21555 431.25103
7145.0000 -37.38227 -36.22892 1.15335 1.71632 -36.30203 425.13910
7150.0000 -37.29361 -36.67367 0.61994 1.69207 -36.45601 386.89192
7155.0000 -37.17294 -36.29870 0.87424 1.66086 -36.65422 346.28854
7160.0000 -37.35782 -36.47017 0.88765 1.71040 -36.33964 432.66500
7165.0000 -37.41523 -36.70630 0.70893 1.68677 -36.48970 377.70635
7170.0000 -37.30275 -36.49224 0.81052 1.65768 -36.67437 357.02926
7175.0000 -37.04892 -36.35203 0.69688 1.69674 -36.42638 396.19154
7180.0000 -37.34723 -36.62241 0.72482 1.67837 -36.54299 365.35961
7185.0000 -37.28292 -36.60271 0.68020 1.63985 -36.78762 314.24936
7190.0000 -37.26244 -36.33552 0.92692 1.70523 -36.37245 401.29678
7195.0000 -37.25741 -36.56846 0.68895 1.67703 -36.55150 366.43922
7200.0000 -37.15975 -36.17171 0.98805 1.71340 -36.32062 426.10516
7205.0000 -37.31129 -36.33773 0.97356 1.75744 -36.04097 486.09373
7210.0000 -37.24241 -36.60721 0.63521 1.69277 -36.45156 381.50271
7215.0000 -37.25337 -36.59174 0.66163 1.66349 -36.63747 357.31604
7220.0000 -37.10525 -36.41317 0.69208 1.67045 -36.59332 374.51264
7225.0000 -37.37448 -36.83679 0.53769 1.66979 -36.59752 356.96906
7230.0000 -37.66537 -36.89536 0.77001 1.62627 -36.87381 292.84324
7235.0000 -37.27215 -36.50386 0.76829 1.66882 -36.60365 361.04919
7240.0000 -37.29801 -36.46992 0.82809 1.70386 -36.38113 397.99194
7245.0000 -37.18043 -36.16306 1.01737 1.71088 -36.33658 417.93394
7250.0000 -37.03382 -36.09509 0.93873 1.74606 -36.11323 451.05856
FREEZING PROCESS: loop number 30 T-loop= 371.00000000000000
main_MD> interactions number 30 at Temperature= 371.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.13268 2.19286 0.77087
force_rgl> df(natom) 0.88226 1.42367 -1.84637
7255.0000 -37.51860 -36.63597 0.88263 1.71243 -36.32672 407.65031
7260.0000 -37.22508 -36.34984 0.87524 1.67064 -36.59213 371.90202
7265.0000 -37.14539 -36.58958 0.55581 1.69217 -36.45536 374.19556
7270.0000 -37.21494 -36.51279 0.70215 1.68457 -36.50364 377.65682
7275.0000 -37.44119 -36.66338 0.77782 1.68563 -36.49693 382.90613
7280.0000 -37.16565 -36.47117 0.69448 1.69368 -36.44583 383.31719
7285.0000 -37.49318 -36.86798 0.62520 1.65366 -36.69992 320.57534
7290.0000 -37.47341 -36.61251 0.86089 1.65461 -36.69385 326.00657
7295.0000 -37.40551 -36.74312 0.66239 1.66392 -36.63476 330.26598
7300.0000 -37.35448 -36.37280 0.98168 1.65905 -36.66569 332.04090
7305.0000 -37.36906 -36.55267 0.81640 1.68079 -36.52762 370.02726
7310.0000 -37.39186 -36.44609 0.94577 1.67563 -36.56041 391.20973
7315.0000 -37.12165 -36.60807 0.51358 1.68551 -36.49766 419.57685
7320.0000 -37.45600 -36.64452 0.81149 1.65637 -36.68274 341.51320
7325.0000 -37.35916 -36.59864 0.76053 1.67271 -36.57897 371.45435
7330.0000 -37.19777 -36.41325 0.78451 1.69759 -36.42099 421.65639
7335.0000 -37.29988 -36.57079 0.72908 1.67837 -36.54303 373.76532
7340.0000 -37.34059 -36.68405 0.65654 1.67865 -36.54126 370.76832
7345.0000 -37.25145 -36.62869 0.62276 1.65772 -36.67412 347.35161
7350.0000 -37.34239 -36.39617 0.94623 1.68144 -36.52352 397.84357
7355.0000 -37.36281 -36.48043 0.88238 1.69242 -36.45378 382.83536
7360.0000 -37.19234 -36.16149 1.03085 1.68615 -36.49362 388.12919
7365.0000 -37.30865 -36.19745 1.11119 1.71869 -36.28700 463.09245
7370.0000 -37.16488 -36.37203 0.79285 1.73481 -36.18465 458.29852
7375.0000 -37.26736 -36.67696 0.59040 1.68768 -36.48388 391.90771
7380.0000 -37.32341 -36.51821 0.80520 1.67611 -36.55738 375.50585
7385.0000 -37.11745 -36.36265 0.75480 1.69893 -36.41248 409.40650
7390.0000 -37.24789 -36.49338 0.75452 1.68653 -36.49122 376.33847
7395.0000 -37.23675 -36.54733 0.68942 1.67398 -36.57088 377.03684
7400.0000 -37.63625 -37.01687 0.61938 1.65851 -36.66915 363.89135
7405.0000 -37.54856 -36.65959 0.88897 1.61894 -36.92036 279.66949
7410.0000 -37.38199 -36.66568 0.71630 1.66884 -36.60354 352.86570
7415.0000 -37.42616 -36.65512 0.77104 1.66546 -36.62500 345.66224
7420.0000 -37.24080 -36.60877 0.63203 1.69696 -36.42501 404.64281
7425.0000 -37.49725 -36.51167 0.98558 1.66202 -36.64682 346.14389
7430.0000 -37.31299 -36.76764 0.54535 1.63960 -36.78919 303.90618
7435.0000 -37.31722 -36.45709 0.86013 1.65394 -36.69812 339.29412
7440.0000 -37.21062 -36.55560 0.65502 1.69470 -36.43933 392.48662
7445.0000 -37.33271 -36.35867 0.97403 1.67869 -36.54099 366.31603
7450.0000 -37.57995 -36.58021 0.99975 1.69369 -36.44574 390.71481
7455.0000 -37.32723 -36.65837 0.66886 1.65524 -36.68985 340.46883
7460.0000 -37.49592 -36.90673 0.58919 1.66854 -36.60543 355.58345
7465.0000 -37.22391 -36.46263 0.76127 1.63612 -36.81125 309.26023
7470.0000 -36.97554 -36.04018 0.93537 1.71635 -36.30183 428.38612
7475.0000 -36.99305 -36.26565 0.72741 1.70923 -36.34707 418.50356
7480.0000 -37.21742 -36.49387 0.72355 1.71014 -36.34131 423.12203
7485.0000 -37.16931 -36.05818 1.11113 1.72921 -36.22019 434.51487
7490.0000 -37.06769 -36.23695 0.83074 1.74001 -36.15166 437.86752
7495.0000 -37.15966 -36.41333 0.74633 1.72984 -36.21619 437.02069
7500.0000 -37.35087 -36.43689 0.91398 1.70021 -36.40436 403.98478
FREEZING PROCESS: loop number 31 T-loop= 346.00000000000000
main_MD> interactions number 31 at Temperature= 346.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.85651 -0.26208 0.83791
force_rgl> df(natom) -1.59844 1.14764 -0.53437
7505.0000 -37.50063 -36.87814 0.62248 1.63475 -36.82002 316.17848
7510.0000 -37.28664 -36.61795 0.66870 1.66327 -36.63892 354.75010
7515.0000 -37.33577 -36.60768 0.72809 1.66006 -36.65926 343.84473
7520.0000 -37.30132 -36.44754 0.85378 1.68928 -36.47377 390.43565
7525.0000 -37.07701 -36.45037 0.62663 1.70632 -36.36552 391.68690
7530.0000 -37.31545 -36.41881 0.89664 1.67848 -36.54229 373.72277
7535.0000 -37.35658 -36.60325 0.75332 1.68934 -36.47337 390.27580
7540.0000 -37.30449 -36.04387 1.26063 1.69420 -36.44248 383.19784
7545.0000 -37.19756 -36.12052 1.07705 1.74958 -36.09083 487.51526
7550.0000 -37.18947 -36.50864 0.68083 1.67111 -36.58910 347.01949
7555.0000 -37.21684 -36.55800 0.65883 1.67770 -36.54725 388.79384
7560.0000 -37.29759 -36.66079 0.63680 1.66820 -36.60760 365.04980
7565.0000 -37.29352 -36.58750 0.70602 1.67347 -36.57416 372.30581
7570.0000 -37.16882 -36.58703 0.58179 1.67898 -36.53913 374.19579
7575.0000 -37.51831 -36.83864 0.67967 1.63292 -36.83160 318.31644
7580.0000 -37.45270 -36.80203 0.65068 1.64315 -36.76662 328.39084
7585.0000 -37.45515 -36.88067 0.57448 1.62110 -36.90668 296.38880
7590.0000 -37.40018 -36.48519 0.91499 1.64984 -36.72420 320.84938
7595.0000 -37.16481 -36.59849 0.56632 1.67831 -36.54338 377.93373
7600.0000 -37.46264 -36.64628 0.81636 1.65884 -36.66700 343.39028
7605.0000 -37.36827 -36.47185 0.89642 1.67982 -36.53383 369.26741
7610.0000 -37.49099 -36.67833 0.81266 1.66574 -36.62323 367.31587
7615.0000 -37.50387 -36.94088 0.56299 1.63095 -36.84413 301.08741
7620.0000 -37.17177 -36.47794 0.69383 1.63104 -36.84355 309.84726
7625.0000 -37.41957 -36.44416 0.97540 1.71209 -36.32890 429.73531
7630.0000 -37.38470 -36.65734 0.72736 1.66856 -36.60530 361.46368
7635.0000 -37.43457 -36.77769 0.65688 1.63825 -36.79775 316.04266
7640.0000 -37.44690 -37.00812 0.43878 1.62379 -36.88960 298.08202
7645.0000 -37.15216 -36.55968 0.59248 1.64078 -36.78169 315.52357
7650.0000 -37.57074 -36.88601 0.68473 1.65191 -36.71103 330.80929
7655.0000 -37.53053 -37.07181 0.45872 1.61560 -36.94158 279.75956
7660.0000 -37.42463 -36.77894 0.64568 1.62204 -36.90072 284.90697
7665.0000 -37.42405 -36.55945 0.86460 1.64772 -36.73763 321.84626
7670.0000 -37.45821 -36.34628 1.11194 1.65828 -36.67056 333.15697
7675.0000 -37.62108 -36.94369 0.67739 1.65673 -36.68042 341.26020
7680.0000 -37.30793 -36.75532 0.55261 1.63713 -36.80485 318.91304
7685.0000 -37.15159 -36.55230 0.59929 1.65855 -36.66888 349.18481
7690.0000 -37.16115 -36.45096 0.71019 1.67216 -36.58244 359.63436
7695.0000 -37.37046 -36.66701 0.70346 1.66208 -36.64642 334.43411
7700.0000 -37.40712 -36.69577 0.71135 1.64473 -36.75660 320.07740
7705.0000 -37.42705 -36.95936 0.46769 1.63641 -36.80946 310.22816
7710.0000 -37.37708 -36.87039 0.50669 1.65838 -36.66993 342.03791
7715.0000 -37.52674 -36.97638 0.55036 1.62192 -36.90144 292.78130
7720.0000 -37.53312 -36.84216 0.69096 1.63613 -36.81124 307.51156
7725.0000 -37.31499 -36.55757 0.75741 1.65690 -36.67933 331.98632
7730.0000 -37.15684 -36.24433 0.91251 1.71159 -36.33206 419.00861
7735.0000 -37.22783 -36.50889 0.71893 1.69638 -36.42866 392.95707
7740.0000 -37.57684 -36.94327 0.63357 1.68324 -36.51209 360.72853
7745.0000 -37.51769 -36.85643 0.66126 1.64904 -36.72925 339.10363
7750.0000 -37.34987 -36.79780 0.55207 1.61712 -36.93192 284.51916
FREEZING PROCESS: loop number 32 T-loop= 321.00000000000000
main_MD> interactions number 32 at Temperature= 321.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.87278 1.51050 0.74006
force_rgl> df(natom) 0.30098 1.27578 -1.42704
7755.0000 -37.34195 -36.64001 0.70194 1.63295 -36.83140 300.97948
7760.0000 -37.50966 -36.69832 0.81133 1.64006 -36.78629 329.99036
7765.0000 -37.54170 -36.67606 0.86563 1.66069 -36.65529 356.13335
7770.0000 -37.57508 -36.79421 0.78087 1.65162 -36.71286 348.39095
7775.0000 -37.58297 -37.05389 0.52908 1.61809 -36.92580 287.79702
7780.0000 -37.52067 -36.80112 0.71955 1.62494 -36.88228 284.97493
7785.0000 -37.37380 -36.62391 0.74989 1.64703 -36.74200 332.91188
7790.0000 -37.56822 -36.64185 0.92637 1.69293 -36.45057 397.22466
7795.0000 -37.61129 -37.05033 0.56096 1.61747 -36.92973 287.95876
7800.0000 -37.57275 -37.06961 0.50313 1.58327 -37.14684 235.41257
7805.0000 -37.46443 -37.04931 0.41513 1.61346 -36.95515 277.80151
7810.0000 -37.61944 -37.15476 0.46468 1.60173 -37.02966 259.06556
7815.0000 -37.44322 -36.82005 0.62317 1.59661 -37.06214 252.75451
7820.0000 -37.40315 -36.65765 0.74550 1.62678 -36.87061 300.23537
7825.0000 -37.14792 -36.44904 0.69888 1.64853 -36.73250 350.47963
7830.0000 -37.24531 -36.34060 0.90472 1.69171 -36.45830 392.50695
7835.0000 -37.38825 -36.62944 0.75881 1.70133 -36.39725 419.26668
7840.0000 -37.18870 -36.26754 0.92116 1.70323 -36.38516 395.38196
7845.0000 -37.47936 -36.96163 0.51773 1.67252 -36.58014 351.44780
7850.0000 -37.40076 -36.90360 0.49715 1.62799 -36.86293 304.45574
7855.0000 -37.28214 -36.53423 0.74791 1.65234 -36.70829 337.63601
7860.0000 -37.34910 -36.48266 0.86643 1.68629 -36.49273 397.32926
7865.0000 -37.31107 -36.62010 0.69097 1.70375 -36.38186 415.81078
7870.0000 -37.28287 -36.41643 0.86644 1.67790 -36.54600 376.65176
7875.0000 -37.39090 -36.16233 1.22856 1.71729 -36.29587 422.14539
7880.0000 -37.32584 -36.78478 0.54106 1.68390 -36.50788 371.93809
7885.0000 -37.46876 -36.54673 0.92203 1.66732 -36.61318 358.66457
7890.0000 -37.31720 -36.74544 0.57176 1.63838 -36.79692 332.10686
7895.0000 -37.43290 -36.92980 0.50311 1.63240 -36.83493 304.05755
7900.0000 -37.64776 -36.98742 0.66033 1.62676 -36.87074 301.87281
7905.0000 -37.59463 -36.71466 0.87996 1.63069 -36.84575 311.23320
7910.0000 -37.56802 -36.56927 0.99875 1.66155 -36.64978 350.85435
7915.0000 -37.57304 -36.96441 0.60863 1.65227 -36.70872 346.71773
7920.0000 -37.73216 -37.10667 0.62550 1.59957 -37.04339 255.04785
7925.0000 -37.33664 -36.51746 0.81918 1.63396 -36.82501 306.65319
7930.0000 -37.49313 -36.80520 0.68794 1.61726 -36.93102 286.79641
7935.0000 -37.73176 -36.92808 0.80369 1.62589 -36.87623 297.87707
7940.0000 -37.41263 -36.87982 0.53281 1.62164 -36.90323 299.56839
7945.0000 -37.57659 -36.67243 0.90416 1.63257 -36.83380 301.10600
7950.0000 -37.43979 -36.78848 0.65131 1.64590 -36.74921 329.20633
7955.0000 -37.19868 -36.57153 0.62715 1.64493 -36.75535 324.24018
7960.0000 -37.35305 -36.78865 0.56441 1.63309 -36.83054 306.21511
7965.0000 -37.65592 -37.13208 0.52383 1.58737 -37.12081 242.63426
7970.0000 -37.69342 -37.18203 0.51139 1.58083 -37.16237 226.09573
7975.0000 -37.63414 -37.17465 0.45949 1.59875 -37.04855 265.95171
7980.0000 -37.49332 -36.86874 0.62457 1.59269 -37.08707 249.01951
7985.0000 -37.35421 -36.68267 0.67153 1.66123 -36.65183 349.41140
7990.0000 -37.55127 -36.92927 0.62199 1.64525 -36.75329 321.57551
7995.0000 -37.45407 -36.85673 0.59734 1.64511 -36.75420 321.23112
8000.0000 -37.41054 -36.82758 0.58297 1.63047 -36.84719 295.70198
main_MD> EXECUTION TIME: 0 [day], 0 [hour], 2 [min], 18.0824540 [s].
main_MD> Deallocating global variables
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