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nanoparticlesims/growth_Melting_Silver_ICO_2451/meltingSims/run_41/melt.log

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main_MD> Reading input file
read_input> Process type: melting
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 fromtoMelt_41.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 = 41 ntipo2 = 0
read_input> Finish reading input
main_MD> Allocating global variables
main_MD> Number of outputs that will be created: 1750
main_MD> Size of nv and nvoiz: 41 4100
main_MD> Size of nv and nvoiz: 41 4100
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 = 41
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> -6.2001991483330975E-003 -0.11776763442056128 -0.12670936690103635 initial drift of cluster / NP1 for coalescence
init> 0.36979712952427707 0.36995796325473246 0.33667443262422592 scaling for velocity /for coalescence NP1
init.f90 > facguy = 1.8658042791461023E-003
preparo> IN BIGVOI : LIMIT 1.2247448652052084 1.2247448652052084 1.2247448652052084
preparo> END t=0 TIME STEP
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -2.00289 -1.45932 1.43383
force_rgl> df(natom) 0.43721 0.01372 -1.25598
preparo> THERMALIZATION PROCESS AT 302.99485800134352
preparo> TOTAL ENERGY, KINETIC EN., POT. ENERGY, DELTA
5000 -100.53768343752077 2.0229828545080588 -102.56066629202883 3.7417329418391312E-004
preparo> END THERMALISATION ON NPAST DEFINE IN PARACLUSTER MODULE
main_MD> Time-loop is starting for melting
main_MD> Now the computation of EXECUTION TIME starts
main_MD> Running from loop 1 to 35
MELTING PROCESS: loop number 1 T-loop= 327.00000000000000
main_MD> interactions number 1 at Temperature= 327.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.00687 0.83320 -0.43740
force_rgl> df(natom) 0.91801 -0.14406 0.04150
5.0000 -102.19130 -100.72711 1.46419 1.70903 -100.62927 300.18047
10.0000 -102.37370 -101.07647 1.29723 1.69782 -100.76252 293.76589
15.0000 -102.21106 -100.68034 1.53072 1.67450 -101.03983 268.77135
20.0000 -102.29887 -100.62166 1.67721 1.71316 -100.58014 302.40155
25.0000 -102.27902 -100.64882 1.63020 1.69607 -100.78336 290.82162
30.0000 -102.07434 -100.39036 1.68398 1.70698 -100.65366 305.25710
35.0000 -101.50317 -99.73719 1.76598 1.74605 -100.18906 341.34377
40.0000 -102.34825 -100.70393 1.64432 1.72970 -100.38356 318.76108
45.0000 -102.13455 -100.36494 1.76961 1.73972 -100.26442 339.74692
50.0000 -102.07054 -100.25334 1.81720 1.73785 -100.28655 334.91667
55.0000 -101.45888 -99.45624 2.00264 1.76960 -99.90904 362.74803
60.0000 -101.96986 -100.08405 1.88581 1.78496 -99.72641 367.54814
65.0000 -101.89462 -100.04615 1.84847 1.75314 -100.10482 335.58413
70.0000 -102.22055 -100.31128 1.90927 1.76908 -99.91529 358.40287
75.0000 -101.94824 -100.25789 1.69035 1.72754 -100.40923 305.85227
80.0000 -101.77291 -100.10517 1.66775 1.74979 -100.14463 329.97384
85.0000 -101.83499 -100.10163 1.73336 1.75801 -100.04696 342.77047
90.0000 -102.20089 -100.43264 1.76826 1.72264 -100.46742 319.09120
95.0000 -101.89113 -100.03139 1.85974 1.72332 -100.45933 328.05420
100.0000 -102.23130 -100.50019 1.73111 1.73274 -100.34731 331.69594
105.0000 -102.12878 -100.61097 1.51781 1.70234 -100.70888 302.33332
110.0000 -102.32969 -100.45161 1.87808 1.70641 -100.66049 304.11296
115.0000 -102.32271 -100.57740 1.74530 1.70944 -100.62442 307.77603
120.0000 -102.26402 -100.50108 1.76294 1.72071 -100.49047 308.00205
125.0000 -102.22897 -100.41538 1.81359 1.73593 -100.30941 316.45962
130.0000 -101.86679 -100.50728 1.35951 1.72499 -100.43950 319.59661
135.0000 -102.22061 -100.69743 1.52318 1.70225 -100.70993 296.00132
140.0000 -101.88300 -100.40060 1.48240 1.72050 -100.49296 316.06711
145.0000 -101.92199 -100.62233 1.29966 1.73015 -100.37815 316.93024
150.0000 -102.13540 -100.16604 1.96936 1.72460 -100.44413 308.98256
155.0000 -101.87112 -100.28753 1.58360 1.75283 -100.10851 348.76072
160.0000 -102.21012 -100.29402 1.91610 1.73196 -100.35661 315.79524
165.0000 -101.84566 -100.15173 1.69394 1.74567 -100.19366 329.19761
170.0000 -101.88232 -100.02116 1.86115 1.73431 -100.32869 328.46047
175.0000 -101.95526 -100.07662 1.87865 1.76773 -99.93132 350.02087
180.0000 -102.21547 -99.83241 2.38307 1.76302 -99.98730 369.95256
185.0000 -101.87836 -100.11760 1.76076 1.74729 -100.17439 345.64417
190.0000 -101.93116 -100.00789 1.92327 1.74949 -100.14817 348.66155
195.0000 -102.26015 -100.49915 1.76100 1.74425 -100.21056 342.76818
200.0000 -102.12474 -100.38749 1.73725 1.73649 -100.30282 335.29775
205.0000 -102.22157 -100.52326 1.69831 1.71194 -100.59465 306.89957
210.0000 -102.10918 -100.39071 1.71846 1.73042 -100.37501 331.41447
215.0000 -101.30982 -99.55769 1.75213 1.75263 -100.11091 356.84420
220.0000 -101.66139 -99.74666 1.91473 1.80016 -99.54569 398.33128
225.0000 -102.16900 -100.63578 1.53322 1.73678 -100.29933 328.81305
230.0000 -101.95249 -100.34402 1.60848 1.70959 -100.62268 301.50947
235.0000 -102.19917 -100.32521 1.87395 1.73763 -100.28922 337.51035
240.0000 -102.32635 -100.61673 1.70962 1.73513 -100.31890 332.95328
245.0000 -102.11321 -100.59000 1.52321 1.72521 -100.43695 325.16861
250.0000 -102.46679 -100.94089 1.52590 1.71230 -100.59039 308.19031
MELTING PROCESS: loop number 2 T-loop= 352.00000000000000
main_MD> interactions number 2 at Temperature= 352.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.40924 2.63967 0.56330
force_rgl> df(natom) 2.62178 0.67113 -0.35493
255.0000 -101.98170 -100.03449 1.94721 1.70971 -100.62116 297.06403
260.0000 -101.66686 -99.81707 1.84979 1.76367 -99.97963 354.48720
265.0000 -102.20405 -100.07667 2.12738 1.75304 -100.10598 347.04735
270.0000 -102.10002 -100.30659 1.79343 1.74187 -100.23875 340.49628
275.0000 -102.05586 -100.03117 2.02469 1.74291 -100.22640 335.80213
280.0000 -101.72193 -100.03285 1.68908 1.74987 -100.14369 346.89835
285.0000 -101.70856 -100.07968 1.62888 1.75869 -100.03881 358.34931
290.0000 -101.79462 -99.52930 2.26532 1.80678 -99.46705 403.64711
295.0000 -101.90052 -99.61703 2.28349 1.77896 -99.79784 364.66976
300.0000 -102.07629 -100.29556 1.78073 1.75396 -100.09506 344.84067
305.0000 -101.70285 -99.91353 1.78932 1.74629 -100.18621 332.17899
310.0000 -101.46728 -99.34581 2.12147 1.80576 -99.47915 386.45754
315.0000 -101.31781 -99.50788 1.80994 1.81107 -99.41605 400.18780
320.0000 -101.09285 -99.37561 1.71724 1.81165 -99.40912 406.70639
325.0000 -101.95864 -99.65196 2.30668 1.79154 -99.64824 388.45074
330.0000 -101.88198 -99.93032 1.95167 1.77158 -99.88551 360.10637
335.0000 -101.98473 -100.05598 1.92876 1.75872 -100.03852 350.62094
340.0000 -101.92781 -99.65857 2.26924 1.76911 -99.91496 369.57480
345.0000 -101.53174 -99.77010 1.76164 1.77918 -99.79517 373.50685
350.0000 -101.53153 -99.63897 1.89256 1.77774 -99.81234 356.74851
355.0000 -101.66538 -99.47120 2.19419 1.78837 -99.68590 355.94472
360.0000 -101.47671 -99.28878 2.18793 1.79398 -99.61921 374.76377
365.0000 -101.96503 -100.13510 1.82993 1.80021 -99.54514 394.09427
370.0000 -102.04863 -100.18042 1.86821 1.75654 -100.06443 353.35800
375.0000 -102.02473 -100.35500 1.66973 1.74327 -100.22217 340.56009
380.0000 -101.87521 -99.99108 1.88414 1.75221 -100.11582 353.34168
385.0000 -102.08984 -99.92007 2.16977 1.77531 -99.84119 374.93264
390.0000 -102.14471 -100.06423 2.08048 1.76286 -99.98923 361.27134
395.0000 -101.55509 -99.59812 1.95697 1.75958 -100.02827 356.71256
400.0000 -101.97963 -100.16378 1.81585 1.76253 -99.99312 360.73959
405.0000 -102.06548 -100.03173 2.03375 1.74909 -100.15302 343.25383
410.0000 -101.05775 -98.81116 2.24659 1.80506 -99.48745 403.53422
415.0000 -102.19721 -100.06386 2.13335 1.80986 -99.43042 399.47526
420.0000 -101.88182 -99.97240 1.90941 1.76372 -99.97900 356.72895
425.0000 -102.04559 -100.22992 1.81566 1.74823 -100.16319 353.58951
430.0000 -101.83702 -99.88680 1.95021 1.75460 -100.08746 348.00966
435.0000 -101.51127 -99.31725 2.19402 1.80266 -99.51604 393.43009
440.0000 -101.77191 -99.72900 2.04292 1.80263 -99.51639 411.32733
445.0000 -101.71723 -99.57814 2.13908 1.77202 -99.88033 364.85701
450.0000 -101.51556 -99.69418 1.82138 1.79980 -99.55007 385.16452
455.0000 -101.87818 -100.13312 1.74505 1.79014 -99.66493 368.61698
460.0000 -101.98041 -99.92136 2.05906 1.73806 -100.28414 342.37023
465.0000 -102.16534 -100.40315 1.76219 1.74820 -100.16357 342.14298
470.0000 -101.92515 -99.87320 2.05196 1.74641 -100.18479 336.72372
475.0000 -101.60960 -99.44671 2.16290 1.79604 -99.59470 388.76478
480.0000 -101.54259 -99.46338 2.07921 1.79628 -99.59193 379.96641
485.0000 -102.09534 -100.30760 1.78774 1.76602 -99.95168 362.98500
490.0000 -101.95205 -99.70501 2.24704 1.77181 -99.88279 352.76061
495.0000 -101.75633 -99.99241 1.76392 1.76233 -99.99553 352.88478
500.0000 -102.11410 -100.18923 1.92487 1.73975 -100.26398 327.91308
MELTING PROCESS: loop number 3 T-loop= 377.00000000000000
main_MD> interactions number 3 at Temperature= 377.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -3.19964 -1.71249 -1.98688
force_rgl> df(natom) 1.26827 -0.27232 1.06395
505.0000 -102.14084 -100.42023 1.72060 1.75613 -100.06925 340.36809
510.0000 -101.67557 -99.73844 1.93713 1.75964 -100.02750 340.17095
515.0000 -101.44025 -99.43085 2.00940 1.83020 -99.18859 412.81366
520.0000 -101.72789 -99.61419 2.11370 1.79099 -99.65479 366.11622
525.0000 -101.81099 -99.68718 2.12381 1.78648 -99.70837 359.27620
530.0000 -101.27100 -99.15397 2.11702 1.81255 -99.39836 392.31173
535.0000 -102.13857 -100.11849 2.02008 1.79127 -99.65140 376.64025
540.0000 -101.28650 -99.28006 2.00644 1.78622 -99.71152 364.96404
545.0000 -101.36725 -99.54365 1.82360 1.81985 -99.31166 406.65424
550.0000 -101.45857 -99.32188 2.13669 1.81420 -99.37874 392.45583
555.0000 -101.85514 -100.10542 1.74972 1.77839 -99.80460 355.23379
560.0000 -101.57580 -99.26502 2.31078 1.80541 -99.48328 387.48190
565.0000 -101.68382 -99.21060 2.47322 1.81984 -99.31174 403.49799
570.0000 -101.93375 -99.61593 2.31783 1.80811 -99.45122 378.76065
575.0000 -101.64793 -100.04524 1.60269 1.77623 -99.83031 344.02713
580.0000 -100.75079 -99.02242 1.72837 1.79818 -99.56928 360.82089
585.0000 -100.77169 -98.52778 2.24391 1.84206 -99.04750 392.32983
590.0000 -101.10359 -98.84232 2.26127 1.87333 -98.67575 450.72624
595.0000 -102.04380 -99.98003 2.06377 1.81739 -99.34082 396.63809
600.0000 -101.26932 -99.10190 2.16742 1.80440 -99.49530 377.32345
605.0000 -100.97577 -99.14950 1.82627 1.83744 -99.10253 397.44331
610.0000 -101.27677 -99.07977 2.19700 1.83606 -99.11886 415.04225
615.0000 -101.46367 -98.47360 2.99007 1.87124 -98.70055 437.32035
620.0000 -101.88154 -99.36883 2.51271 1.84660 -98.99354 442.22311
625.0000 -101.69530 -99.84831 1.84699 1.81559 -99.36227 407.99336
630.0000 -101.63751 -99.72279 1.91472 1.77147 -99.88683 357.97653
635.0000 -101.66179 -99.98899 1.67280 1.81276 -99.39596 407.82108
640.0000 -102.16924 -100.26408 1.90516 1.72845 -100.39836 326.40667
645.0000 -101.35808 -98.79780 2.56029 1.82029 -99.30638 415.88503
650.0000 -101.02211 -98.96169 2.06042 1.83482 -99.13365 422.10731
655.0000 -101.85875 -99.49259 2.36616 1.84716 -98.98694 443.36387
660.0000 -101.41945 -99.52442 1.89503 1.80891 -99.44168 403.65769
665.0000 -101.72669 -99.72175 2.00494 1.78580 -99.71648 381.37349
670.0000 -101.46902 -99.49498 1.97404 1.80288 -99.51339 382.48059
675.0000 -101.15583 -99.15474 2.00108 1.81452 -99.37499 401.43590
680.0000 -101.44863 -99.38273 2.06590 1.80992 -99.42972 395.35612
685.0000 -101.58507 -99.97372 1.61135 1.80171 -99.52728 384.90561
690.0000 -101.60645 -99.56908 2.03737 1.75720 -100.05653 345.08349
695.0000 -101.64427 -99.82458 1.81969 1.77109 -99.89143 339.95299
700.0000 -101.93388 -100.10819 1.82569 1.77408 -99.85584 349.03298
705.0000 -101.80008 -99.79349 2.00659 1.75714 -100.05725 338.78207
710.0000 -102.01370 -99.71209 2.30161 1.76793 -99.92890 364.88779
715.0000 -101.44206 -99.63257 1.80950 1.77215 -99.87878 378.57723
720.0000 -101.83412 -99.56595 2.26817 1.82418 -99.26017 421.09262
725.0000 -101.94807 -100.05634 1.89173 1.79673 -99.58652 392.31842
730.0000 -102.01246 -100.26999 1.74247 1.73789 -100.28609 322.61158
735.0000 -101.23561 -98.89435 2.34126 1.80042 -99.54260 397.94781
740.0000 -101.64128 -99.75508 1.88620 1.80273 -99.51521 393.66063
745.0000 -101.79970 -100.16426 1.63544 1.77293 -99.86947 364.84600
750.0000 -102.07916 -100.01272 2.06644 1.76895 -99.91677 362.59471
MELTING PROCESS: loop number 4 T-loop= 402.00000000000000
main_MD> interactions number 4 at Temperature= 402.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.54235 -2.63426 -0.50522
force_rgl> df(natom) 0.07173 -1.25401 -0.30338
755.0000 -101.99469 -99.96156 2.03313 1.76222 -99.99681 348.77424
760.0000 -101.58229 -99.20947 2.37283 1.79609 -99.59407 385.04258
765.0000 -101.36947 -99.18792 2.18155 1.82328 -99.27089 416.37612
770.0000 -101.79706 -99.63169 2.16537 1.79775 -99.57443 372.29419
775.0000 -102.12319 -100.07840 2.04479 1.78696 -99.70264 385.38531
780.0000 -101.69461 -99.63276 2.06185 1.78319 -99.74746 379.09917
785.0000 -101.55234 -99.54686 2.00548 1.79731 -99.57965 388.75518
790.0000 -101.78042 -99.14260 2.63782 1.81432 -99.37742 389.85618
795.0000 -101.34690 -98.90855 2.43835 1.84879 -98.96757 437.41791
800.0000 -101.80288 -99.55549 2.24739 1.84923 -98.96227 439.94938
805.0000 -101.35631 -99.41814 1.93817 1.80593 -99.47717 395.81890
810.0000 -101.66005 -99.42169 2.23836 1.80824 -99.44967 393.61360
815.0000 -101.17988 -98.77071 2.40917 1.85658 -98.87494 446.06716
820.0000 -101.24509 -99.13082 2.11427 1.80828 -99.44921 393.90951
825.0000 -101.60290 -99.57402 2.02888 1.80857 -99.44568 394.34457
830.0000 -102.33864 -100.09758 2.24107 1.76404 -99.97517 342.26007
835.0000 -102.08768 -100.04810 2.03958 1.74956 -100.14736 337.41724
840.0000 -101.62657 -99.71885 1.90773 1.77718 -99.81902 378.49788
845.0000 -101.65159 -99.14124 2.51035 1.81120 -99.41448 413.31413
850.0000 -101.23697 -98.43509 2.80188 1.87396 -98.66824 463.08697
855.0000 -101.06918 -98.86997 2.19921 1.87403 -98.66745 482.43950
860.0000 -101.54404 -99.32393 2.22011 1.83920 -99.08158 426.65984
865.0000 -101.79794 -100.32465 1.47328 1.78957 -99.67169 378.33644
870.0000 -102.31440 -100.47232 1.84208 1.74348 -100.21971 336.40074
875.0000 -101.44493 -99.38681 2.05812 1.79943 -99.55438 389.23449
880.0000 -101.19655 -98.91939 2.27717 1.84107 -99.05936 423.49331
885.0000 -101.39392 -99.79990 1.59402 1.80081 -99.53796 386.62538
890.0000 -102.01582 -99.92867 2.08715 1.78247 -99.75605 372.86402
895.0000 -101.91767 -99.81612 2.10155 1.78655 -99.70757 382.21610
900.0000 -101.54448 -99.22280 2.32168 1.80112 -99.53433 388.60364
905.0000 -101.34710 -99.36978 1.97731 1.82763 -99.21909 410.95229
910.0000 -101.34142 -99.44188 1.89954 1.83354 -99.14880 428.18310
915.0000 -101.77416 -99.98303 1.79113 1.76659 -99.94485 360.36809
920.0000 -101.48457 -99.89786 1.58671 1.76619 -99.94968 356.19262
925.0000 -101.80690 -99.58976 2.21714 1.79736 -99.57904 384.61355
930.0000 -101.79579 -99.88763 1.90816 1.76322 -99.98490 344.05701
935.0000 -101.97449 -100.06195 1.91254 1.77639 -99.82834 357.33766
940.0000 -101.81723 -99.71513 2.10210 1.78551 -99.71987 371.95161
945.0000 -101.61413 -99.63206 1.98208 1.79708 -99.58232 389.60511
950.0000 -101.70901 -99.43534 2.27367 1.79952 -99.55330 391.51100
955.0000 -102.00143 -99.72336 2.27807 1.81916 -99.31981 409.71223
960.0000 -101.73915 -99.63102 2.10813 1.79057 -99.65973 394.34303
965.0000 -102.13828 -100.18699 1.95128 1.79038 -99.66197 385.16421
970.0000 -101.57650 -99.52149 2.05501 1.77151 -99.88642 365.89980
975.0000 -101.72124 -99.46996 2.25128 1.79759 -99.57627 380.75909
980.0000 -101.69096 -99.41856 2.27240 1.82904 -99.20237 433.13729
985.0000 -101.45199 -99.42799 2.02400 1.82456 -99.25557 414.60871
990.0000 -101.68708 -99.86003 1.82705 1.78512 -99.72456 382.71721
995.0000 -101.55037 -98.99034 2.56004 1.78508 -99.72509 377.01871
1000.0000 -101.63691 -99.72971 1.90720 1.79962 -99.55219 387.61256
MELTING PROCESS: loop number 5 T-loop= 427.00000000000000
main_MD> interactions number 5 at Temperature= 427.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.02820 -1.24386 0.42713
force_rgl> df(natom) -2.15592 -3.93246 3.35970
1005.0000 -100.98390 -98.77575 2.20815 1.85846 -98.85258 448.10323
1010.0000 -101.25895 -99.28381 1.97514 1.82147 -99.29230 379.92295
1015.0000 -101.43677 -99.54253 1.89424 1.81625 -99.35442 392.28056
1020.0000 -101.68789 -99.74194 1.94595 1.79729 -99.57983 382.12294
1025.0000 -101.36745 -99.45873 1.90873 1.79879 -99.56204 401.85333
1030.0000 -101.24289 -99.23208 2.01081 1.81044 -99.42354 393.43986
1035.0000 -101.56306 -98.82099 2.74207 1.85885 -98.84788 446.56740
1040.0000 -101.81008 -99.64845 2.16163 1.84201 -99.04818 435.67356
1045.0000 -101.80214 -99.95946 1.84268 1.79057 -99.65973 375.63919
1050.0000 -101.64771 -99.52496 2.12275 1.81487 -99.37083 404.76848
1055.0000 -101.82768 -99.45476 2.37292 1.80566 -99.48030 394.14130
1060.0000 -101.36954 -98.98732 2.38222 1.83782 -99.09794 425.91593
1065.0000 -101.43136 -99.47824 1.95312 1.83917 -99.08187 416.59529
1070.0000 -101.49404 -99.09861 2.39543 1.85258 -98.92249 437.27998
1075.0000 -101.27732 -98.73574 2.54158 1.86017 -98.83215 439.54863
1080.0000 -101.92740 -99.58798 2.33942 1.82846 -99.20927 413.63193
1085.0000 -102.05982 -99.67868 2.38114 1.80104 -99.53528 384.75703
1090.0000 -101.43531 -99.17645 2.25886 1.79160 -99.64757 388.82949
1095.0000 -101.48656 -99.48227 2.00430 1.79230 -99.63917 390.30798
1100.0000 -101.13637 -98.74709 2.38929 1.84279 -99.03888 445.29260
1105.0000 -101.63481 -99.45451 2.18030 1.85926 -98.84301 462.73021
1110.0000 -101.45549 -99.13271 2.32279 1.81191 -99.40598 405.91830
1115.0000 -101.11844 -98.59114 2.52730 1.86819 -98.73681 460.80810
1120.0000 -100.95450 -98.80992 2.14458 1.89011 -98.47622 462.68729
1125.0000 -100.99441 -98.34514 2.64927 1.85927 -98.84288 446.88993
1130.0000 -101.33252 -98.56404 2.76849 1.86141 -98.81743 465.95896
1135.0000 -101.21577 -98.88024 2.33553 1.85473 -98.89691 444.99762
1140.0000 -101.14866 -99.20877 1.93989 1.84016 -99.07010 439.66577
1145.0000 -101.46653 -99.61280 1.85373 1.79507 -99.60631 378.90416
1150.0000 -100.96520 -98.81087 2.15433 1.79866 -99.56358 379.44104
1155.0000 -100.96899 -98.61151 2.35748 1.87348 -98.67392 457.56208
1160.0000 -101.23928 -99.24305 1.99624 1.85647 -98.87614 442.46476
1165.0000 -101.63944 -99.54629 2.09315 1.80124 -99.53287 404.45562
1170.0000 -102.26936 -100.04334 2.22602 1.77705 -99.82056 372.42522
1175.0000 -102.27810 -99.82852 2.44958 1.77189 -99.88186 371.78372
1180.0000 -101.54362 -99.50837 2.03525 1.76940 -99.91149 363.04910
1185.0000 -101.08590 -98.82027 2.26562 1.82359 -99.26712 423.19366
1190.0000 -101.39147 -99.73459 1.65688 1.79797 -99.57182 397.49523
1195.0000 -101.75599 -99.81516 1.94083 1.77001 -99.90418 376.36690
1200.0000 -101.89982 -99.86253 2.03729 1.79581 -99.59748 393.88795
1205.0000 -101.97330 -99.80924 2.16406 1.76494 -99.96449 368.08991
1210.0000 -101.61116 -98.81458 2.79658 1.81154 -99.41044 412.86847
1215.0000 -100.89099 -98.79147 2.09952 1.84954 -98.95860 438.06793
1220.0000 -100.99312 -99.22842 1.76470 1.83443 -99.13830 418.33554
1225.0000 -101.04265 -98.83651 2.20614 1.85059 -98.94614 431.10580
1230.0000 -101.54069 -99.02229 2.51840 1.85032 -98.94932 428.53376
1235.0000 -101.36090 -99.01355 2.34735 1.84528 -99.00926 433.48474
1240.0000 -101.21308 -98.92013 2.29296 1.84277 -99.03914 425.96949
1245.0000 -100.67842 -97.92783 2.75059 1.89557 -98.41132 476.70632
1250.0000 -100.72220 -98.04392 2.67828 1.94203 -97.85891 499.44547
MELTING PROCESS: loop number 6 T-loop= 452.00000000000000
main_MD> interactions number 6 at Temperature= 452.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.79482 -2.35162 2.77047
force_rgl> df(natom) -1.22633 0.81128 -0.26583
1255.0000 -101.49361 -99.09127 2.40235 1.90190 -98.33607 478.37435
1260.0000 -101.13942 -98.60237 2.53706 1.85627 -98.87861 432.67417
1265.0000 -101.19010 -98.54592 2.64418 1.86916 -98.72536 444.37157
1270.0000 -100.88327 -98.67114 2.21213 1.87958 -98.60146 443.44701
1275.0000 -100.95131 -98.40390 2.54741 1.87097 -98.70374 461.67881
1280.0000 -100.49128 -98.45715 2.03413 1.88335 -98.55662 466.78372
1285.0000 -101.03497 -98.34999 2.68498 1.87680 -98.63448 465.48326
1290.0000 -100.97379 -98.74126 2.23253 1.90061 -98.35131 491.56162
1295.0000 -101.68039 -99.15344 2.52695 1.85347 -98.91191 451.46311
1300.0000 -101.05495 -99.15987 1.89508 1.84720 -98.98642 436.69126
1305.0000 -101.38266 -99.03278 2.34988 1.83894 -99.08465 415.79035
1310.0000 -101.25096 -99.26510 1.98586 1.85534 -98.88957 434.12538
1315.0000 -101.23352 -99.03596 2.19756 1.84651 -98.99465 435.26178
1320.0000 -100.87995 -98.10417 2.77579 1.87343 -98.67454 447.72023
1325.0000 -100.75339 -98.58218 2.17121 1.89751 -98.38828 457.90866
1330.0000 -100.19607 -97.95369 2.24238 1.91840 -98.13987 497.62701
1335.0000 -100.73593 -98.52956 2.20636 1.90794 -98.26417 483.82089
1340.0000 -101.02813 -99.12080 1.90732 1.89166 -98.45779 476.26285
1345.0000 -101.10807 -98.49664 2.61144 1.86781 -98.74133 455.15577
1350.0000 -100.81546 -98.62355 2.19190 1.87003 -98.71491 421.10837
1355.0000 -100.67575 -98.26797 2.40778 1.87811 -98.61888 422.95304
1360.0000 -100.26654 -97.66922 2.59733 1.97758 -97.43620 506.41316
1365.0000 -100.61825 -98.39418 2.22407 1.90681 -98.27767 433.20240
1370.0000 -100.44392 -97.78183 2.66209 1.92322 -98.08249 464.45916
1375.0000 -101.19685 -98.60075 2.59611 1.91435 -98.18804 473.94750
1380.0000 -100.49922 -98.06943 2.42979 1.89882 -98.37269 465.41143
1385.0000 -100.58074 -97.18064 3.40010 1.96070 -97.63689 529.08694
1390.0000 -101.16568 -98.58964 2.57603 1.90087 -98.34830 457.69606
1395.0000 -101.45945 -98.45665 3.00280 1.88823 -98.49859 442.48263
1400.0000 -100.43361 -97.86675 2.56686 1.90381 -98.31326 464.49902
1405.0000 -100.87835 -98.29779 2.58056 1.92679 -98.04010 484.07857
1410.0000 -100.55633 -97.86491 2.69142 1.92360 -98.07804 480.17979
1415.0000 -100.30625 -97.22224 3.08400 1.96984 -97.52822 512.80182
1420.0000 -100.66436 -98.07645 2.58791 1.92790 -98.02693 473.14776
1425.0000 -100.38086 -97.99434 2.38651 1.90196 -98.33531 486.20156
1430.0000 -100.54049 -98.65900 1.88148 1.91412 -98.19076 460.21535
1435.0000 -100.18959 -98.12724 2.06235 1.91017 -98.23763 441.57924
1440.0000 -100.46944 -98.64728 1.82216 1.90984 -98.24167 452.55799
1445.0000 -101.16835 -98.60508 2.56327 1.88037 -98.59200 437.01325
1450.0000 -101.32204 -99.25900 2.06304 1.85002 -98.95288 423.33461
1455.0000 -101.53654 -99.38099 2.15555 1.81848 -99.32789 391.93848
1460.0000 -101.26226 -98.96335 2.29891 1.83869 -99.08765 413.73796
1465.0000 -101.10966 -98.96029 2.14937 1.84731 -98.98509 432.62227
1470.0000 -100.57704 -98.32344 2.25360 1.86292 -98.79946 451.68147
1475.0000 -100.90915 -98.71061 2.19854 1.90104 -98.34628 473.02694
1480.0000 -100.44589 -98.03694 2.40896 1.89593 -98.40703 456.37251
1485.0000 -100.51375 -97.63345 2.88030 1.93171 -97.98162 463.81834
1490.0000 -100.52989 -98.00377 2.52612 1.93902 -97.89463 467.15688
1495.0000 -101.07781 -98.76563 2.31218 1.91604 -98.16784 463.64344
1500.0000 -101.09109 -98.39464 2.69645 1.89056 -98.47081 435.56840
MELTING PROCESS: loop number 7 T-loop= 477.00000000000000
main_MD> interactions number 7 at Temperature= 477.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.61700 -2.13723 0.34871
force_rgl> df(natom) 0.01824 -1.11037 -0.28795
1505.0000 -100.53381 -97.87428 2.65953 1.92571 -98.05291 475.91017
1510.0000 -99.84223 -97.60349 2.23874 1.92082 -98.11110 468.67611
1515.0000 -100.21943 -97.81136 2.40807 1.95157 -97.74539 489.56170
1520.0000 -101.18551 -98.26325 2.92226 1.95621 -97.69026 516.96762
1525.0000 -100.54388 -97.48580 3.05808 1.93121 -97.98754 483.82594
1530.0000 -100.70264 -98.50671 2.19593 1.92264 -98.08942 511.61763
1535.0000 -100.37577 -98.01425 2.36152 1.91632 -98.16453 487.74087
1540.0000 -100.89852 -98.64424 2.25428 1.91285 -98.20584 471.23316
1545.0000 -100.98905 -98.73634 2.25271 1.84840 -98.97221 425.36523
1550.0000 -101.19180 -98.75403 2.43777 1.87641 -98.63907 434.61611
1555.0000 -100.75807 -98.69757 2.06050 1.86806 -98.73840 427.62020
1560.0000 -100.84320 -98.52509 2.31811 1.88954 -98.48298 450.19578
1565.0000 -101.10878 -98.58988 2.51890 1.88972 -98.48081 455.21299
1570.0000 -101.37885 -99.10290 2.27595 1.88133 -98.58061 458.17513
1575.0000 -100.75140 -98.40299 2.34841 1.86793 -98.73990 465.65842
1580.0000 -101.05248 -98.47971 2.57277 1.88808 -98.50037 483.65119
1585.0000 -101.59518 -98.74875 2.84643 1.87633 -98.64007 461.95232
1590.0000 -101.59272 -99.16718 2.42554 1.87737 -98.62775 459.60781
1595.0000 -101.74648 -99.10796 2.63851 1.84520 -99.01014 442.84187
1600.0000 -100.70771 -98.41350 2.29421 1.88015 -98.59463 483.44993
1605.0000 -100.73955 -98.07439 2.66516 1.89895 -98.37110 493.61076
1610.0000 -101.18074 -98.43083 2.74991 1.90795 -98.26406 495.91528
1615.0000 -100.65195 -98.08768 2.56427 1.91209 -98.21484 479.55030
1620.0000 -101.29463 -98.35839 2.93624 1.87620 -98.64163 452.97414
1625.0000 -100.89816 -97.79649 3.10167 1.96080 -97.63570 543.66979
1630.0000 -100.83389 -98.51127 2.32262 1.92600 -98.04944 497.21301
1635.0000 -100.03489 -97.32817 2.70672 1.91959 -98.12573 501.99523
1640.0000 -100.88484 -98.05741 2.82743 1.94141 -97.86629 540.93508
1645.0000 -100.24782 -97.52087 2.72695 1.94054 -97.87654 538.10338
1650.0000 -100.45480 -98.69113 1.76367 1.89836 -98.37814 490.60548
1655.0000 -100.62049 -98.45239 2.16810 1.87545 -98.65048 462.72473
1660.0000 -100.71545 -98.29766 2.41779 1.87275 -98.68262 432.80632
1665.0000 -100.36928 -97.76349 2.60578 1.94684 -97.80171 518.98192
1670.0000 -101.14060 -98.41043 2.73017 1.90309 -98.32189 460.43543
1675.0000 -100.84660 -98.44976 2.39684 1.89236 -98.44948 461.11378
1680.0000 -101.24766 -99.01577 2.23190 1.88829 -98.49790 472.00660
1685.0000 -101.24557 -98.45758 2.78800 1.86606 -98.76216 464.64928
1690.0000 -100.78339 -98.48039 2.30300 1.88541 -98.53213 451.78755
1695.0000 -100.11074 -97.38909 2.72165 1.94784 -97.78981 506.64542
1700.0000 -100.17543 -97.76095 2.41448 1.99763 -97.19778 534.25544
1705.0000 -100.79204 -98.31202 2.48003 1.90469 -98.30287 453.40071
1710.0000 -100.60491 -97.41420 3.19071 1.94816 -97.78594 485.94904
1715.0000 -99.74105 -96.72143 3.01962 2.01830 -96.95198 558.48766
1720.0000 -100.66726 -98.36893 2.29833 1.96301 -97.60941 511.75724
1725.0000 -101.08448 -98.74965 2.33482 1.88975 -98.48049 447.64406
1730.0000 -101.04828 -98.96623 2.08205 1.84422 -99.02189 399.72741
1735.0000 -100.58099 -97.94394 2.63704 1.89674 -98.39739 443.60413
1740.0000 -100.72428 -97.98622 2.73806 1.92917 -98.01180 470.82863
1745.0000 -100.84077 -98.02410 2.81667 1.94332 -97.84349 484.88178
1750.0000 -100.66261 -98.10040 2.56221 1.93943 -97.88975 487.26446
MELTING PROCESS: loop number 8 T-loop= 502.00000000000000
main_MD> interactions number 8 at Temperature= 502.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.03977 0.52809 0.52967
force_rgl> df(natom) -1.19476 -1.20235 8.57601
1755.0000 -100.56770 -98.18830 2.37940 1.91210 -98.21480 463.33002
1760.0000 -100.17592 -97.40792 2.76800 1.94888 -97.77742 505.01616
1765.0000 -100.48051 -97.47095 3.00956 1.97317 -97.48862 518.72905
1770.0000 -99.29972 -97.05675 2.24297 1.96896 -97.53865 529.63245
1775.0000 -100.28211 -97.39310 2.88901 1.98218 -97.38146 525.25925
1780.0000 -100.37661 -97.96792 2.40869 1.94130 -97.86753 499.21123
1785.0000 -100.50840 -97.91875 2.58965 1.91720 -98.15409 489.40273
1790.0000 -100.58308 -98.14284 2.44024 1.91455 -98.18565 487.47702
1795.0000 -100.83291 -98.15505 2.67786 1.91077 -98.23056 476.56410
1800.0000 -100.92851 -98.41960 2.50891 1.90566 -98.29136 474.27919
1805.0000 -100.38663 -97.53405 2.85258 1.95019 -97.76188 515.59056
1810.0000 -100.80064 -98.09629 2.70435 1.92952 -98.00759 513.79760
1815.0000 -100.87751 -98.59709 2.28042 1.91198 -98.21619 501.12289
1820.0000 -100.26241 -98.12528 2.13713 1.89395 -98.43061 471.93323
1825.0000 -100.67117 -98.36468 2.30649 1.88623 -98.52232 445.30355
1830.0000 -101.17697 -98.80035 2.37662 1.89637 -98.40178 458.88108
1835.0000 -101.07660 -98.86491 2.21169 1.87404 -98.66733 461.57257
1840.0000 -101.67859 -99.15042 2.52817 1.86922 -98.72463 430.67789
1845.0000 -101.60604 -98.85156 2.75448 1.84730 -98.98522 439.13636
1850.0000 -101.48935 -99.06065 2.42869 1.84218 -99.04606 444.18225
1855.0000 -101.39567 -99.35786 2.03782 1.81285 -99.39486 406.67996
1860.0000 -100.58140 -98.19904 2.38236 1.85505 -98.89310 453.14577
1865.0000 -100.92167 -98.21896 2.70270 1.87806 -98.61954 472.23384
1870.0000 -100.96380 -98.06172 2.90207 1.90409 -98.30998 488.71095
1875.0000 -100.95605 -98.79133 2.16471 1.88532 -98.53316 455.83228
1880.0000 -100.98942 -97.98632 3.00310 1.87316 -98.67769 453.73487
1885.0000 -101.04388 -98.34719 2.69668 1.93757 -97.91188 512.03134
1890.0000 -100.81250 -98.53295 2.27955 1.88759 -98.50623 471.37642
1895.0000 -100.43601 -97.91008 2.52593 1.88702 -98.51292 439.90715
1900.0000 -100.38481 -97.73859 2.64621 1.93034 -97.99787 481.42322
1905.0000 -100.02383 -97.98611 2.03773 1.93645 -97.92521 476.99547
1910.0000 -100.60105 -97.95556 2.64548 1.90926 -98.24857 463.35848
1915.0000 -100.64094 -97.83917 2.80177 1.92697 -98.03794 482.22769
1920.0000 -100.80913 -98.11362 2.69550 1.93691 -97.91973 511.03516
1925.0000 -100.85072 -97.82535 3.02537 1.94050 -97.87707 509.85688
1930.0000 -100.39061 -97.55163 2.83898 1.93995 -97.88361 505.20089
1935.0000 -100.73847 -98.42219 2.31628 1.95234 -97.73623 530.74273
1940.0000 -100.56554 -97.33451 3.23103 1.89563 -98.41052 467.73515
1945.0000 -100.53633 -97.93073 2.60560 1.95969 -97.64891 554.68595
1950.0000 -100.85644 -98.43213 2.42431 1.93027 -97.99865 498.18220
1955.0000 -100.43438 -97.68021 2.75418 1.93433 -97.95042 514.50585
1960.0000 -100.91057 -97.99105 2.91952 1.94836 -97.78357 531.41744
1965.0000 -100.88435 -98.51633 2.36803 1.94519 -97.82126 519.47501
1970.0000 -100.92227 -98.23254 2.68973 1.90504 -98.29871 485.38953
1975.0000 -100.80306 -98.42548 2.37758 1.89442 -98.42495 453.03184
1980.0000 -100.86592 -98.28274 2.58318 1.91157 -98.22102 465.23817
1985.0000 -100.28637 -97.46924 2.81713 1.98617 -97.33407 542.54584
1990.0000 -101.03150 -98.42849 2.60301 1.93160 -97.98286 505.88396
1995.0000 -100.36073 -97.91588 2.44485 1.92490 -98.06251 496.62572
2000.0000 -100.85603 -98.25655 2.59947 1.92856 -98.01905 508.20297
MELTING PROCESS: loop number 9 T-loop= 527.00000000000000
main_MD> interactions number 9 at Temperature= 527.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.47449 0.25029 0.67594
force_rgl> df(natom) 2.60136 -0.09267 -0.72226
2005.0000 -100.95697 -98.85352 2.10345 1.89209 -98.45270 484.73455
2010.0000 -100.46183 -97.91059 2.55124 1.90598 -98.28750 497.28456
2015.0000 -99.67614 -97.14144 2.53470 1.98375 -97.36284 563.36450
2020.0000 -100.57873 -96.93652 3.64221 2.01307 -97.01414 597.20494
2025.0000 -99.99132 -97.17266 2.81866 2.03493 -96.75425 561.71236
2030.0000 -99.95474 -97.38395 2.57078 1.99014 -97.28682 523.30613
2035.0000 -100.42739 -97.56650 2.86089 1.95902 -97.65683 513.41307
2040.0000 -100.78393 -97.71369 3.07024 1.90626 -98.28415 480.88395
2045.0000 -100.19957 -97.09354 3.10603 1.98159 -97.38851 553.90487
2050.0000 -99.81276 -96.66025 3.15250 2.01839 -96.95092 561.96994
2055.0000 -99.77694 -96.68112 3.09583 2.07015 -96.33548 601.04533
2060.0000 -100.09048 -97.54807 2.54242 1.97991 -97.40845 513.85907
2065.0000 -100.98029 -98.35387 2.62642 1.92177 -98.09981 471.69944
2070.0000 -100.59201 -97.49051 3.10150 1.90799 -98.26360 480.00850
2075.0000 -100.55341 -98.13017 2.42324 1.93946 -97.88947 512.22583
2080.0000 -100.71696 -98.36915 2.34782 1.90891 -98.25267 480.62467
2085.0000 -100.55139 -98.07949 2.47190 1.93312 -97.96486 509.41763
2090.0000 -99.94764 -97.31558 2.63206 1.95357 -97.72169 514.92820
2095.0000 -99.70571 -96.68051 3.02521 2.01829 -96.95214 570.38920
2100.0000 -100.01641 -97.51803 2.49839 2.01613 -96.97775 536.11071
2105.0000 -100.58472 -98.24053 2.34419 1.92920 -98.01143 486.75592
2110.0000 -100.54831 -97.73002 2.81829 1.89236 -98.44942 436.23911
2115.0000 -100.66357 -98.36167 2.30189 1.92882 -98.01589 497.05929
2120.0000 -99.97501 -97.71976 2.25525 1.92761 -98.03029 481.16778
2125.0000 -100.53214 -97.73107 2.80107 1.95262 -97.73294 504.01390
2130.0000 -100.27940 -97.26372 3.01568 1.97271 -97.49411 510.87684
2135.0000 -100.27873 -97.59069 2.68804 1.97918 -97.41711 526.64460
2140.0000 -99.75941 -97.09550 2.66391 2.01350 -97.00908 581.30828
2145.0000 -100.62333 -97.55676 3.06657 1.97412 -97.47728 536.92710
2150.0000 -100.66209 -97.92445 2.73764 1.98971 -97.29192 550.97797
2155.0000 -100.90272 -97.70744 3.19528 1.95307 -97.72760 543.19207
2160.0000 -101.22687 -98.33594 2.89093 1.94078 -97.87368 505.90099
2165.0000 -100.57448 -97.43740 3.13708 1.91954 -98.12627 496.52670
2170.0000 -100.52595 -98.20741 2.31855 1.93819 -97.90450 502.94003
2175.0000 -100.99423 -98.48293 2.51130 1.89834 -98.37830 469.55947
2180.0000 -99.61127 -97.55207 2.05921 1.91934 -98.12865 480.06144
2185.0000 -100.12716 -97.17305 2.95411 1.97540 -97.46207 540.57881
2190.0000 -100.28870 -97.15589 3.13281 1.98458 -97.35289 531.75623
2195.0000 -99.65060 -96.88703 2.76357 2.01360 -97.00785 558.29315
2200.0000 -100.53427 -97.70818 2.82608 2.00555 -97.10356 504.74754
2205.0000 -100.27986 -97.72060 2.55926 1.94938 -97.77144 501.37216
2210.0000 -99.97748 -97.46006 2.51742 1.95335 -97.72429 487.05410
2215.0000 -98.84054 -95.69856 3.14198 2.07127 -96.32214 602.44969
2220.0000 -99.10200 -96.07705 3.02495 2.12219 -95.71667 641.46663
2225.0000 -99.66970 -96.97051 2.69919 2.06890 -96.35041 587.14646
2230.0000 -100.51625 -97.43634 3.07992 2.01768 -96.95939 557.18850
2235.0000 -100.27205 -96.88357 3.38847 1.99176 -97.26756 561.44224
2240.0000 -100.22089 -97.35932 2.86156 2.00363 -97.12638 543.86819
2245.0000 -100.29575 -96.81163 3.48413 2.02359 -96.88916 544.71055
2250.0000 -100.19410 -97.05614 3.13796 1.99395 -97.24153 543.63130
MELTING PROCESS: loop number 10 T-loop= 552.00000000000000
main_MD> interactions number 10 at Temperature= 552.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -2.01123 0.69095 -2.44980
force_rgl> df(natom) 0.08718 -1.14092 -1.14257
2255.0000 -99.50056 -96.63588 2.86468 2.03756 -96.72300 569.01228
2260.0000 -100.97553 -98.12507 2.85046 1.96283 -97.61156 511.59941
2265.0000 -101.05630 -98.02195 3.03435 1.90749 -98.26952 490.46062
2270.0000 -100.57453 -97.68322 2.89131 1.92740 -98.03283 504.99014
2275.0000 -100.38291 -97.72503 2.65788 1.94689 -97.80111 525.11896
2280.0000 -100.21550 -97.26186 2.95365 1.96693 -97.56280 566.32779
2285.0000 -99.68714 -97.39470 2.29244 1.98887 -97.30192 547.45732
2290.0000 -99.99662 -96.76392 3.23270 2.01334 -97.01092 581.44182
2295.0000 -99.64476 -96.47105 3.17371 2.04280 -96.66068 580.11439
2300.0000 -99.37772 -96.43870 2.93902 2.07483 -96.27981 614.97032
2305.0000 -100.24619 -97.04525 3.20095 2.05111 -96.56192 563.51030
2310.0000 -99.95884 -97.11029 2.84854 1.99621 -97.21469 537.24141
2315.0000 -100.30457 -97.74602 2.55855 1.98189 -97.38494 512.76618
2320.0000 -100.38429 -97.30241 3.08187 1.95511 -97.70338 517.92839
2325.0000 -99.35215 -96.36110 2.99104 1.99358 -97.24589 552.32322
2330.0000 -99.55434 -96.45574 3.09860 2.09603 -96.02783 645.75261
2335.0000 -100.11035 -97.75312 2.35723 2.01301 -97.01495 561.80999
2340.0000 -100.29986 -97.41266 2.88720 1.97941 -97.41437 527.91397
2345.0000 -99.84769 -97.07654 2.77114 1.99092 -97.27758 534.93187
2350.0000 -100.49774 -97.91202 2.58572 2.02282 -96.89827 565.87726
2355.0000 -99.90272 -96.85724 3.04548 1.98141 -97.39065 547.76584
2360.0000 -99.84556 -96.70168 3.14388 2.01086 -97.04047 571.93809
2365.0000 -100.50882 -97.27224 3.23658 2.00403 -97.12168 541.15130
2370.0000 -100.66115 -98.05770 2.60345 1.94646 -97.80621 517.54770
2375.0000 -100.48559 -98.29319 2.19240 1.90806 -98.26280 475.95756
2380.0000 -100.45376 -97.51370 2.94006 1.92817 -98.02369 506.36769
2385.0000 -100.34811 -97.67664 2.67147 1.99347 -97.24729 555.75738
2390.0000 -100.83715 -98.14030 2.69686 1.90968 -98.24352 486.18841
2395.0000 -100.13635 -97.41465 2.72169 1.95459 -97.70950 530.23846
2400.0000 -99.83366 -96.95789 2.87577 1.95866 -97.66119 487.87001
2405.0000 -100.11983 -96.93070 3.18913 1.97692 -97.44398 523.43701
2410.0000 -99.78950 -96.78267 3.00683 2.04603 -96.62223 576.38082
2415.0000 -99.66500 -97.05630 2.60871 2.01741 -96.96258 545.72623
2420.0000 -100.03559 -97.46906 2.56653 2.00253 -97.13955 537.83141
2425.0000 -99.05169 -96.01613 3.03557 2.00454 -97.11556 533.81601
2430.0000 -100.10758 -96.74370 3.36387 2.04104 -96.68158 572.71066
2435.0000 -99.84294 -96.83473 3.00820 2.05339 -96.53473 634.57725
2440.0000 -100.00011 -96.96745 3.03266 2.00583 -97.10029 529.37151
2445.0000 -100.57535 -97.50230 3.07305 2.01336 -97.01071 559.45390
2450.0000 -100.12882 -97.07205 3.05678 1.98406 -97.35916 578.40228
2455.0000 -100.27182 -97.41991 2.85191 1.99856 -97.18676 557.94634
2460.0000 -99.53233 -96.65705 2.87528 1.99749 -97.19945 551.44452
2465.0000 -100.15947 -96.87517 3.28431 2.04952 -96.58079 594.44621
2470.0000 -99.87670 -96.84591 3.03079 2.01741 -96.96255 564.02034
2475.0000 -99.20162 -96.15780 3.04383 2.06090 -96.44552 568.83893
2480.0000 -100.44501 -97.05916 3.38585 2.04589 -96.62401 584.79170
2485.0000 -99.59779 -97.15958 2.43821 2.00590 -97.09944 519.64135
2490.0000 -99.42740 -96.43112 2.99627 2.05042 -96.57008 559.25397
2495.0000 -99.58937 -96.75569 2.83368 2.06270 -96.42411 608.28400
2500.0000 -100.36224 -96.33931 4.02293 2.07925 -96.22729 632.76010
MELTING PROCESS: loop number 11 T-loop= 577.00000000000000
main_MD> interactions number 11 at Temperature= 577.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.10531 -2.31679 -1.35499
force_rgl> df(natom) -7.46875 0.29823 0.25262
2505.0000 -99.77580 -96.57919 3.19661 2.07772 -96.24543 627.21753
2510.0000 -99.57698 -96.68052 2.89646 2.02990 -96.81404 564.90910
2515.0000 -99.81478 -96.15014 3.66464 2.07463 -96.28223 583.02762
2520.0000 -100.24232 -97.26059 2.98173 2.02623 -96.85770 575.99175
2525.0000 -99.28393 -96.30677 2.97716 2.02800 -96.83664 571.20934
2530.0000 -99.98447 -97.08037 2.90409 2.03302 -96.77701 569.64721
2535.0000 -100.78196 -98.25035 2.53160 1.98229 -97.38017 531.78210
2540.0000 -99.85376 -97.08607 2.76769 1.96345 -97.60421 523.21403
2545.0000 -100.25456 -97.30734 2.94722 2.04848 -96.59313 588.89101
2550.0000 -100.33406 -97.21337 3.12069 1.99428 -97.23765 519.49815
2555.0000 -99.19212 -96.45526 2.73686 1.99526 -97.22595 558.72253
2560.0000 -99.90696 -97.01900 2.88797 2.03627 -96.73831 567.86282
2565.0000 -99.73740 -96.71188 3.02552 2.06067 -96.44827 601.46087
2570.0000 -100.30154 -97.31469 2.98685 2.03606 -96.74089 563.71934
2575.0000 -100.54382 -97.20101 3.34281 1.97573 -97.45823 519.66456
2580.0000 -99.71922 -96.32041 3.39881 2.00934 -97.05854 554.62394
2585.0000 -99.10890 -96.09302 3.01588 2.08971 -96.10298 633.83052
2590.0000 -99.69087 -96.70869 2.98218 2.08031 -96.21468 608.14470
2595.0000 -99.77991 -97.24206 2.53785 2.04318 -96.65616 565.60646
2600.0000 -99.27249 -96.14639 3.12610 2.04373 -96.64960 569.43033
2605.0000 -99.46513 -96.10133 3.36380 2.08409 -96.16976 582.94809
2610.0000 -99.54813 -96.41442 3.13372 2.07025 -96.33434 605.12993
2615.0000 -99.47129 -96.86718 2.60412 2.06811 -96.35974 582.52651
2620.0000 -99.48858 -96.82194 2.66664 2.02705 -96.84799 553.43650
2625.0000 -99.90293 -96.89026 3.01266 2.04182 -96.67231 562.02582
2630.0000 -100.26220 -96.62731 3.63489 1.98992 -97.28948 552.57029
2635.0000 -99.31859 -96.01028 3.30831 2.05994 -96.45693 599.25453
2640.0000 -99.37429 -96.06534 3.30896 2.08396 -96.17130 617.93898
2645.0000 -100.00412 -96.96438 3.03974 2.04583 -96.62463 587.12437
2650.0000 -100.15851 -97.51004 2.64847 2.00935 -97.05839 532.00224
2655.0000 -99.96609 -96.89001 3.07608 1.99318 -97.25068 545.21268
2660.0000 -100.40660 -97.28499 3.12161 2.03785 -96.71955 575.71948
2665.0000 -99.90765 -96.89303 3.01462 1.99216 -97.26279 535.23280
2670.0000 -100.16753 -96.79057 3.37696 2.01784 -96.95751 582.33185
2675.0000 -99.99017 -96.89873 3.09144 2.01242 -97.02193 556.03434
2680.0000 -100.40311 -97.45504 2.94807 1.99796 -97.19387 554.49799
2685.0000 -100.49306 -97.35685 3.13622 2.00014 -97.16791 543.83879
2690.0000 -99.90003 -97.07472 2.82531 1.98229 -97.38019 554.10763
2695.0000 -101.31046 -98.34308 2.96738 1.97577 -97.45773 556.00169
2700.0000 -100.32195 -97.63878 2.68317 1.92897 -98.01420 495.59751
2705.0000 -100.13350 -97.53531 2.59818 1.96331 -97.60586 510.89074
2710.0000 -99.24972 -96.43102 2.81869 2.02633 -96.85655 584.47247
2715.0000 -99.88966 -96.37653 3.51313 2.07609 -96.26484 644.57071
2720.0000 -100.03105 -96.57125 3.45980 2.06479 -96.39928 618.86286
2725.0000 -99.32842 -96.46084 2.86758 2.04295 -96.65897 582.10692
2730.0000 -100.06305 -97.56031 2.50273 2.05331 -96.53568 578.72140
2735.0000 -99.58511 -96.41063 3.17448 2.05596 -96.50426 597.70965
2740.0000 -99.87921 -97.18587 2.69334 2.03026 -96.80984 564.86962
2745.0000 -100.33531 -96.92901 3.40630 1.99252 -97.25850 566.46204
2750.0000 -99.60426 -96.99286 2.61140 2.03895 -96.70645 582.93626
MELTING PROCESS: loop number 12 T-loop= 602.00000000000000
main_MD> interactions number 12 at Temperature= 602.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.50974 1.55423 -2.09014
force_rgl> df(natom) -0.38114 -1.05542 4.41832
2755.0000 -100.12784 -96.42077 3.70707 2.03802 -96.71753 587.88982
2760.0000 -99.09367 -95.95450 3.13917 2.08540 -96.15421 589.90942
2765.0000 -99.10790 -95.60294 3.50497 2.10209 -95.95576 603.64960
2770.0000 -98.33909 -95.66835 2.67075 2.11989 -95.74402 637.07322
2775.0000 -99.02744 -95.51026 3.51718 2.14149 -95.48731 681.20753
2780.0000 -98.95538 -95.74581 3.20958 2.14843 -95.40476 703.60341
2785.0000 -99.25428 -96.35577 2.89850 2.09066 -96.09165 642.02853
2790.0000 -100.32413 -97.66197 2.66215 2.03948 -96.70018 606.05086
2795.0000 -100.59604 -96.57266 4.02338 2.01620 -96.97697 582.47659
2800.0000 -100.41741 -97.98134 2.43608 2.01651 -96.97328 573.29753
2805.0000 -99.63131 -96.42939 3.20193 1.98624 -97.33324 535.17122
2810.0000 -98.78051 -95.39451 3.38601 2.10661 -95.90196 633.58743
2815.0000 -98.84715 -94.95481 3.89234 2.16605 -95.19527 663.21696
2820.0000 -99.16357 -95.06826 4.09530 2.20473 -94.73534 723.94637
2825.0000 -98.75287 -95.11392 3.63895 2.14507 -95.44471 677.64554
2830.0000 -98.75382 -95.27674 3.47709 2.16398 -95.21987 663.49144
2835.0000 -99.44453 -96.46930 2.97523 2.10761 -95.89013 651.51186
2840.0000 -98.63256 -95.40725 3.22531 2.06164 -96.43673 597.02122
2845.0000 -98.44159 -95.46518 2.97641 2.16658 -95.18888 665.36184
2850.0000 -99.60611 -95.51101 4.09510 2.14879 -95.40041 659.34910
2855.0000 -100.05892 -96.82834 3.23058 2.06206 -96.43173 602.64323
2860.0000 -99.84309 -96.49285 3.35024 2.04833 -96.59494 602.71507
2865.0000 -99.38869 -95.43824 3.95045 2.09499 -96.04009 624.53062
2870.0000 -99.62084 -96.38595 3.23489 2.10987 -95.86322 658.93440
2875.0000 -100.03217 -96.99832 3.03385 2.03821 -96.71530 572.68488
2880.0000 -99.10264 -96.49917 2.60346 2.05504 -96.51518 584.43963
2885.0000 -99.83671 -97.06935 2.76736 2.05339 -96.53477 590.23214
2890.0000 -99.83219 -96.49192 3.34027 2.04794 -96.59963 551.26956
2895.0000 -98.88766 -95.73049 3.15717 2.10102 -95.96842 631.69355
2900.0000 -99.98785 -96.86084 3.12701 2.09598 -96.02835 617.62332
2905.0000 -99.34615 -96.22647 3.11968 2.02848 -96.83098 551.86430
2910.0000 -100.59395 -97.53293 3.06102 2.02399 -96.88434 589.55577
2915.0000 -100.24702 -97.01239 3.23463 1.97889 -97.42061 545.63935
2920.0000 -100.27192 -97.31470 2.95722 1.99636 -97.21292 580.29831
2925.0000 -100.24931 -97.20483 3.04448 1.97711 -97.44172 566.05991
2930.0000 -100.04448 -97.35232 2.69216 1.98595 -97.33668 544.54038
2935.0000 -100.24002 -96.86602 3.37400 2.00536 -97.10586 579.54410
2940.0000 -100.16181 -96.87049 3.29133 2.03849 -96.71189 610.54917
2945.0000 -100.63584 -97.92655 2.70929 1.99212 -97.26335 580.32206
2950.0000 -100.63552 -97.22561 3.40992 2.01920 -96.94134 613.10146
2955.0000 -99.70218 -96.47556 3.22662 1.99586 -97.21879 551.38756
2960.0000 -98.70313 -96.00345 2.69968 2.06569 -96.38851 600.35222
2965.0000 -99.49121 -95.67245 3.81876 2.13457 -95.56954 660.00420
2970.0000 -99.00508 -95.73811 3.26697 2.14406 -95.45672 643.48412
2975.0000 -99.53250 -96.40264 3.12986 2.10025 -95.97763 637.57866
2980.0000 -99.84485 -97.17165 2.67319 2.07398 -96.28995 602.31462
2985.0000 -98.96887 -96.05351 2.91536 2.03645 -96.73618 584.30431
2990.0000 -99.72575 -96.07466 3.65108 2.06720 -96.37056 607.65087
2995.0000 -98.80780 -96.34921 2.45859 2.08676 -96.13796 564.09283
3000.0000 -98.84176 -95.09446 3.74729 2.13376 -95.57913 613.30143
MELTING PROCESS: loop number 13 T-loop= 627.00000000000000
main_MD> interactions number 13 at Temperature= 627.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.44122 -1.39288 -0.08279
force_rgl> df(natom) 0.66596 -0.50299 0.27392
3005.0000 -99.81196 -96.66458 3.14739 2.07986 -96.22002 613.71645
3010.0000 -100.23761 -97.23848 2.99912 2.05511 -96.51431 619.14508
3015.0000 -99.54032 -96.42603 3.11429 2.04010 -96.69276 554.31671
3020.0000 -99.59274 -96.79135 2.80139 2.03448 -96.75968 530.21254
3025.0000 -99.00157 -95.91000 3.09157 2.05630 -96.50022 578.88035
3030.0000 -98.45646 -95.03761 3.41885 2.17421 -95.09824 680.72935
3035.0000 -99.28493 -95.52705 3.75788 2.19789 -94.81667 726.80663
3040.0000 -99.41063 -96.64601 2.76462 2.06362 -96.41318 605.11321
3045.0000 -98.82569 -95.93241 2.89328 2.09688 -96.01772 622.81930
3050.0000 -99.06405 -95.06331 4.00074 2.12856 -95.64101 620.33798
3055.0000 -98.37064 -94.83906 3.53157 2.18353 -94.98740 664.54735
3060.0000 -99.16323 -95.88564 3.27759 2.12420 -95.69278 640.08876
3065.0000 -98.50142 -94.83800 3.66342 2.11757 -95.77169 627.78902
3070.0000 -100.19015 -96.99777 3.19238 2.11201 -95.83778 640.80091
3075.0000 -99.62663 -97.05357 2.57306 2.00573 -97.10148 561.75107
3080.0000 -99.91015 -95.83475 4.07540 2.07182 -96.31564 625.48750
3085.0000 -99.48353 -96.12903 3.35449 2.08825 -96.12025 627.78939
3090.0000 -99.18601 -95.06808 4.11793 2.11808 -95.76565 660.57733
3095.0000 -99.82830 -96.94822 2.88008 2.08528 -96.15558 588.57268
3100.0000 -99.98815 -96.97458 3.01357 2.00628 -97.09497 549.95587
3105.0000 -99.81992 -96.83833 2.98159 2.01996 -96.93227 606.68895
3110.0000 -100.16521 -96.96043 3.20478 2.02768 -96.84047 580.64459
3115.0000 -100.10013 -95.98486 4.11526 2.07170 -96.31710 605.59399
3120.0000 -99.09643 -95.56601 3.53042 2.11659 -95.78328 668.60884
3125.0000 -99.30646 -96.18289 3.12356 2.11176 -95.84071 635.30921
3130.0000 -99.89835 -96.64519 3.25317 2.05364 -96.53178 599.74433
3135.0000 -98.01823 -94.54883 3.46941 2.13184 -95.60203 657.17289
3140.0000 -99.22845 -95.46849 3.75996 2.14781 -95.41206 645.43248
3145.0000 -100.38170 -98.03360 2.34810 1.99351 -97.24674 547.33689
3150.0000 -100.07690 -97.61953 2.45737 1.95813 -97.66749 505.18082
3155.0000 -99.37735 -96.27634 3.10100 2.02646 -96.85500 579.71393
3160.0000 -99.08550 -96.05073 3.03477 2.09187 -96.07730 619.02049
3165.0000 -99.08707 -95.44376 3.64332 2.10473 -95.92428 636.74751
3170.0000 -99.94730 -97.16746 2.77984 2.09988 -95.98194 617.59884
3175.0000 -99.79093 -96.96797 2.82296 2.00087 -97.15919 533.09137
3180.0000 -99.70495 -97.50600 2.19895 1.95215 -97.73857 503.27957
3185.0000 -99.06877 -96.20750 2.86127 2.02563 -96.86483 575.62731
3190.0000 -99.95928 -96.96092 2.99837 2.03834 -96.71376 570.88265
3195.0000 -99.35386 -96.38137 2.97249 2.05799 -96.48003 605.16774
3200.0000 -99.79461 -96.90676 2.88785 2.05996 -96.45660 587.87231
3205.0000 -99.34762 -96.46823 2.87940 2.03587 -96.74310 567.08768
3210.0000 -99.85494 -96.76320 3.09174 2.07440 -96.28494 620.91168
3215.0000 -100.18630 -96.72272 3.46358 2.05091 -96.56427 607.22994
3220.0000 -98.94609 -95.57100 3.37509 2.08829 -96.11984 615.51413
3225.0000 -100.03528 -96.61656 3.41872 2.11449 -95.80832 631.83413
3230.0000 -99.96267 -96.91757 3.04510 2.02202 -96.90781 559.25472
3235.0000 -99.71888 -96.44255 3.27633 2.04164 -96.67452 542.87487
3240.0000 -99.25228 -96.71338 2.53890 2.10156 -95.96201 622.83658
3245.0000 -100.34201 -97.44840 2.89361 2.04110 -96.68092 593.95016
3250.0000 -99.91645 -96.61104 3.30542 2.02436 -96.87993 592.11257
MELTING PROCESS: loop number 14 T-loop= 652.00000000000000
main_MD> interactions number 14 at Temperature= 652.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.20024 2.38007 -0.59381
force_rgl> df(natom) 0.38696 0.14163 -0.71553
3255.0000 -100.15309 -96.76625 3.38684 2.04899 -96.58705 635.83641
3260.0000 -98.96340 -95.86705 3.09636 2.06366 -96.41271 649.42081
3265.0000 -97.79229 -94.80742 2.98487 2.14888 -95.39942 628.77156
3270.0000 -98.71049 -95.05164 3.65886 2.20523 -94.72939 713.34264
3275.0000 -98.62813 -95.41227 3.21586 2.12701 -95.65943 639.09658
3280.0000 -99.02929 -95.91667 3.11262 2.12735 -95.65536 651.55647
3285.0000 -99.23674 -95.26319 3.97355 2.15049 -95.38022 688.38481
3290.0000 -100.63550 -96.87968 3.75582 2.13733 -95.53672 686.51178
3295.0000 -98.72901 -95.96014 2.76887 2.08561 -96.15168 610.25248
3300.0000 -98.23916 -94.42105 3.81811 2.11740 -95.77367 608.19486
3305.0000 -98.23940 -94.40643 3.83296 2.24772 -94.22415 773.95116
3310.0000 -99.23284 -94.40989 4.82295 2.23176 -94.41390 749.98427
3315.0000 -99.79591 -95.19562 4.60028 2.17739 -95.06039 688.93621
3320.0000 -99.44674 -95.52384 3.92290 2.15044 -95.38084 691.93210
3325.0000 -98.09601 -94.06886 4.02715 2.22937 -94.44236 723.01954
3330.0000 -98.14968 -93.73173 4.41795 2.26406 -94.02991 783.17602
3335.0000 -98.19075 -94.97078 3.21997 2.22843 -94.45350 712.66400
3340.0000 -98.69289 -95.58879 3.10410 2.14748 -95.41609 682.67910
3345.0000 -97.97491 -93.85949 4.11542 2.18365 -94.98597 698.00527
3350.0000 -99.59295 -95.85781 3.73513 2.15612 -95.31334 686.54211
3355.0000 -99.16546 -96.62449 2.54098 2.02890 -96.82594 581.26875
3360.0000 -99.41588 -96.01797 3.39791 2.07314 -96.29994 606.38344
3365.0000 -99.56640 -96.37451 3.19189 2.10363 -95.93740 610.09292
3370.0000 -100.12986 -97.19031 2.93955 2.02896 -96.82529 572.12588
3375.0000 -99.17600 -95.97834 3.19767 2.06450 -96.40273 614.27389
3380.0000 -98.70857 -95.70544 3.00314 2.07375 -96.29270 598.58019
3385.0000 -99.36994 -95.99954 3.37040 2.09396 -96.05240 625.41709
3390.0000 -98.31833 -94.58762 3.73070 2.14730 -95.41813 677.54064
3395.0000 -99.05273 -95.91279 3.13994 2.16616 -95.19390 678.49126
3400.0000 -99.08648 -94.88997 4.19651 2.14435 -95.45328 681.68781
3405.0000 -99.05603 -94.71516 4.34088 2.19456 -94.85620 744.13864
3410.0000 -98.56983 -94.68550 3.88433 2.17679 -95.06754 713.78446
3415.0000 -99.21662 -95.45145 3.76517 2.18732 -94.94229 709.49203
3420.0000 -98.97541 -95.13413 3.84128 2.13919 -95.51461 671.43265
3425.0000 -98.17978 -94.69409 3.48569 2.19398 -94.86313 706.13996
3430.0000 -99.24834 -95.64320 3.60514 2.15048 -95.38035 650.80355
3435.0000 -98.60391 -95.01330 3.59061 2.16025 -95.26418 671.11590
3440.0000 -98.95783 -94.76875 4.18908 2.18284 -94.99563 720.70843
3445.0000 -99.50247 -96.16437 3.33811 2.12147 -95.72528 668.35146
3450.0000 -99.79098 -96.35753 3.43345 2.09246 -96.07019 614.18223
3455.0000 -98.77756 -95.00505 3.77251 2.13518 -95.56231 645.24997
3460.0000 -98.56122 -94.45296 4.10827 2.16100 -95.25527 660.23685
3465.0000 -99.19409 -94.57441 4.61968 2.23251 -94.40504 723.22038
3470.0000 -99.11626 -95.16948 3.94678 2.17890 -95.04248 675.28485
3475.0000 -98.63587 -95.46020 3.17568 2.15067 -95.37809 703.96164
3480.0000 -99.35536 -96.10456 3.25080 2.08970 -96.10301 621.36725
3485.0000 -100.16020 -96.75035 3.40985 2.04823 -96.59610 593.69455
3490.0000 -99.95837 -96.93409 3.02428 2.04887 -96.58848 592.06504
3495.0000 -100.73636 -97.28456 3.45180 2.00500 -97.11013 533.57800
3500.0000 -99.55009 -95.88387 3.66622 2.08173 -96.19777 642.03265
MELTING PROCESS: loop number 15 T-loop= 677.00000000000000
main_MD> interactions number 15 at Temperature= 677.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -5.10089 0.20934 3.49825
force_rgl> df(natom) 1.54800 -0.26140 -1.59381
3505.0000 -98.72983 -95.65681 3.07301 2.11785 -95.76833 671.22792
3510.0000 -98.74872 -94.94062 3.80810 2.13420 -95.57393 644.56617
3515.0000 -98.65937 -94.78571 3.87367 2.17874 -95.04434 714.01051
3520.0000 -97.64781 -93.60245 4.04536 2.28946 -93.72786 770.75641
3525.0000 -98.56713 -94.26472 4.30241 2.26109 -94.06514 751.73508
3530.0000 -98.82310 -94.17209 4.65101 2.23582 -94.36561 743.42665
3535.0000 -98.93718 -95.44889 3.48829 2.15705 -95.30220 689.33446
3540.0000 -98.83213 -94.53985 4.29227 2.20218 -94.76560 728.78708
3545.0000 -98.28583 -95.08657 3.19926 2.20632 -94.71644 699.94672
3550.0000 -99.03812 -95.32804 3.71009 2.17446 -95.09517 702.90894
3555.0000 -99.15062 -95.86147 3.28915 2.10510 -95.91989 634.93907
3560.0000 -99.33645 -95.88626 3.45019 2.11690 -95.77962 659.08405
3565.0000 -99.30301 -95.50011 3.80290 2.16670 -95.18755 666.29702
3570.0000 -98.56992 -94.85106 3.71887 2.17588 -95.07839 693.14661
3575.0000 -98.81327 -95.28931 3.52396 2.16309 -95.23042 669.85725
3580.0000 -99.17210 -96.00327 3.16883 2.14838 -95.40528 663.80903
3585.0000 -98.53665 -95.63682 2.89983 2.15058 -95.37915 647.52447
3590.0000 -98.22067 -94.57022 3.65045 2.13242 -95.59514 656.40794
3595.0000 -98.78063 -95.62158 3.15905 2.16823 -95.16927 697.32000
3600.0000 -98.60405 -95.18559 3.41846 2.16112 -95.25385 676.89177
3605.0000 -98.52061 -95.11858 3.40203 2.17085 -95.13816 670.21619
3610.0000 -99.46639 -95.60454 3.86185 2.16273 -95.23473 666.57986
3615.0000 -98.40165 -94.72144 3.68021 2.17424 -95.09788 690.87465
3620.0000 -99.30867 -95.72985 3.57882 2.22472 -94.49764 737.34733
3625.0000 -98.72392 -95.49072 3.23319 2.13381 -95.57859 680.92893
3630.0000 -98.84252 -95.95568 2.88684 2.15208 -95.36128 680.33034
3635.0000 -99.40746 -96.39013 3.01733 2.10674 -95.90046 623.76286
3640.0000 -99.15471 -96.80148 2.35323 2.09235 -96.07153 627.83460
3645.0000 -99.00419 -96.13721 2.86698 2.07472 -96.28111 635.11656
3650.0000 -98.61527 -95.67961 2.93566 2.13375 -95.57934 655.57787
3655.0000 -99.48525 -95.25024 4.23500 2.12865 -95.63996 638.50674
3660.0000 -98.92737 -95.20449 3.72288 2.15758 -95.29595 704.15752
3665.0000 -98.43135 -94.25720 4.17415 2.18137 -95.01305 693.08799
3670.0000 -98.73164 -95.04083 3.69081 2.26102 -94.06599 758.00046
3675.0000 -99.43435 -95.44832 3.98603 2.15207 -95.36148 651.58526
3680.0000 -99.46074 -96.27039 3.19035 2.13184 -95.60199 656.38708
3685.0000 -99.33611 -95.42631 3.90980 2.13144 -95.60680 660.17627
3690.0000 -98.40505 -95.16388 3.24116 2.16086 -95.25694 625.89495
3695.0000 -98.20781 -94.45557 3.75224 2.20372 -94.74734 735.14435
3700.0000 -97.81952 -94.07454 3.74498 2.18665 -94.95025 705.35709
3705.0000 -98.24096 -95.05172 3.18924 2.20142 -94.77463 711.99581
3710.0000 -97.86804 -94.24216 3.62588 2.19705 -94.82660 705.53403
3715.0000 -98.43804 -95.27967 3.15838 2.22461 -94.49899 740.59866
3720.0000 -98.62134 -95.12248 3.49886 2.13955 -95.51034 678.58509
3725.0000 -98.97714 -96.03732 2.93981 2.17279 -95.11512 687.97614
3730.0000 -99.68713 -94.80651 4.88062 2.17583 -95.07891 700.52697
3735.0000 -99.28599 -95.67456 3.61143 2.16082 -95.25745 662.84362
3740.0000 -99.76362 -96.18535 3.57827 2.09772 -96.00768 607.68685
3745.0000 -98.35312 -95.21934 3.13378 2.09491 -96.04105 645.64836
3750.0000 -99.01774 -94.91068 4.10705 2.16144 -95.25008 678.99595
MELTING PROCESS: loop number 16 T-loop= 702.00000000000000
main_MD> interactions number 16 at Temperature= 702.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.43177 0.77897 -0.62053
force_rgl> df(natom) -1.09559 0.86991 -2.96031
3755.0000 -98.65051 -94.44267 4.20784 2.22699 -94.47060 694.63898
3760.0000 -97.28410 -93.04878 4.23532 2.27766 -93.86822 771.17707
3765.0000 -96.62681 -92.93942 3.68739 2.32234 -93.33696 807.44445
3770.0000 -98.31000 -94.02121 4.28879 2.33535 -93.18223 787.01959
3775.0000 -97.88414 -94.27419 3.60995 2.22298 -94.51829 738.68407
3780.0000 -98.87165 -94.83446 4.03719 2.17073 -95.13955 674.86561
3785.0000 -97.45196 -93.42962 4.02234 2.27323 -93.92087 780.27131
3790.0000 -98.60000 -95.20349 3.39651 2.21725 -94.58647 696.56991
3795.0000 -98.01765 -94.25843 3.75921 2.23552 -94.36918 715.65429
3800.0000 -98.43596 -93.82193 4.61404 2.19451 -94.85688 696.54866
3805.0000 -98.50420 -94.05025 4.45395 2.26662 -93.99944 762.32267
3810.0000 -98.06389 -93.20259 4.86130 2.27771 -93.86759 740.39526
3815.0000 -99.11922 -95.44959 3.66963 2.22702 -94.47027 761.50559
3820.0000 -98.65461 -95.50720 3.14741 2.12419 -95.69293 641.34046
3825.0000 -98.95968 -96.17339 2.78629 2.14148 -95.48739 685.30511
3830.0000 -98.46635 -95.55618 2.91017 2.09696 -96.01671 636.29028
3835.0000 -98.94285 -95.34423 3.59862 2.12979 -95.62640 659.06891
3840.0000 -98.20524 -93.91062 4.29462 2.19197 -94.88706 711.32252
3845.0000 -96.93296 -92.65160 4.28135 2.33855 -93.14421 813.33181
3850.0000 -98.17774 -93.63756 4.54019 2.34948 -93.01426 840.24642
3855.0000 -98.54741 -93.74041 4.80700 2.29795 -93.62686 799.72499
3860.0000 -98.68160 -94.22526 4.45634 2.25472 -94.14094 759.19714
3865.0000 -98.17204 -94.65659 3.51544 2.25338 -94.15682 768.78511
3870.0000 -98.07732 -93.40014 4.67718 2.25866 -94.09405 779.03785
3875.0000 -97.61164 -93.50734 4.10430 2.30045 -93.59714 805.35788
3880.0000 -99.40272 -95.18989 4.21283 2.21810 -94.57631 723.14053
3885.0000 -99.01820 -95.44430 3.57390 2.16173 -95.24662 690.91159
3890.0000 -99.79841 -95.98264 3.81578 2.13656 -95.54586 641.58833
3895.0000 -98.49059 -95.50569 2.98491 2.13788 -95.53016 634.98262
3900.0000 -99.42387 -95.44950 3.97437 2.13216 -95.59818 633.36694
3905.0000 -99.46824 -94.93150 4.53673 2.12178 -95.72157 663.11241
3910.0000 -98.89410 -95.59256 3.30154 2.13357 -95.58137 681.78541
3915.0000 -98.98356 -95.18997 3.79359 2.13008 -95.62289 679.70783
3920.0000 -99.02509 -95.50803 3.51706 2.13293 -95.58899 654.79074
3925.0000 -99.36958 -95.24675 4.12283 2.13399 -95.57641 649.08882
3930.0000 -99.17246 -95.30972 3.86274 2.12965 -95.62804 642.23648
3935.0000 -98.72399 -94.68525 4.03874 2.17563 -95.08128 707.96542
3940.0000 -98.17720 -94.45997 3.71723 2.20831 -94.69272 740.71900
3945.0000 -99.29911 -94.95426 4.34485 2.23239 -94.40641 745.88237
3950.0000 -99.06558 -96.70550 2.36008 2.12355 -95.70055 653.94873
3955.0000 -98.25411 -95.30141 2.95269 2.11105 -95.84919 633.45404
3960.0000 -98.12467 -94.67779 3.44688 2.17274 -95.11565 677.52388
3965.0000 -99.58807 -95.22034 4.36773 2.22114 -94.54023 756.41329
3970.0000 -98.27987 -95.03257 3.24730 2.21832 -94.57371 773.91625
3975.0000 -98.78786 -94.73931 4.04855 2.17477 -95.09153 707.49788
3980.0000 -98.74671 -95.30207 3.44464 2.15100 -95.37415 674.38802
3985.0000 -97.99216 -94.58820 3.40396 2.19769 -94.81904 698.00191
3990.0000 -99.95021 -96.54090 3.40931 2.10007 -95.97969 634.78024
3995.0000 -99.72317 -95.92082 3.80235 2.07651 -96.25992 649.16460
4000.0000 -99.90590 -96.60524 3.30067 2.12072 -95.73425 694.93248
MELTING PROCESS: loop number 17 T-loop= 727.00000000000000
main_MD> interactions number 17 at Temperature= 727.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.22650 0.47917 0.10021
force_rgl> df(natom) -2.64547 -0.42893 -0.98746
4005.0000 -100.13117 -96.68698 3.44419 2.02455 -96.87773 580.67764
4010.0000 -98.46052 -94.46412 3.99640 2.18867 -94.92631 738.70929
4015.0000 -98.39566 -93.42713 4.96853 2.23618 -94.36135 711.43863
4020.0000 -98.26985 -94.54929 3.72055 2.30815 -93.50567 771.30987
4025.0000 -98.46659 -94.48684 3.97975 2.21325 -94.63398 708.87971
4030.0000 -98.41726 -94.43863 3.97864 2.24636 -94.24030 763.08555
4035.0000 -99.61608 -96.10833 3.50775 2.21766 -94.58155 723.40016
4040.0000 -98.59452 -96.17214 2.42238 2.08538 -96.15439 593.54938
4045.0000 -98.58232 -95.48178 3.10054 2.12873 -95.63895 644.55556
4050.0000 -99.05148 -95.66489 3.38659 2.12102 -95.73065 653.77546
4055.0000 -99.36815 -95.36271 4.00544 2.12718 -95.65742 651.41157
4060.0000 -98.77954 -95.51422 3.26532 2.12482 -95.68543 651.87681
4065.0000 -98.47722 -95.34926 3.12796 2.12008 -95.74185 613.04265
4070.0000 -99.14218 -94.45440 4.68777 2.19970 -94.79513 697.21030
4075.0000 -98.35696 -94.42281 3.93415 2.23248 -94.40540 711.46035
4080.0000 -97.72408 -94.89680 2.82728 2.20302 -94.75568 706.63791
4085.0000 -97.53854 -93.83193 3.70661 2.23732 -94.34784 717.25441
4090.0000 -98.68732 -94.77948 3.90784 2.24236 -94.28785 747.45485
4095.0000 -97.43011 -93.27233 4.15778 2.25250 -94.16730 767.42274
4100.0000 -98.14543 -94.66791 3.47752 2.29694 -93.63895 781.99450
4105.0000 -96.94018 -93.63843 3.30176 2.23463 -94.37980 719.53989
4110.0000 -98.05010 -94.18193 3.86817 2.28161 -93.82118 780.75206
4115.0000 -99.16606 -94.94088 4.22518 2.22109 -94.54077 741.21915
4120.0000 -98.65507 -94.39451 4.26056 2.19429 -94.85940 716.86810
4125.0000 -98.74613 -94.22913 4.51700 2.24715 -94.23089 779.82415
4130.0000 -98.86471 -95.53148 3.33323 2.20088 -94.78109 739.80818
4135.0000 -99.61121 -96.69141 2.91980 2.09846 -95.99883 590.83264
4140.0000 -98.59869 -95.60621 2.99248 2.08655 -96.14049 579.40337
4145.0000 -98.16350 -94.52626 3.63724 2.18796 -94.93471 681.78721
4150.0000 -98.79791 -95.51448 3.28343 2.16905 -95.15958 702.09587
4155.0000 -99.16798 -95.53552 3.63246 2.15106 -95.37348 665.00133
4160.0000 -96.48160 -92.74597 3.73563 2.23155 -94.41642 739.40072
4165.0000 -97.34217 -92.96957 4.37260 2.36646 -92.81234 888.77488
4170.0000 -96.89523 -92.40542 4.48981 2.39627 -92.45792 863.17341
4175.0000 -97.84961 -93.80665 4.04295 2.33747 -93.15695 840.00168
4180.0000 -97.97818 -93.74982 4.22836 2.29728 -93.63485 718.33183
4185.0000 -98.42512 -93.82560 4.59952 2.26860 -93.97591 746.43026
4190.0000 -98.56751 -94.26568 4.30184 2.25842 -94.09695 730.18052
4195.0000 -98.30737 -93.74850 4.55888 2.28435 -93.78860 773.98834
4200.0000 -97.82767 -94.66940 3.15826 2.20926 -94.68150 734.85100
4205.0000 -98.02616 -94.24226 3.78390 2.20826 -94.69330 718.72184
4210.0000 -97.87336 -94.71304 3.16032 2.20607 -94.71943 691.41677
4215.0000 -99.10513 -94.58336 4.52177 2.20098 -94.77985 660.35085
4220.0000 -97.94409 -94.34055 3.60354 2.22520 -94.49193 759.84840
4225.0000 -96.97765 -93.61465 3.36300 2.24018 -94.31386 750.32408
4230.0000 -98.48352 -94.50974 3.97378 2.23003 -94.43451 752.13546
4235.0000 -97.75554 -94.21042 3.54512 2.24554 -94.25002 721.96745
4240.0000 -98.80722 -95.19515 3.61208 2.19765 -94.81948 717.77849
4245.0000 -98.90589 -95.03562 3.87027 2.20278 -94.75849 758.67003
4250.0000 -98.80331 -95.00225 3.80106 2.18934 -94.91831 722.54208
MELTING PROCESS: loop number 18 T-loop= 752.00000000000000
main_MD> interactions number 18 at Temperature= 752.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.80505 -0.90397 1.14953
force_rgl> df(natom) -4.08219 0.48453 1.10767
4255.0000 -98.83504 -94.71516 4.11988 2.17253 -95.11822 723.20451
4260.0000 -98.20428 -95.09619 3.10808 2.16966 -95.15233 692.97463
4265.0000 -98.25135 -93.64573 4.60563 2.24316 -94.27842 732.79847
4270.0000 -97.03456 -93.39819 3.63637 2.26169 -94.05799 774.69452
4275.0000 -98.55289 -93.39690 5.15599 2.31345 -93.44257 827.26042
4280.0000 -98.47159 -93.52353 4.94806 2.32308 -93.32816 841.39431
4285.0000 -98.13866 -94.33569 3.80297 2.27509 -93.89872 775.42540
4290.0000 -98.63309 -94.61134 4.02175 2.19755 -94.82063 718.51186
4295.0000 -97.99329 -93.92701 4.06628 2.18816 -94.93229 702.20606
4300.0000 -97.36933 -93.56146 3.80787 2.29785 -93.62811 757.53456
4305.0000 -98.29451 -94.80479 3.48971 2.23058 -94.42800 700.93171
4310.0000 -98.88998 -94.62218 4.26780 2.17325 -95.10966 709.75023
4315.0000 -98.16532 -92.97780 5.18752 2.25119 -94.18285 749.81499
4320.0000 -98.24032 -94.22036 4.01996 2.30408 -93.55407 800.95280
4325.0000 -98.31791 -94.18057 4.13734 2.23253 -94.40480 746.84524
4330.0000 -97.12136 -93.50537 3.61599 2.22751 -94.46441 733.30946
4335.0000 -98.08479 -93.41451 4.67028 2.25967 -94.08207 746.08722
4340.0000 -98.96909 -94.64059 4.32850 2.24081 -94.30634 737.75006
4345.0000 -98.21345 -94.58529 3.62816 2.17859 -95.04612 684.72828
4350.0000 -99.43561 -95.81635 3.61926 2.17794 -95.05387 708.80394
4355.0000 -98.21909 -94.28181 3.93728 2.21673 -94.59267 736.14322
4360.0000 -97.53292 -94.38022 3.15269 2.26366 -94.03458 756.29111
4365.0000 -98.51160 -94.88120 3.63040 2.19219 -94.88436 696.77072
4370.0000 -98.59236 -94.15263 4.43972 2.23232 -94.40725 765.75406
4375.0000 -97.90934 -93.65750 4.25184 2.22753 -94.46424 759.48731
4380.0000 -98.30638 -94.21242 4.09396 2.25401 -94.14942 750.69215
4385.0000 -97.56171 -93.51779 4.04392 2.28890 -93.73454 751.79759
4390.0000 -98.49296 -95.18635 3.30661 2.26317 -94.04045 747.58850
4395.0000 -98.68801 -94.54244 4.14557 2.20153 -94.77337 724.52838
4400.0000 -97.79719 -93.49602 4.30116 2.27055 -93.95265 772.84612
4405.0000 -98.08260 -94.40902 3.67358 2.26158 -94.05936 746.63898
4410.0000 -98.50613 -95.05605 3.45008 2.27957 -93.84542 766.35757
4415.0000 -97.93915 -94.01027 3.92888 2.23054 -94.42841 755.58211
4420.0000 -97.98322 -94.53656 3.44666 2.23547 -94.36987 748.42582
4425.0000 -99.03822 -94.44426 4.59396 2.20863 -94.68896 734.33677
4430.0000 -98.13551 -94.16249 3.97303 2.22815 -94.45684 729.16072
4435.0000 -98.33787 -94.61411 3.72376 2.23814 -94.33802 763.20321
4440.0000 -99.34912 -94.83730 4.51181 2.21662 -94.59396 697.44711
4445.0000 -99.03817 -95.39558 3.64259 2.19336 -94.87050 693.00433
4450.0000 -98.52570 -94.88275 3.64295 2.17530 -95.08519 672.57688
4455.0000 -98.51101 -95.38504 3.12596 2.16981 -95.15055 683.13643
4460.0000 -98.60646 -94.77668 3.82978 2.15767 -95.29487 656.00277
4465.0000 -97.63136 -94.68292 2.94844 2.20642 -94.71521 698.30849
4470.0000 -97.45100 -92.77334 4.67766 2.27606 -93.88713 776.95524
4475.0000 -98.11341 -93.97809 4.13531 2.32395 -93.31777 831.64482
4480.0000 -99.23674 -95.42518 3.81156 2.18283 -94.99573 712.06515
4485.0000 -99.15715 -94.68202 4.47512 2.16873 -95.16330 685.71605
4490.0000 -97.89279 -93.46243 4.43037 2.27597 -93.88821 798.91183
4495.0000 -98.25034 -94.83264 3.41770 2.29462 -93.66648 814.40652
4500.0000 -98.91577 -94.39563 4.52013 2.22432 -94.50242 762.49867
MELTING PROCESS: loop number 19 T-loop= 777.00000000000000
main_MD> interactions number 19 at Temperature= 777.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -6.18005 0.34304 0.58644
force_rgl> df(natom) 2.92062 2.76063 -0.51652
4505.0000 -98.49920 -94.55422 3.94498 2.22548 -94.48861 748.45892
4510.0000 -97.78143 -92.87884 4.90259 2.28685 -93.75888 777.70868
4515.0000 -96.09132 -92.73707 3.35425 2.33305 -93.20960 805.71785
4520.0000 -97.80934 -93.72751 4.08184 2.36441 -92.83668 832.01126
4525.0000 -98.97048 -94.78361 4.18687 2.29376 -93.67669 783.06508
4530.0000 -99.65450 -96.17190 3.48260 2.11093 -95.85061 671.10861
4535.0000 -98.36794 -94.71420 3.65374 2.21384 -94.62703 767.15618
4540.0000 -97.44701 -93.90213 3.54487 2.26679 -93.99745 737.75334
4545.0000 -97.74043 -94.03649 3.70395 2.26498 -94.01896 706.09204
4550.0000 -98.16868 -94.15700 4.01168 2.26288 -94.04388 721.63333
4555.0000 -98.31715 -94.32270 3.99445 2.28178 -93.81918 760.25162
4560.0000 -97.62890 -94.17023 3.45867 2.23475 -94.37832 712.64236
4565.0000 -98.74732 -94.68235 4.06498 2.20647 -94.71464 652.11635
4570.0000 -99.04390 -95.25293 3.79097 2.20239 -94.76318 704.01641
4575.0000 -97.66277 -94.26348 3.39930 2.24261 -94.28491 785.71077
4580.0000 -97.37715 -93.13141 4.24573 2.29173 -93.70083 786.16674
4585.0000 -97.11251 -92.77445 4.33806 2.38273 -92.61890 818.25717
4590.0000 -97.64815 -93.18485 4.46329 2.39796 -92.43778 884.32047
4595.0000 -97.47070 -94.01274 3.45796 2.33273 -93.21341 802.57775
4600.0000 -97.52937 -93.76842 3.76095 2.29165 -93.70178 749.22819
4605.0000 -98.20841 -93.62028 4.58812 2.29571 -93.65355 769.12015
4610.0000 -97.33467 -92.97591 4.35875 2.28814 -93.74353 807.65755
4615.0000 -98.58588 -94.35676 4.22912 2.33595 -93.17509 777.51805
4620.0000 -97.62322 -94.53146 3.09176 2.25521 -94.13508 705.10641
4625.0000 -97.56513 -93.15923 4.40590 2.25420 -94.14708 709.69404
4630.0000 -97.29285 -93.47284 3.82001 2.29132 -93.70570 757.34764
4635.0000 -96.97385 -92.54423 4.42962 2.35988 -92.89053 812.71471
4640.0000 -97.51489 -94.23788 3.27701 2.32686 -93.28313 786.83215
4645.0000 -97.06975 -92.15678 4.91297 2.30270 -93.57047 753.82754
4650.0000 -97.33102 -93.79587 3.53516 2.37317 -92.73248 843.47600
4655.0000 -97.36027 -94.11966 3.24060 2.24851 -94.21479 765.64984
4660.0000 -98.37387 -94.02806 4.34581 2.29849 -93.62049 784.31869
4665.0000 -97.49076 -93.54373 3.94702 2.25974 -94.08118 738.50325
4670.0000 -96.46493 -92.35375 4.11118 2.35723 -92.92212 793.57485
4675.0000 -95.78741 -91.91058 3.87683 2.42955 -92.06213 870.50856
4680.0000 -97.16003 -92.78986 4.37017 2.37720 -92.68458 828.67519
4685.0000 -97.86513 -93.31646 4.54867 2.31890 -93.37775 820.26387
4690.0000 -97.62724 -94.22741 3.39983 2.26854 -93.97661 764.42209
4695.0000 -97.47368 -93.54476 3.92892 2.31052 -93.47750 788.52444
4700.0000 -97.84462 -92.92384 4.92078 2.31197 -93.46026 743.88248
4705.0000 -97.57827 -93.84509 3.73319 2.34237 -93.09870 782.39612
4710.0000 -98.74632 -93.63139 5.11493 2.28884 -93.73528 769.23609
4715.0000 -98.36679 -94.63103 3.73576 2.24822 -94.21817 758.86335
4720.0000 -98.30926 -94.38968 3.91957 2.21326 -94.63388 740.39521
4725.0000 -99.05450 -95.04859 4.00590 2.23670 -94.35514 755.61281
4730.0000 -99.32170 -95.40169 3.92001 2.12936 -95.63149 670.09284
4735.0000 -98.32789 -94.10093 4.22697 2.22913 -94.44516 741.59793
4740.0000 -97.28989 -92.96348 4.32641 2.30425 -93.55194 771.61734
4745.0000 -98.02749 -93.70137 4.32612 2.23158 -94.41610 694.98298
4750.0000 -98.01326 -94.25079 3.76247 2.30519 -93.54079 804.78621
MELTING PROCESS: loop number 20 T-loop= 802.00000000000000
main_MD> interactions number 20 at Temperature= 802.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.08674 -0.76607 1.93780
force_rgl> df(natom) 0.14925 1.87077 2.89136
4755.0000 -98.62572 -93.04470 5.58103 2.26334 -94.03839 768.95765
4760.0000 -98.07604 -94.02757 4.04847 2.29773 -93.62959 796.11192
4765.0000 -97.30940 -92.16383 5.14557 2.42006 -92.17494 906.01665
4770.0000 -98.23479 -93.82506 4.40973 2.37114 -92.75672 843.63977
4775.0000 -97.72892 -93.91339 3.81553 2.27332 -93.91977 767.01653
4780.0000 -96.52057 -92.88460 3.63597 2.35737 -92.92037 835.91495
4785.0000 -97.61294 -93.64161 3.97134 2.34773 -93.03505 861.88934
4790.0000 -98.43033 -93.84059 4.58974 2.30687 -93.52085 813.19547
4795.0000 -96.84359 -93.44016 3.40343 2.24140 -94.29927 753.02486
4800.0000 -97.60540 -94.00178 3.60361 2.28539 -93.77631 727.05515
4805.0000 -98.41784 -94.89552 3.52232 2.22274 -94.52112 730.17086
4810.0000 -98.78217 -93.97207 4.81010 2.26561 -94.01149 814.03005
4815.0000 -97.92593 -94.66533 3.26060 2.28925 -93.73034 780.28711
4820.0000 -97.76743 -93.13559 4.63184 2.28268 -93.80843 766.74743
4825.0000 -96.84356 -91.27761 5.56595 2.35241 -92.97940 827.17082
4830.0000 -97.58600 -93.35243 4.23358 2.40007 -92.41268 845.81258
4835.0000 -97.44127 -93.77463 3.66665 2.31163 -93.46425 808.90904
4840.0000 -97.91716 -93.75861 4.15855 2.29908 -93.61352 776.80210
4845.0000 -97.10501 -92.49947 4.60554 2.38282 -92.61780 841.76775
4850.0000 -98.40486 -94.31463 4.09023 2.29761 -93.63091 779.76923
4855.0000 -98.87988 -94.57811 4.30177 2.23889 -94.32916 764.20021
4860.0000 -98.37429 -93.15055 5.22374 2.30935 -93.49132 787.18294
4865.0000 -97.82863 -93.38200 4.44663 2.32737 -93.27713 800.96469
4870.0000 -98.70107 -94.52245 4.17862 2.26099 -94.06638 784.92255
4875.0000 -98.07196 -93.15048 4.92149 2.29493 -93.66284 763.92651
4880.0000 -97.74828 -93.34292 4.40535 2.28738 -93.75255 749.12026
4885.0000 -97.43893 -93.02046 4.41848 2.30020 -93.60015 794.44342
4890.0000 -97.32127 -92.83961 4.48166 2.41288 -92.26031 897.83842
4895.0000 -95.68435 -91.43787 4.24648 2.38060 -92.64419 870.98543
4900.0000 -96.16480 -91.21508 4.94973 2.51596 -91.03471 967.60570
4905.0000 -96.56687 -91.84268 4.72419 2.40401 -92.36585 826.54206
4910.0000 -96.56119 -92.82792 3.73327 2.40816 -92.31645 860.18547
4915.0000 -97.76794 -92.74422 5.02372 2.37670 -92.69060 794.12600
4920.0000 -97.60513 -92.76270 4.84242 2.38256 -92.62092 884.05707
4925.0000 -95.68170 -91.26610 4.41559 2.47364 -91.53788 964.80386
4930.0000 -96.01043 -91.67054 4.33989 2.43957 -91.94297 915.79770
4935.0000 -96.66665 -92.79271 3.87394 2.44947 -91.82527 876.12645
4940.0000 -98.23331 -93.31027 4.92303 2.36622 -92.81516 854.22158
4945.0000 -98.55597 -94.24160 4.31437 2.30069 -93.59438 815.99534
4950.0000 -97.95026 -93.15038 4.79988 2.34108 -93.11413 809.76003
4955.0000 -98.40787 -94.33194 4.07593 2.30256 -93.57212 777.65202
4960.0000 -97.54842 -91.72105 5.82736 2.40139 -92.39694 880.65816
4965.0000 -96.05367 -91.55484 4.49883 2.47188 -91.55883 899.59352
4970.0000 -96.14282 -90.85844 5.28438 2.43747 -91.96804 898.48887
4975.0000 -97.24497 -93.40902 3.83595 2.41871 -92.19102 848.51492
4980.0000 -98.42972 -93.91433 4.51539 2.32198 -93.34114 820.58128
4985.0000 -97.13174 -93.66049 3.47126 2.29548 -93.65630 819.40479
4990.0000 -98.58443 -93.59603 4.98840 2.29415 -93.67213 791.11794
4995.0000 -97.32262 -93.68834 3.63428 2.21960 -94.55851 709.66916
5000.0000 -97.46092 -93.54520 3.91572 2.29461 -93.66668 740.25058
MELTING PROCESS: loop number 21 T-loop= 827.00000000000000
main_MD> interactions number 21 at Temperature= 827.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.32990 0.42236 -2.32372
force_rgl> df(natom) -0.45949 0.06282 2.06253
5005.0000 -97.49791 -92.74850 4.74942 2.33713 -93.16107 812.68371
5010.0000 -97.02214 -92.97787 4.04426 2.30184 -93.58061 796.48408
5015.0000 -96.71532 -91.88806 4.82726 2.39851 -92.43125 881.05852
5020.0000 -97.29947 -92.01797 5.28150 2.46588 -91.63014 945.05189
5025.0000 -97.41741 -93.66337 3.75404 2.38073 -92.64261 864.51643
5030.0000 -97.25593 -93.03106 4.22487 2.34917 -93.01791 772.13135
5035.0000 -97.00036 -92.11809 4.88226 2.38935 -92.54018 890.72103
5040.0000 -97.60655 -93.33192 4.27463 2.37365 -92.72678 871.54121
5045.0000 -98.21736 -94.59354 3.62382 2.26029 -94.07470 741.91148
5050.0000 -97.81627 -93.50319 4.31308 2.27338 -93.91902 754.96764
5055.0000 -98.21872 -93.84768 4.37105 2.31863 -93.38097 802.58904
5060.0000 -98.28380 -93.71024 4.57356 2.28796 -93.74568 811.87353
5065.0000 -98.34199 -95.02786 3.31413 2.27257 -93.92863 790.57970
5070.0000 -98.38919 -93.42387 4.96532 2.24196 -94.29264 734.39297
5075.0000 -97.59393 -93.65082 3.94311 2.33223 -93.21930 837.31248
5080.0000 -97.63555 -93.46664 4.16891 2.26820 -93.98069 749.15327
5085.0000 -98.22988 -94.14779 4.08209 2.27099 -93.94751 749.56421
5090.0000 -97.74521 -93.99015 3.75506 2.31937 -93.37224 798.57999
5095.0000 -97.41356 -93.46557 3.94799 2.31205 -93.45923 767.28470
5100.0000 -98.42037 -93.55354 4.86683 2.32585 -93.29513 819.36595
5105.0000 -96.57031 -93.02077 3.54954 2.35313 -92.97082 836.23761
5110.0000 -97.25256 -92.25233 5.00023 2.36209 -92.86424 846.63069
5115.0000 -97.56872 -92.30501 5.26371 2.42250 -92.14601 877.90185
5120.0000 -97.19205 -92.58762 4.60443 2.39394 -92.48554 844.74371
5125.0000 -97.66602 -94.11996 3.54606 2.26759 -93.98795 764.61264
5130.0000 -98.27101 -93.89988 4.37113 2.26492 -94.01968 782.91439
5135.0000 -98.34486 -94.44889 3.89596 2.24410 -94.26723 763.18320
5140.0000 -96.93984 -91.96422 4.97562 2.32855 -93.26305 836.19495
5145.0000 -98.15614 -93.65283 4.50331 2.37896 -92.66371 847.88477
5150.0000 -97.30427 -92.80300 4.50127 2.30876 -93.49842 798.16627
5155.0000 -97.02470 -92.36852 4.65618 2.40754 -92.32389 869.94489
5160.0000 -96.89441 -91.53431 5.36010 2.47607 -91.50899 895.79671
5165.0000 -96.23379 -91.96962 4.26417 2.44898 -91.83111 872.47435
5170.0000 -97.93040 -93.95012 3.98027 2.38909 -92.54325 876.72199
5175.0000 -97.82490 -93.40730 4.41760 2.27073 -93.95052 794.79653
5180.0000 -98.58263 -93.64666 4.93597 2.27990 -93.84151 799.98322
5185.0000 -97.19191 -92.64804 4.54387 2.38604 -92.57953 856.16390
5190.0000 -96.51647 -91.97378 4.54269 2.42522 -92.11370 876.59974
5195.0000 -97.15372 -92.69339 4.46033 2.36697 -92.80628 869.98608
5200.0000 -97.29786 -92.80508 4.49278 2.39575 -92.46405 876.71147
5205.0000 -98.03146 -93.89683 4.13462 2.32641 -93.28853 823.53537
5210.0000 -97.02136 -91.15034 5.87102 2.38490 -92.59305 875.54609
5215.0000 -97.51900 -91.18678 6.33222 2.44065 -91.93014 907.10516
5220.0000 -96.28085 -91.97369 4.30716 2.44144 -91.92075 916.43779
5225.0000 -97.02412 -93.04051 3.98361 2.37756 -92.68032 841.70238
5230.0000 -97.07396 -92.91438 4.15958 2.33660 -93.16740 798.61263
5235.0000 -96.94605 -92.63305 4.31300 2.36662 -92.81036 847.21535
5240.0000 -97.00992 -92.22953 4.78038 2.40940 -92.30170 860.33012
5245.0000 -98.37408 -93.51769 4.85638 2.38071 -92.64284 844.21961
5250.0000 -98.05565 -93.93790 4.11775 2.31342 -93.44300 838.09247
MELTING PROCESS: loop number 22 T-loop= 852.00000000000000
main_MD> interactions number 22 at Temperature= 852.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.24460 0.30839 -0.25244
force_rgl> df(natom) 1.83099 1.51163 0.95524
5255.0000 -97.63905 -92.01035 5.62870 2.42978 -92.05948 901.03176
5260.0000 -98.34982 -93.65773 4.69209 2.40548 -92.34837 874.47772
5265.0000 -96.94501 -92.99768 3.94733 2.34606 -93.05493 819.81730
5270.0000 -97.48555 -92.58498 4.90056 2.35430 -92.95686 821.49897
5275.0000 -97.36655 -91.67664 5.68991 2.33528 -93.18310 782.08104
5280.0000 -95.59366 -91.56315 4.03051 2.44637 -91.86219 879.56726
5285.0000 -97.36816 -92.15670 5.21146 2.49931 -91.23271 957.20648
5290.0000 -97.62407 -92.85533 4.76875 2.42850 -92.07461 918.59267
5295.0000 -96.70073 -92.85429 3.84644 2.35391 -92.96154 867.07482
5300.0000 -96.76878 -93.34328 3.42550 2.39122 -92.51795 837.97060
5305.0000 -97.22381 -93.32320 3.90061 2.35518 -92.94649 827.51025
5310.0000 -96.90639 -92.29603 4.61036 2.34338 -93.08674 799.45793
5315.0000 -97.56900 -93.81042 3.75858 2.34823 -93.02910 807.04552
5320.0000 -97.69919 -92.83551 4.86368 2.31386 -93.43772 821.49184
5325.0000 -97.53984 -91.82238 5.71746 2.40047 -92.40792 876.58241
5330.0000 -96.28827 -92.36813 3.92014 2.43346 -92.01562 876.70965
5335.0000 -96.87563 -91.94033 4.93530 2.44542 -91.87340 882.19490
5340.0000 -97.21847 -90.93470 6.28378 2.45062 -91.81165 939.80933
5345.0000 -97.07559 -92.20096 4.87464 2.49914 -91.23472 976.66300
5350.0000 -97.25847 -92.81968 4.43879 2.36476 -92.83257 877.06014
5355.0000 -96.78154 -91.42499 5.35655 2.45471 -91.76300 895.21409
5360.0000 -96.52707 -91.66811 4.85896 2.44340 -91.89748 896.80747
5365.0000 -96.82805 -91.71014 5.11790 2.47553 -91.51540 917.89799
5370.0000 -96.93837 -92.53809 4.40028 2.44387 -91.89193 908.97071
5375.0000 -96.48800 -92.25302 4.23499 2.38777 -92.55896 875.94657
5380.0000 -97.37376 -92.88763 4.48613 2.36511 -92.82842 820.20878
5385.0000 -98.45828 -93.67448 4.78380 2.36316 -92.85149 849.55074
5390.0000 -97.40776 -92.11755 5.29020 2.36523 -92.82691 862.25455
5395.0000 -96.71911 -92.32518 4.39393 2.42095 -92.16441 882.94440
5400.0000 -97.01625 -91.91302 5.10323 2.45745 -91.73037 926.38705
5405.0000 -98.02112 -93.06485 4.95627 2.42290 -92.14118 876.95359
5410.0000 -98.21324 -93.59434 4.61891 2.33153 -93.22770 805.01044
5415.0000 -98.52412 -94.98363 3.54049 2.23371 -94.39070 730.55034
5420.0000 -98.75512 -95.29972 3.45540 2.17315 -95.11085 677.26623
5425.0000 -97.45966 -94.07906 3.38060 2.23191 -94.41211 753.02205
5430.0000 -97.95268 -93.20778 4.74490 2.21994 -94.55447 755.16201
5435.0000 -97.34763 -92.25902 5.08862 2.32489 -93.30656 814.50307
5440.0000 -97.77415 -92.68411 5.09004 2.37792 -92.67599 852.85551
5445.0000 -98.07551 -93.03798 5.03753 2.32910 -93.25658 811.66379
5450.0000 -97.01502 -92.70651 4.30851 2.32829 -93.26621 810.61988
5455.0000 -96.84225 -91.22715 5.61510 2.39369 -92.48852 832.75951
5460.0000 -96.91240 -91.91332 4.99908 2.43139 -92.04023 884.21774
5465.0000 -98.28339 -93.21206 5.07134 2.39839 -92.43268 887.65086
5470.0000 -96.27286 -91.45236 4.82050 2.37139 -92.75372 832.36970
5475.0000 -96.33820 -90.68585 5.65235 2.51611 -91.03299 959.76739
5480.0000 -96.16797 -90.67807 5.48990 2.52034 -90.98261 971.08054
5485.0000 -96.25339 -90.89936 5.35403 2.54957 -90.63508 945.47925
5490.0000 -97.22865 -92.85312 4.37553 2.51251 -91.07577 936.31783
5495.0000 -96.07777 -92.13979 3.93798 2.36200 -92.86531 839.74203
5500.0000 -97.50789 -92.11863 5.38925 2.41472 -92.23850 898.31396
MELTING PROCESS: loop number 23 T-loop= 877.00000000000000
main_MD> interactions number 23 at Temperature= 877.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.10128 0.88549 0.29187
force_rgl> df(natom) -3.36839 -3.09645 3.07180
5505.0000 -96.28917 -92.20793 4.08124 2.46803 -91.60462 904.07830
5510.0000 -96.52955 -91.07269 5.45686 2.49212 -91.31822 938.85888
5515.0000 -97.13315 -92.58227 4.55088 2.43114 -92.04328 919.75649
5520.0000 -97.54868 -92.47708 5.07160 2.41054 -92.28822 912.45011
5525.0000 -97.28570 -92.92626 4.35944 2.40282 -92.38000 852.09812
5530.0000 -96.81258 -92.31680 4.49579 2.37843 -92.66998 829.49415
5535.0000 -96.78705 -92.16952 4.61753 2.43322 -92.01854 871.98128
5540.0000 -97.60734 -93.38000 4.22734 2.41701 -92.21125 889.62586
5545.0000 -97.25825 -94.07196 3.18629 2.28046 -93.83488 788.31369
5550.0000 -98.08220 -94.13545 3.94675 2.29803 -93.62598 796.73913
5555.0000 -97.43302 -93.11676 4.31625 2.31693 -93.40127 799.39435
5560.0000 -96.24744 -91.16207 5.08536 2.43217 -92.03100 885.64642
5565.0000 -96.60761 -92.62479 3.98283 2.41805 -92.19894 860.60377
5570.0000 -97.39917 -93.10785 4.29132 2.35641 -92.93177 811.64198
5575.0000 -97.58674 -93.32995 4.25679 2.32990 -93.24704 801.07112
5580.0000 -97.44031 -92.68340 4.75691 2.36767 -92.79796 859.78202
5585.0000 -95.65459 -90.82183 4.83276 2.47247 -91.55189 924.45552
5590.0000 -97.33988 -92.31164 5.02824 2.42427 -92.12491 865.16387
5595.0000 -96.77061 -91.93759 4.83303 2.44318 -91.90012 905.96580
5600.0000 -97.32947 -93.40132 3.92815 2.35107 -92.99528 837.47437
5605.0000 -97.39847 -92.92235 4.47613 2.33271 -93.21365 845.90727
5610.0000 -96.91254 -92.25801 4.65453 2.39386 -92.48646 849.72891
5615.0000 -97.32923 -92.83860 4.49063 2.39883 -92.42743 835.79343
5620.0000 -95.93907 -91.63765 4.30142 2.39087 -92.52206 858.00946
5625.0000 -97.68907 -92.61969 5.06939 2.38009 -92.65025 816.36147
5630.0000 -96.86625 -92.05720 4.80905 2.39000 -92.53243 843.87789
5635.0000 -95.66451 -90.69961 4.96490 2.46879 -91.59560 915.89317
5640.0000 -95.83181 -91.29666 4.53515 2.46552 -91.63450 946.89001
5645.0000 -97.38049 -92.88870 4.49179 2.45614 -91.74597 948.13110
5650.0000 -96.40596 -92.13793 4.26803 2.39036 -92.52809 867.33443
5655.0000 -96.41988 -91.52527 4.89461 2.45321 -91.78078 859.27790
5660.0000 -95.83283 -91.54803 4.28480 2.49681 -91.26241 925.93377
5665.0000 -95.84157 -90.55399 5.28757 2.52244 -90.95766 940.23608
5670.0000 -97.23537 -92.74744 4.48793 2.45019 -91.81669 899.09181
5675.0000 -98.27213 -93.78936 4.48278 2.30633 -93.52726 818.75556
5680.0000 -97.10967 -92.39279 4.71688 2.38990 -92.53365 875.67635
5685.0000 -96.70062 -92.92758 3.77304 2.39577 -92.46378 858.22402
5690.0000 -98.27439 -93.46978 4.80461 2.31557 -93.41741 814.53054
5695.0000 -96.70781 -92.93810 3.76971 2.36974 -92.77329 829.54067
5700.0000 -97.23742 -93.19286 4.04456 2.32626 -93.29031 835.00455
5705.0000 -98.50547 -92.98338 5.52209 2.34016 -93.12498 825.17425
5710.0000 -96.63887 -92.69702 3.94185 2.39162 -92.51317 854.20253
5715.0000 -96.70623 -91.79430 4.91193 2.35805 -92.91228 824.32468
5720.0000 -95.60488 -90.69351 4.91137 2.53383 -90.82227 943.10767
5725.0000 -95.79763 -90.86771 4.92992 2.59249 -90.12477 1028.21209
5730.0000 -95.59740 -91.00706 4.59034 2.53239 -90.83932 976.47789
5735.0000 -94.95170 -90.58916 4.36254 2.52129 -90.97131 977.69643
5740.0000 -96.91069 -91.94627 4.96442 2.54290 -90.71436 1007.03525
5745.0000 -96.81920 -91.92766 4.89155 2.43121 -92.04244 899.64739
5750.0000 -98.40940 -94.07289 4.33651 2.36466 -92.83369 844.62880
MELTING PROCESS: loop number 24 T-loop= 902.00000000000000
main_MD> interactions number 24 at Temperature= 902.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.91722 3.47996 1.85078
force_rgl> df(natom) 1.09228 -0.74177 -0.94654
5755.0000 -96.96803 -93.47997 3.48806 2.24549 -94.25064 775.05525
5760.0000 -97.02945 -91.60508 5.42437 2.34289 -93.09252 852.04601
5765.0000 -97.15421 -92.24207 4.91214 2.41790 -92.20065 900.58768
5770.0000 -96.65911 -92.30281 4.35630 2.42513 -92.11471 901.68444
5775.0000 -95.58643 -90.41659 5.16984 2.48079 -91.45288 936.43383
5780.0000 -95.82823 -91.17673 4.65150 2.51136 -91.08948 974.09049
5785.0000 -97.17291 -92.47200 4.70091 2.46129 -91.68481 914.68291
5790.0000 -97.09488 -92.15127 4.94360 2.46594 -91.62946 927.36052
5795.0000 -95.49915 -89.93761 5.56154 2.55241 -90.60130 1012.92450
5800.0000 -94.46508 -89.99802 4.46706 2.61694 -89.83404 1131.89695
5805.0000 -96.13841 -89.17824 6.96017 2.73174 -88.46912 1133.09000
5810.0000 -96.73009 -92.65096 4.07914 2.50431 -91.17321 958.12404
5815.0000 -97.69081 -93.29741 4.39340 2.42067 -92.16773 839.25200
5820.0000 -97.50901 -92.80616 4.70285 2.36660 -92.81067 837.30557
5825.0000 -96.14973 -91.19653 4.95320 2.42938 -92.06415 911.66845
5830.0000 -96.61445 -91.82216 4.79229 2.54356 -90.70653 946.81573
5835.0000 -96.21624 -91.70508 4.51116 2.47733 -91.49409 930.92762
5840.0000 -97.05575 -91.32561 5.73014 2.44325 -91.89921 936.89351
5845.0000 -97.29990 -92.25283 5.04707 2.43162 -92.03760 867.58903
5850.0000 -96.04749 -91.82784 4.21965 2.41375 -92.24997 861.99505
5855.0000 -96.73888 -91.76137 4.97751 2.49198 -91.31989 919.39751
5860.0000 -96.41706 -91.93441 4.48265 2.44321 -91.89977 855.91911
5865.0000 -96.11158 -90.71467 5.39691 2.50389 -91.17826 954.14008
5870.0000 -97.19251 -93.24887 3.94364 2.48964 -91.34764 954.09462
5875.0000 -96.22953 -92.49183 3.73770 2.33809 -93.14964 828.96997
5880.0000 -95.71020 -92.25263 3.45757 2.41860 -92.19231 870.71299
5885.0000 -96.23171 -91.60521 4.62650 2.41817 -92.19752 840.97916
5890.0000 -98.12428 -92.93158 5.19270 2.44387 -91.89189 934.28734
5895.0000 -95.39609 -91.09531 4.30077 2.45182 -91.79741 934.88994
5900.0000 -95.68735 -91.00027 4.68708 2.53856 -90.76595 1035.39850
5905.0000 -95.34350 -90.75697 4.58654 2.53347 -90.82648 955.57643
5910.0000 -95.65372 -91.12255 4.53117 2.47638 -91.50537 953.97445
5915.0000 -96.60032 -92.05534 4.54498 2.44776 -91.84559 888.69224
5920.0000 -97.35846 -92.51336 4.84510 2.43217 -92.03104 887.29231
5925.0000 -96.16113 -91.41343 4.74770 2.46035 -91.69590 934.76208
5930.0000 -95.78448 -91.31430 4.47018 2.50812 -91.12800 973.21020
5935.0000 -96.39149 -90.47060 5.92089 2.53884 -90.76263 991.43251
5940.0000 -96.45907 -91.68560 4.77348 2.52307 -90.95013 939.03057
5945.0000 -96.54719 -90.90209 5.64511 2.45125 -91.80418 887.51439
5950.0000 -96.40010 -90.83740 5.56270 2.55991 -90.51217 1010.94426
5955.0000 -96.43000 -91.55887 4.87113 2.51849 -91.00461 931.41778
5960.0000 -97.83194 -94.05816 3.77378 2.43573 -91.98864 849.30707
5965.0000 -96.74840 -92.49976 4.24865 2.37563 -92.70330 842.41357
5970.0000 -96.82486 -92.05214 4.77272 2.47202 -91.55714 925.20381
5975.0000 -96.93655 -91.54045 5.39610 2.38084 -92.64138 851.76773
5980.0000 -95.51601 -90.34448 5.17153 2.50337 -91.18439 942.69238
5985.0000 -95.06388 -90.27755 4.78633 2.57943 -90.28004 964.20208
5990.0000 -96.62372 -91.54343 5.08029 2.56639 -90.43509 995.37673
5995.0000 -94.61473 -90.83673 3.77800 2.46246 -91.67087 920.74327
6000.0000 -96.21570 -91.02240 5.19330 2.48287 -91.42815 889.12584
MELTING PROCESS: loop number 25 T-loop= 927.00000000000000
main_MD> interactions number 25 at Temperature= 927.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.14315 -1.46907 -0.71566
force_rgl> df(natom) 0.65259 2.11036 -0.50388
6005.0000 -95.48838 -91.73978 3.74860 2.51365 -91.06217 971.94229
6010.0000 -96.29725 -90.81801 5.47924 2.43218 -92.03094 914.77633
6015.0000 -96.17729 -91.66827 4.50902 2.52296 -90.95149 960.62402
6020.0000 -97.45662 -93.18735 4.26927 2.44990 -91.82016 890.25958
6025.0000 -97.56020 -94.27114 3.28906 2.28612 -93.76762 794.80650
6030.0000 -97.40048 -91.36888 6.03159 2.31239 -93.45520 786.74825
6035.0000 -96.96496 -91.88784 5.07712 2.42472 -92.11963 837.87637
6040.0000 -96.66390 -92.63820 4.02570 2.42735 -92.08832 885.54851
6045.0000 -97.66019 -92.43369 5.22650 2.41176 -92.27367 874.04915
6050.0000 -96.62379 -92.48750 4.13629 2.39589 -92.46244 846.29155
6055.0000 -97.16366 -92.52379 4.63987 2.45960 -91.70481 926.62653
6060.0000 -97.41086 -91.58112 5.82975 2.40360 -92.37069 879.72348
6065.0000 -96.69363 -92.05165 4.64198 2.41626 -92.22013 920.82404
6070.0000 -96.11096 -91.06498 5.04598 2.49028 -91.34008 926.42607
6075.0000 -96.79430 -91.85189 4.94240 2.46004 -91.69961 892.90349
6080.0000 -95.25291 -90.86404 4.38888 2.52024 -90.98379 962.57388
6085.0000 -96.38176 -91.64348 4.73829 2.45096 -91.80757 899.22403
6090.0000 -96.49580 -92.20587 4.28993 2.44839 -91.83820 888.08708
6095.0000 -96.77396 -91.46483 5.30913 2.48902 -91.35500 943.39404
6100.0000 -96.13749 -90.61648 5.52101 2.48657 -91.38419 872.69006
6105.0000 -94.63808 -89.94637 4.69171 2.59168 -90.13442 1002.53550
6110.0000 -95.54857 -89.62202 5.92654 2.63318 -89.64091 998.35653
6115.0000 -94.53370 -88.54592 5.98779 2.70436 -88.79466 1111.17841
6120.0000 -95.18928 -90.89631 4.29297 2.64063 -89.55241 1020.49625
6125.0000 -95.99457 -89.91860 6.07598 2.52952 -90.87354 1018.80874
6130.0000 -97.56919 -92.83898 4.73021 2.49827 -91.24501 976.17690
6135.0000 -97.46371 -92.68038 4.78333 2.36004 -92.88864 852.30508
6140.0000 -97.19068 -92.66604 4.52464 2.39600 -92.46111 867.11244
6145.0000 -97.00021 -91.94813 5.05208 2.41415 -92.24528 891.66260
6150.0000 -97.56089 -92.08728 5.47361 2.41713 -92.20987 879.00341
6155.0000 -97.03526 -91.03426 6.00101 2.48932 -91.35148 965.39020
6160.0000 -95.58259 -90.11511 5.46749 2.53187 -90.84551 982.76276
6165.0000 -95.44659 -90.82252 4.62406 2.57268 -90.36031 1017.07277
6170.0000 -97.58149 -92.46935 5.11214 2.45444 -91.76618 914.45274
6175.0000 -98.08267 -91.96554 6.11712 2.40863 -92.31093 859.35551
6180.0000 -96.67229 -91.26912 5.40317 2.51724 -91.01949 931.44034
6185.0000 -95.39338 -90.99553 4.39785 2.53285 -90.83389 1002.05295
6190.0000 -94.30884 -89.88886 4.41998 2.56854 -90.40960 1000.35734
6195.0000 -96.44890 -91.48410 4.96480 2.59107 -90.14160 996.78871
6200.0000 -96.83841 -92.21626 4.62215 2.45675 -91.73880 940.83841
6205.0000 -97.64192 -93.16114 4.48079 2.35387 -92.96195 830.27065
6210.0000 -96.93510 -91.88814 5.04696 2.36777 -92.79678 857.96974
6215.0000 -97.23828 -92.00653 5.23175 2.42235 -92.14783 869.96503
6220.0000 -95.65482 -89.81088 5.84395 2.53613 -90.79493 974.90360
6225.0000 -95.58141 -89.73303 5.84837 2.57026 -90.38909 1003.89275
6230.0000 -96.38894 -90.93794 5.45099 2.54203 -90.72480 972.34913
6235.0000 -96.16322 -91.49188 4.67135 2.48919 -91.35306 926.24468
6240.0000 -96.14562 -91.55034 4.59528 2.43099 -92.04506 860.85124
6245.0000 -96.73253 -90.85488 5.87766 2.50651 -91.14711 976.35726
6250.0000 -95.42376 -91.22228 4.20148 2.51501 -91.04605 952.10383
MELTING PROCESS: loop number 26 T-loop= 952.00000000000000
main_MD> interactions number 26 at Temperature= 952.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.65077 -1.16558 -1.08416
force_rgl> df(natom) 1.07451 -0.81510 -2.73995
6255.0000 -97.04265 -92.58066 4.46200 2.45509 -91.75854 937.31670
6260.0000 -95.73339 -91.91459 3.81880 2.43967 -91.94185 922.16213
6265.0000 -95.47741 -90.18893 5.28848 2.50134 -91.20860 925.49026
6270.0000 -95.19045 -89.52364 5.66681 2.62037 -89.79321 1072.97292
6275.0000 -96.58164 -91.70581 4.87583 2.58760 -90.18293 1069.90721
6280.0000 -97.72059 -93.81437 3.90622 2.36491 -92.83079 856.34206
6285.0000 -96.61021 -91.69155 4.91866 2.35206 -92.98352 875.40675
6290.0000 -95.82426 -90.22345 5.60081 2.56690 -90.42906 998.18300
6295.0000 -96.13156 -90.66688 5.46468 2.55315 -90.59256 1016.44090
6300.0000 -96.75293 -91.16098 5.59195 2.55252 -90.60008 1022.77216
6305.0000 -95.89459 -90.75731 5.13728 2.54093 -90.73788 968.19602
6310.0000 -96.10386 -90.84098 5.26288 2.53839 -90.76798 975.76078
6315.0000 -96.60260 -92.36372 4.23888 2.47852 -91.47991 911.07967
6320.0000 -97.37285 -91.80236 5.57049 2.41542 -92.23023 909.07357
6325.0000 -94.94791 -90.68276 4.26515 2.53858 -90.76576 973.27262
6330.0000 -96.14636 -91.33053 4.81583 2.54968 -90.63379 972.51879
6335.0000 -95.66545 -90.90288 4.76257 2.54469 -90.69307 967.53674
6340.0000 -97.12335 -92.08788 5.03547 2.42227 -92.14873 894.04339
6345.0000 -95.95396 -91.58795 4.36601 2.42398 -92.12837 894.66365
6350.0000 -96.24853 -90.61985 5.62868 2.54005 -90.74831 964.71425
6355.0000 -96.54108 -91.17250 5.36858 2.48917 -91.35325 932.70854
6360.0000 -95.79125 -90.13662 5.65463 2.51591 -91.03535 961.10828
6365.0000 -95.83461 -91.39464 4.43996 2.53420 -90.81785 999.04543
6370.0000 -96.07343 -91.17255 4.90088 2.50349 -91.18302 940.99678
6375.0000 -95.56636 -89.92500 5.64136 2.52272 -90.95429 976.52628
6380.0000 -96.23955 -89.53183 6.70772 2.57601 -90.32070 1030.91609
6385.0000 -94.80630 -88.87245 5.93385 2.70094 -88.83525 1075.61001
6390.0000 -94.74305 -89.74464 4.99841 2.67111 -89.18995 1090.83392
6395.0000 -96.32575 -91.86426 4.46149 2.54747 -90.66005 1001.26836
6400.0000 -96.16336 -92.72635 3.43702 2.41188 -92.27227 895.37692
6405.0000 -96.91015 -91.65543 5.25473 2.37848 -92.66934 848.13585
6410.0000 -95.87873 -90.87896 4.99976 2.55219 -90.60398 962.54729
6415.0000 -96.70543 -91.75433 4.95109 2.51149 -91.08793 968.11586
6420.0000 -96.62768 -90.92495 5.70274 2.50455 -91.17040 972.67674
6425.0000 -96.26561 -91.31359 4.95201 2.54798 -90.65402 941.17976
6430.0000 -95.63411 -90.81182 4.82229 2.52803 -90.89123 984.43020
6435.0000 -96.67101 -91.50328 5.16773 2.52570 -90.91887 959.35096
6440.0000 -97.21658 -91.72494 5.49165 2.49207 -91.31876 984.19272
6445.0000 -96.77639 -92.09419 4.68220 2.45525 -91.75653 933.74743
6450.0000 -96.66883 -92.25751 4.41132 2.40959 -92.29951 873.86142
6455.0000 -96.80064 -92.53068 4.26996 2.42455 -92.12161 899.98472
6460.0000 -95.06976 -90.51899 4.55077 2.51169 -91.08552 968.61880
6465.0000 -96.47657 -91.83204 4.64453 2.48318 -91.42448 958.49478
6470.0000 -97.15868 -91.99865 5.16003 2.47962 -91.46682 942.00924
6475.0000 -95.75422 -90.64526 5.10896 2.57260 -90.36129 995.74757
6480.0000 -97.66094 -91.13646 6.52447 2.56138 -90.49473 995.87744
6485.0000 -95.55836 -91.11510 4.44327 2.49826 -91.24523 941.78380
6490.0000 -95.85941 -91.73870 4.12071 2.52331 -90.94732 990.25729
6495.0000 -96.49352 -90.93707 5.55645 2.45650 -91.74177 905.78341
6500.0000 -95.89176 -90.95834 4.93342 2.50486 -91.16675 941.74626
MELTING PROCESS: loop number 27 T-loop= 977.00000000000000
main_MD> interactions number 27 at Temperature= 977.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.73370 -3.00361 -1.02693
force_rgl> df(natom) -1.74091 2.75213 -1.07859
6505.0000 -95.65813 -90.13877 5.51937 2.51572 -91.03755 955.50664
6510.0000 -97.86701 -91.78941 6.07759 2.53627 -90.79326 960.09759
6515.0000 -96.18119 -92.05116 4.13003 2.45525 -91.75652 934.81054
6520.0000 -96.08274 -89.99394 6.08880 2.54671 -90.66912 1010.73019
6525.0000 -94.59001 -89.76896 4.82105 2.55067 -90.62197 987.92616
6530.0000 -94.51156 -89.61802 4.89354 2.60178 -90.01431 984.56105
6535.0000 -95.44566 -90.45231 4.99335 2.50294 -91.18949 939.70229
6540.0000 -95.22285 -90.86893 4.35392 2.55307 -90.59354 996.20384
6545.0000 -96.07309 -89.80337 6.26972 2.58201 -90.24944 969.61820
6550.0000 -93.87395 -87.70532 6.16863 2.71308 -88.69090 1076.23462
6555.0000 -94.02434 -88.59520 5.42914 2.65263 -89.40971 1052.97386
6560.0000 -94.06802 -88.35163 5.71639 2.74800 -88.27573 1136.63409
6565.0000 -95.06083 -90.02909 5.03174 2.65837 -89.34145 1047.46025
6570.0000 -95.69178 -90.20051 5.49127 2.60172 -90.01502 1059.25666
6575.0000 -97.15802 -92.02769 5.13033 2.55422 -90.57980 1029.58424
6580.0000 -96.21800 -90.78904 5.42896 2.45695 -91.73634 936.36306
6585.0000 -94.11141 -89.24007 4.87134 2.61849 -89.81557 1046.64088
6590.0000 -95.35351 -90.51802 4.83549 2.60528 -89.97275 989.91790
6595.0000 -94.60623 -89.00949 5.59674 2.62105 -89.78521 1062.41166
6600.0000 -94.84031 -90.28601 4.55429 2.61112 -89.90331 1004.10050
6605.0000 -96.24227 -89.33667 6.90561 2.55139 -90.61350 1025.79821
6610.0000 -95.29692 -88.96975 6.32717 2.66244 -89.29308 1110.60385
6615.0000 -96.19720 -91.14782 5.04939 2.58696 -90.19050 990.53179
6620.0000 -94.87227 -90.11115 4.76112 2.49894 -91.23712 925.83739
6625.0000 -95.41968 -89.42925 5.99043 2.56607 -90.43890 962.02424
6630.0000 -96.67954 -91.68940 4.99014 2.61788 -89.82289 1021.32628
6635.0000 -97.13027 -91.56966 5.56061 2.46056 -91.69349 914.22908
6640.0000 -96.48558 -90.55654 5.92904 2.53687 -90.78615 989.56220
6645.0000 -95.52155 -90.05395 5.46760 2.57015 -90.39045 993.75228
6650.0000 -96.13886 -90.33176 5.80710 2.55894 -90.52363 965.21220
6655.0000 -95.26923 -89.63074 5.63849 2.61527 -89.85387 1037.69283
6660.0000 -95.00376 -90.15250 4.85126 2.61474 -89.86019 1017.43899
6665.0000 -95.53819 -89.55767 5.98052 2.59418 -90.10467 1018.62710
6670.0000 -95.92041 -90.72859 5.19182 2.55774 -90.53795 962.99756
6675.0000 -96.59594 -90.27608 6.31986 2.55494 -90.57120 1007.88832
6680.0000 -95.19248 -89.66777 5.52471 2.61914 -89.80792 1054.87710
6685.0000 -95.59835 -89.06483 6.53351 2.59507 -90.09413 1019.14912
6690.0000 -95.20517 -89.72877 5.47640 2.56878 -90.40667 996.86112
6695.0000 -97.30575 -92.78808 4.51767 2.57028 -90.38888 1009.73390
6700.0000 -95.98748 -91.04906 4.93841 2.43574 -91.98856 874.78913
6705.0000 -96.12680 -91.33433 4.79248 2.48328 -91.42329 941.45151
6710.0000 -94.32731 -89.53016 4.79715 2.57715 -90.30714 988.43593
6715.0000 -96.43768 -90.12373 6.31395 2.61702 -89.83309 1019.62555
6720.0000 -95.59904 -90.21764 5.38140 2.52777 -90.89432 939.58534
6725.0000 -96.02549 -91.26343 4.76206 2.53313 -90.83060 976.16396
6730.0000 -96.95602 -92.56427 4.39175 2.43819 -91.95942 859.14648
6735.0000 -96.77266 -91.55734 5.21532 2.39120 -92.51812 863.59124
6740.0000 -96.87417 -91.74731 5.12687 2.46974 -91.58427 933.47268
6745.0000 -96.94812 -92.72111 4.22701 2.43778 -91.96433 896.57854
6750.0000 -96.04206 -90.67841 5.36365 2.42997 -92.05719 885.05459
MELTING PROCESS: loop number 28 T-loop= 1002.0000000000000
main_MD> interactions number 28 at Temperature= 1002.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 4.59879 -4.53576 3.89711
force_rgl> df(natom) 1.72208 1.70439 -1.39808
6755.0000 -95.56527 -90.44592 5.11935 2.50542 -91.16001 1004.30157
6760.0000 -96.12149 -89.69822 6.42327 2.62739 -89.70980 1017.71808
6765.0000 -95.53294 -89.86829 5.66465 2.64507 -89.49955 1065.81858
6770.0000 -96.78916 -90.45919 6.32996 2.53898 -90.76101 957.63778
6775.0000 -96.85218 -90.04326 6.80891 2.50830 -91.12585 931.19204
6780.0000 -95.64642 -89.33885 6.30757 2.63699 -89.59567 1047.19976
6785.0000 -94.76363 -88.58108 6.18255 2.65130 -89.42556 1095.01150
6790.0000 -95.26170 -89.55359 5.70811 2.69101 -88.95337 1139.25301
6795.0000 -96.26922 -90.78976 5.47946 2.63421 -89.62865 1040.35831
6800.0000 -95.57117 -90.26611 5.30505 2.53495 -90.80895 1009.09363
6805.0000 -96.11823 -90.30876 5.80948 2.61357 -89.87416 1069.58421
6810.0000 -96.02338 -90.92821 5.09516 2.53706 -90.78383 993.18818
6815.0000 -96.96912 -91.28746 5.68166 2.50098 -91.21279 949.03715
6820.0000 -97.51339 -92.22258 5.29081 2.55715 -90.54494 1009.73219
6825.0000 -96.04523 -91.66323 4.38200 2.50158 -91.20576 944.11560
6830.0000 -96.33386 -90.61012 5.72374 2.47086 -91.57097 947.20238
6835.0000 -95.17183 -89.28214 5.88969 2.59187 -90.13216 1031.21749
6840.0000 -96.28000 -89.58190 6.69810 2.63087 -89.66839 1056.71332
6845.0000 -96.55572 -91.71616 4.83956 2.63299 -89.64325 1035.34355
6850.0000 -94.83877 -89.85460 4.98418 2.49879 -91.23883 933.08165
6855.0000 -95.15357 -90.54749 4.60608 2.57815 -90.29528 977.80498
6860.0000 -95.49074 -90.08860 5.40215 2.54496 -90.68996 996.10435
6865.0000 -96.44082 -91.82793 4.61289 2.46861 -91.59778 898.68848
6870.0000 -95.17798 -90.59616 4.58182 2.48271 -91.43002 893.91522
6875.0000 -95.73724 -91.70850 4.02874 2.53209 -90.84290 951.54702
6880.0000 -97.70087 -93.18347 4.51741 2.39222 -92.50602 874.72980
6885.0000 -97.12399 -90.42759 6.69639 2.50399 -91.17708 906.63948
6890.0000 -96.14758 -90.82415 5.32343 2.55268 -90.59812 1007.91880
6895.0000 -95.77650 -90.38417 5.39233 2.55159 -90.61104 1015.01892
6900.0000 -95.87965 -90.38071 5.49894 2.53647 -90.79091 967.13880
6905.0000 -93.41380 -89.00555 4.40824 2.66541 -89.25774 1071.74657
6910.0000 -94.75985 -89.04298 5.71688 2.72330 -88.56947 1135.67646
6915.0000 -92.91502 -87.09046 5.82456 2.78471 -87.83924 1175.14990
6920.0000 -95.17560 -89.51314 5.66246 2.75794 -88.15754 1172.97092
6925.0000 -94.81738 -89.57724 5.24014 2.64929 -89.44945 1072.02005
6930.0000 -96.92253 -91.18554 5.73699 2.60352 -89.99357 1023.19042
6935.0000 -96.99732 -92.36246 4.63486 2.43529 -91.99394 871.02384
6940.0000 -96.49116 -91.24146 5.24970 2.50727 -91.13806 925.83456
6945.0000 -95.36196 -90.59874 4.76322 2.54402 -90.70112 975.03292
6950.0000 -96.11101 -89.95611 6.15489 2.58251 -90.24349 1018.08158
6955.0000 -95.44537 -90.55918 4.88619 2.69452 -88.91167 1098.71140
6960.0000 -95.94606 -90.39869 5.54737 2.57756 -90.30229 1019.57638
6965.0000 -95.86977 -91.19415 4.67562 2.55199 -90.60637 1018.65733
6970.0000 -94.50338 -89.40568 5.09771 2.52436 -90.93487 972.47596
6975.0000 -95.74502 -90.64775 5.09726 2.58529 -90.21035 1004.71984
6980.0000 -96.23430 -91.13667 5.09763 2.55240 -90.60140 980.34775
6985.0000 -95.96496 -91.51416 4.45079 2.53081 -90.85821 973.69415
6990.0000 -96.03988 -89.63361 6.40628 2.52082 -90.97692 953.29579
6995.0000 -96.24642 -90.89484 5.35158 2.62365 -89.75429 1022.22150
7000.0000 -95.76128 -90.96895 4.79233 2.51556 -91.03948 935.02458
MELTING PROCESS: loop number 29 T-loop= 1027.0000000000000
main_MD> interactions number 29 at Temperature= 1027.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 5.82637 -1.77188 0.06028
force_rgl> df(natom) -0.35164 -0.13705 -1.03093
7005.0000 -95.57106 -90.94169 4.62936 2.53571 -90.79987 981.09208
7010.0000 -97.61423 -91.71310 5.90113 2.51189 -91.08314 998.32353
7015.0000 -95.29457 -90.22334 5.07123 2.53952 -90.75460 977.88895
7020.0000 -96.96478 -92.39790 4.56688 2.56697 -90.42822 1017.46765
7025.0000 -96.57876 -91.19436 5.38440 2.42491 -92.11733 895.47728
7030.0000 -95.30848 -90.98058 4.32789 2.51965 -90.99082 973.73698
7035.0000 -96.26823 -90.68272 5.58551 2.50931 -91.11375 936.89330
7040.0000 -96.13723 -91.39896 4.73827 2.51594 -91.03498 977.47929
7045.0000 -97.27427 -90.76055 6.51372 2.53487 -90.80984 1004.95654
7050.0000 -95.15903 -88.67438 6.48465 2.58198 -90.24969 1010.76999
7055.0000 -94.85628 -90.14606 4.71022 2.70949 -88.73366 1126.62945
7060.0000 -96.55762 -91.49905 5.05858 2.50692 -91.14217 942.51182
7065.0000 -97.07392 -92.40026 4.67366 2.44064 -91.93028 929.41178
7070.0000 -95.58503 -90.26339 5.32164 2.46886 -91.59479 937.34557
7075.0000 -93.57107 -87.49581 6.07526 2.63045 -89.67346 1074.19110
7080.0000 -96.01092 -90.78935 5.22157 2.68610 -89.01169 1091.05875
7085.0000 -94.80797 -89.28375 5.52422 2.62018 -89.79554 1014.36705
7090.0000 -94.29726 -88.44191 5.85534 2.70219 -88.82036 1120.74556
7095.0000 -95.12506 -88.48785 6.63721 2.76564 -88.06596 1127.26350
7100.0000 -96.35063 -90.57049 5.78014 2.65258 -89.41033 1084.29144
7105.0000 -94.49173 -89.02780 5.46392 2.64150 -89.54205 1034.41246
7110.0000 -95.51173 -90.17380 5.33793 2.69551 -88.89983 1099.59344
7115.0000 -97.43274 -91.33303 6.09971 2.55483 -90.57258 994.02017
7120.0000 -95.51939 -90.88983 4.62956 2.58527 -90.21066 1036.19558
7125.0000 -94.26213 -88.36299 5.89914 2.60260 -90.00457 989.25003
7130.0000 -97.20351 -91.30200 5.90151 2.62226 -89.77076 1077.66735
7135.0000 -96.15130 -90.35973 5.79157 2.55811 -90.53358 1045.08110
7140.0000 -96.96568 -91.78884 5.17683 2.51366 -91.06209 954.68149
7145.0000 -96.88621 -91.07686 5.80935 2.49566 -91.27606 976.67127
7150.0000 -95.30745 -89.95902 5.34843 2.56232 -90.48349 1000.60419
7155.0000 -94.95933 -88.91066 6.04867 2.61335 -89.87669 1023.02905
7160.0000 -94.45781 -87.58716 6.87065 2.78839 -87.79552 1188.58976
7165.0000 -95.62384 -90.81504 4.80881 2.66730 -89.23528 1061.91717
7170.0000 -96.88197 -91.71946 5.16251 2.49969 -91.22824 950.73863
7175.0000 -95.54996 -90.33561 5.21435 2.56706 -90.42719 1034.71979
7180.0000 -95.20802 -89.63789 5.57013 2.53749 -90.77870 989.64909
7185.0000 -94.11227 -87.73182 6.38044 2.72233 -88.58090 1120.84628
7190.0000 -93.10468 -88.39374 4.71094 2.68103 -89.07204 1093.90168
7195.0000 -96.72743 -90.60186 6.12557 2.69802 -88.86999 1127.60381
7200.0000 -96.35617 -89.97841 6.37776 2.55913 -90.52144 1006.40135
7205.0000 -95.57328 -88.74792 6.82536 2.62493 -89.73908 1033.66021
7210.0000 -95.89330 -90.00552 5.88778 2.62579 -89.72883 996.67363
7215.0000 -95.89177 -91.26394 4.62783 2.57782 -90.29921 1018.05432
7220.0000 -95.51123 -89.11527 6.39596 2.58913 -90.16474 1033.92426
7225.0000 -94.24159 -89.01484 5.22675 2.65895 -89.33458 1077.66385
7230.0000 -95.95841 -90.41180 5.54661 2.60359 -89.99278 1065.79413
7235.0000 -95.53461 -89.94612 5.58849 2.54688 -90.66710 1007.53573
7240.0000 -93.49142 -88.09505 5.39637 2.67036 -89.19887 1051.47823
7245.0000 -95.45799 -89.90607 5.55193 2.65222 -89.41455 1075.09586
7250.0000 -98.12541 -92.13176 5.99365 2.49181 -91.32191 970.11718
MELTING PROCESS: loop number 30 T-loop= 1052.0000000000000
main_MD> interactions number 30 at Temperature= 1052.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.21514 -0.20941 -0.85104
force_rgl> df(natom) -4.10258 3.06847 3.57093
7255.0000 -97.26788 -92.50674 4.76114 2.39939 -92.42079 918.61666
7260.0000 -95.89340 -91.10997 4.78343 2.47732 -91.49414 957.60343
7265.0000 -96.16758 -90.71415 5.45344 2.52753 -90.89712 930.41982
7270.0000 -95.52067 -90.12959 5.39108 2.54693 -90.66649 928.77096
7275.0000 -96.37949 -91.02234 5.35716 2.57570 -90.32435 992.95128
7280.0000 -96.42076 -90.70213 5.71864 2.50550 -91.15905 910.94225
7285.0000 -94.92745 -89.25373 5.67372 2.62425 -89.74713 1038.31678
7290.0000 -95.32707 -87.85755 7.46953 2.72496 -88.54972 1144.60313
7295.0000 -93.53373 -86.76080 6.77294 2.82901 -87.31248 1248.33204
7300.0000 -95.80547 -88.76380 7.04166 2.80620 -87.58370 1191.96207
7305.0000 -96.01378 -90.44922 5.56455 2.68100 -89.07243 1111.25450
7310.0000 -94.45999 -87.40358 7.05641 2.63638 -89.60291 1031.38581
7315.0000 -94.94723 -88.78621 6.16102 2.75121 -88.23754 1132.80906
7320.0000 -95.02109 -89.63798 5.38311 2.66657 -89.24389 1073.31558
7325.0000 -94.96643 -88.88623 6.08020 2.66882 -89.21714 1094.40048
7330.0000 -96.58545 -90.04814 6.53732 2.67338 -89.16303 1109.09487
7335.0000 -95.84613 -91.10464 4.74148 2.56745 -90.42247 984.90218
7340.0000 -95.10463 -90.45844 4.64619 2.54773 -90.65700 970.36945
7345.0000 -95.27173 -90.22169 5.05004 2.58129 -90.25798 1031.13796
7350.0000 -95.34090 -89.84644 5.49447 2.60417 -89.98589 1037.33350
7355.0000 -96.14419 -90.73026 5.41393 2.51302 -91.06966 973.44768
7360.0000 -96.33323 -91.93158 4.40166 2.50899 -91.11761 957.27826
7365.0000 -95.80203 -90.22467 5.57736 2.56501 -90.45146 955.62236
7370.0000 -95.96085 -90.89288 5.06798 2.56173 -90.49049 934.07827
7375.0000 -96.30733 -89.57161 6.73572 2.60003 -90.03508 1009.07502
7380.0000 -96.16913 -90.27597 5.89316 2.68916 -88.97530 1116.65232
7385.0000 -95.49052 -90.09188 5.39864 2.59820 -90.05694 1058.57108
7390.0000 -93.75572 -88.20824 5.54748 2.68652 -89.00673 1080.31018
7395.0000 -94.48502 -88.96768 5.51734 2.70815 -88.74957 1122.06716
7400.0000 -95.24701 -88.33615 6.91086 2.69316 -88.92780 1127.39169
7405.0000 -96.60058 -90.54825 6.05233 2.62721 -89.71189 1080.92315
7410.0000 -95.42640 -90.27277 5.15363 2.62606 -89.72559 1067.01238
7415.0000 -95.17099 -89.50716 5.66382 2.62290 -89.76320 1072.94812
7420.0000 -95.88918 -90.28819 5.60100 2.58698 -90.19030 1011.40822
7425.0000 -94.91967 -89.30510 5.61457 2.63951 -89.56569 1069.99906
7430.0000 -94.89908 -90.22787 4.67121 2.58073 -90.26460 971.79585
7435.0000 -95.74408 -90.34697 5.39711 2.53348 -90.82645 968.69539
7440.0000 -95.45675 -89.37487 6.08189 2.63921 -89.56925 1072.34282
7445.0000 -95.23761 -88.90574 6.33187 2.74405 -88.32267 1137.21977
7450.0000 -94.32511 -88.38451 5.94060 2.68206 -89.05981 1088.96172
7455.0000 -94.44162 -88.52176 5.91987 2.77952 -87.90095 1145.16677
7460.0000 -95.11101 -88.68469 6.42632 2.71614 -88.65452 1109.53339
7465.0000 -94.28083 -88.00788 6.27295 2.75442 -88.19942 1138.90659
7470.0000 -94.45497 -88.83383 5.62115 2.75319 -88.21402 1159.17482
7475.0000 -95.20307 -90.34275 4.86032 2.65404 -89.39288 1017.98425
7480.0000 -96.28463 -90.37648 5.90814 2.56044 -90.50589 978.27816
7485.0000 -94.94181 -89.03143 5.91038 2.63333 -89.63912 1088.13541
7490.0000 -94.90450 -89.16875 5.73575 2.60634 -89.96015 1012.38899
7495.0000 -95.26202 -90.06183 5.20019 2.60468 -89.97987 1037.59493
7500.0000 -95.83271 -90.42158 5.41113 2.65129 -89.42567 1069.80257
MELTING PROCESS: loop number 31 T-loop= 1077.0000000000000
main_MD> interactions number 31 at Temperature= 1077.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 3.52544 4.11603 0.68616
force_rgl> df(natom) -2.53568 -2.02603 2.15700
7505.0000 -96.13187 -90.42522 5.70665 2.51460 -91.05092 959.90294
7510.0000 -95.66282 -89.83486 5.82796 2.57619 -90.31861 988.34366
7515.0000 -93.94014 -88.18383 5.75631 2.72019 -88.60639 1168.67029
7520.0000 -94.46925 -89.11667 5.35259 2.76294 -88.09805 1177.53164
7525.0000 -94.12478 -88.20923 5.91555 2.68337 -89.04422 1073.83684
7530.0000 -96.74876 -90.40514 6.34361 2.65135 -89.42492 1102.89596
7535.0000 -95.64853 -90.63788 5.01065 2.62765 -89.70671 1055.96179
7540.0000 -94.84004 -90.47262 4.36742 2.53910 -90.75962 1000.59824
7545.0000 -95.51194 -89.65367 5.85828 2.63964 -89.56420 1060.47205
7550.0000 -94.98226 -90.21435 4.76792 2.68841 -88.98421 1056.49519
7555.0000 -95.34107 -90.64076 4.70030 2.52915 -90.87785 986.35479
7560.0000 -95.21364 -88.99016 6.22349 2.59419 -90.10451 1022.65051
7565.0000 -94.88807 -86.58860 8.29947 2.78287 -87.86108 1199.17564
7570.0000 -95.59379 -88.57977 7.01402 2.80906 -87.54966 1221.12464
7575.0000 -95.29652 -89.99501 5.30151 2.59721 -90.06866 995.14587
7580.0000 -95.95790 -91.56910 4.38880 2.54974 -90.63305 944.60549
7585.0000 -96.32940 -90.75835 5.57105 2.56571 -90.44318 1018.21607
7590.0000 -92.95858 -86.62321 6.33537 2.66266 -89.29039 1090.65929
7595.0000 -94.50697 -88.78580 5.72118 2.82152 -87.40159 1202.58703
7600.0000 -94.04110 -87.94927 6.09184 2.73071 -88.48133 1128.69516
7605.0000 -95.24519 -89.60404 5.64115 2.65341 -89.40047 1019.55466
7610.0000 -96.60984 -91.62136 4.98848 2.59123 -90.13976 1027.90215
7615.0000 -96.12912 -90.80539 5.32374 2.54019 -90.74666 1000.35037
7620.0000 -95.36226 -89.70070 5.66155 2.61010 -89.91541 1064.90446
7625.0000 -95.11720 -89.40794 5.70926 2.64407 -89.51145 1079.82244
7630.0000 -93.96812 -88.44389 5.52423 2.70759 -88.75620 1118.55255
7635.0000 -95.61257 -90.50106 5.11151 2.59802 -90.05903 1017.55235
7640.0000 -95.20829 -89.40500 5.80330 2.58575 -90.20493 1031.68964
7645.0000 -94.20015 -88.16445 6.03570 2.71989 -88.61001 1181.82517
7650.0000 -94.21477 -89.14591 5.06887 2.73694 -88.40727 1153.20476
7655.0000 -93.67399 -88.21832 5.45567 2.72155 -88.59020 1094.09682
7660.0000 -94.37854 -89.41055 4.96799 2.76736 -88.04551 1153.02393
7665.0000 -94.13160 -87.94775 6.18384 2.67512 -89.14223 1070.05547
7670.0000 -95.17909 -89.04017 6.13893 2.72006 -88.60799 1084.03090
7675.0000 -94.87287 -87.52926 7.34360 2.73505 -88.42973 1133.22381
7680.0000 -94.54466 -88.61910 5.92555 2.76615 -88.05990 1185.23741
7685.0000 -94.84568 -89.10518 5.74050 2.73889 -88.38409 1121.92974
7690.0000 -95.18642 -89.60910 5.57732 2.72252 -88.57866 1109.81847
7695.0000 -93.42717 -88.85996 4.56721 2.64856 -89.45806 1074.60416
7700.0000 -94.05188 -88.14292 5.90895 2.72165 -88.58898 1156.27258
7705.0000 -92.81592 -87.86562 4.95030 2.75635 -88.17647 1194.84185
7710.0000 -95.34640 -89.43650 5.90989 2.74608 -88.29850 1099.00399
7715.0000 -94.76438 -89.96404 4.80034 2.58419 -90.22346 1010.47564
7720.0000 -95.22094 -89.42413 5.79681 2.55289 -90.59561 991.54335
7725.0000 -96.78289 -92.30834 4.47454 2.57391 -90.34570 1017.02512
7730.0000 -95.19975 -90.86685 4.33291 2.47877 -91.47688 922.59371
7735.0000 -96.12228 -89.83545 6.28683 2.59654 -90.07663 1031.85683
7740.0000 -95.45485 -90.86231 4.59254 2.51350 -91.06397 993.40227
7745.0000 -95.12632 -89.72785 5.39848 2.52890 -90.88088 942.19596
7750.0000 -95.12409 -89.38109 5.74300 2.62042 -89.79264 1022.67401
MELTING PROCESS: loop number 32 T-loop= 1102.0000000000000
main_MD> interactions number 32 at Temperature= 1102.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.39948 -1.67188 -2.74247
force_rgl> df(natom) 6.55886 -5.75395 0.64796
7755.0000 -95.84855 -89.60739 6.24116 2.63538 -89.61486 1025.28380
7760.0000 -94.86644 -89.96179 4.90465 2.70346 -88.80532 1122.12355
7765.0000 -95.33909 -89.42751 5.91157 2.65636 -89.36538 1086.83911
7770.0000 -93.23327 -87.69666 5.53661 2.71670 -88.64783 1130.62895
7775.0000 -94.76311 -88.95356 5.80955 2.72729 -88.52201 1129.82256
7780.0000 -95.39737 -90.26054 5.13683 2.63011 -89.67751 1076.59016
7785.0000 -94.52781 -87.58798 6.93983 2.65514 -89.37986 1038.75585
7790.0000 -94.70845 -88.78756 5.92089 2.70154 -88.82810 1136.99775
7795.0000 -95.26632 -87.85383 7.41250 2.71696 -88.64477 1199.75889
7800.0000 -93.71901 -86.97664 6.74237 2.82603 -87.34794 1261.04721
7805.0000 -94.11547 -88.85669 5.25878 2.81431 -87.48725 1197.43445
7810.0000 -95.20656 -90.66994 4.53663 2.61710 -89.83221 1050.95694
7815.0000 -96.46954 -91.05537 5.41417 2.57468 -90.33649 978.83939
7820.0000 -96.32792 -91.49280 4.83512 2.53274 -90.83517 964.18340
7825.0000 -94.94588 -89.75912 5.18676 2.54324 -90.71038 1028.49344
7830.0000 -94.34138 -88.81986 5.52152 2.66359 -89.27940 1104.06239
7835.0000 -96.39827 -89.66324 6.73504 2.64166 -89.54015 1074.63054
7840.0000 -95.36647 -89.33908 6.02739 2.61625 -89.84225 1064.34289
7845.0000 -94.92114 -89.64603 5.27511 2.63720 -89.59313 1053.11054
7850.0000 -95.70759 -89.16303 6.54456 2.62029 -89.79428 1048.77128
7855.0000 -95.11882 -88.24469 6.87413 2.68727 -88.99776 1121.83197
7860.0000 -94.55444 -88.19569 6.35875 2.67384 -89.15747 1082.27463
7865.0000 -93.89572 -87.42976 6.46596 2.78595 -87.82449 1190.24497
7870.0000 -94.52369 -86.99262 7.53107 2.89429 -86.53629 1280.44778
7875.0000 -95.59313 -88.61727 6.97585 2.77577 -87.94554 1159.83202
7880.0000 -94.38968 -88.87514 5.51454 2.75347 -88.21063 1145.15796
7885.0000 -95.25278 -89.41218 5.84060 2.60727 -89.94906 1000.20731
7890.0000 -92.90637 -87.44310 5.46327 2.82340 -87.37924 1200.99278
7895.0000 -94.14048 -88.10022 6.04026 2.73687 -88.40806 1089.65430
7900.0000 -93.98199 -88.05086 5.93112 2.73841 -88.38974 1148.78722
7905.0000 -95.49683 -89.20823 6.28860 2.72207 -88.58404 1144.70759
7910.0000 -95.58196 -88.53160 7.05036 2.67774 -89.11108 1108.57282
7915.0000 -94.28449 -87.65801 6.62647 2.79576 -87.70782 1206.31843
7920.0000 -94.40837 -88.40450 6.00387 2.76696 -88.05024 1127.98025
7925.0000 -94.48163 -89.48203 4.99960 2.72345 -88.56766 1120.45753
7930.0000 -94.54075 -89.22464 5.31611 2.73678 -88.40909 1123.73173
7935.0000 -95.48595 -89.86880 5.61714 2.67728 -89.11664 1116.91166
7940.0000 -95.22043 -90.02055 5.19988 2.63555 -89.61275 1120.23201
7945.0000 -95.70329 -90.41760 5.28569 2.59369 -90.11053 1050.67260
7950.0000 -95.33575 -90.20873 5.12702 2.63082 -89.66898 1049.15542
7955.0000 -96.53831 -90.55538 5.98293 2.52013 -90.98520 960.03039
7960.0000 -95.08174 -90.24889 4.83284 2.61270 -89.88451 1047.36766
7965.0000 -95.13072 -89.26044 5.87028 2.65155 -89.42259 1108.65599
7970.0000 -95.57962 -89.78163 5.79799 2.71693 -88.64516 1126.68318
7975.0000 -95.05095 -90.61394 4.43702 2.59110 -90.14129 1030.60715
7980.0000 -95.91048 -89.84106 6.06942 2.64474 -89.50356 993.51532
7985.0000 -94.84899 -90.10219 4.74679 2.58806 -90.17748 1003.00850
7990.0000 -94.54673 -89.74103 4.80571 2.55144 -90.61290 979.44990
7995.0000 -94.38419 -88.55601 5.82819 2.79451 -87.72270 1243.77593
8000.0000 -94.24841 -87.95337 6.29504 2.73037 -88.48529 1149.94213
MELTING PROCESS: loop number 33 T-loop= 1127.0000000000000
main_MD> interactions number 33 at Temperature= 1127.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.88156 0.57647 0.81097
force_rgl> df(natom) 2.87815 2.13467 3.83206
8005.0000 -95.28939 -87.71575 7.57364 2.74415 -88.32153 1124.90827
8010.0000 -94.89038 -88.56553 6.32485 2.75852 -88.15067 1137.14818
8015.0000 -93.50610 -88.05074 5.45536 2.69413 -88.91620 1049.24159
8020.0000 -92.86268 -87.02897 5.83372 2.81253 -87.50845 1186.87979
8025.0000 -94.38257 -87.61745 6.76511 2.84142 -87.16495 1240.62122
8030.0000 -94.18895 -88.38722 5.80173 2.74372 -88.32661 1174.21180
8035.0000 -95.76413 -89.81900 5.94513 2.63030 -89.67521 1066.34547
8040.0000 -94.19581 -88.75052 5.44529 2.64212 -89.53470 1057.04228
8045.0000 -94.14876 -89.05008 5.09868 2.68822 -88.98651 1051.17197
8050.0000 -94.33498 -88.79188 5.54310 2.66283 -89.28844 1107.21958
8055.0000 -94.02573 -87.93627 6.08947 2.73725 -88.40352 1115.65228
8060.0000 -94.26064 -88.53192 5.72872 2.70232 -88.81887 1131.15864
8065.0000 -94.73215 -88.28681 6.44533 2.80614 -87.58442 1212.11247
8070.0000 -93.47536 -87.54294 5.93241 2.77256 -87.98372 1141.93364
8075.0000 -93.71916 -88.32509 5.39407 2.66767 -89.23086 1089.94189
8080.0000 -96.15538 -90.25793 5.89745 2.69616 -88.89215 1096.50441
8085.0000 -94.76870 -88.76661 6.00209 2.60974 -89.91970 1047.58839
8090.0000 -94.87678 -90.37044 4.50633 2.64377 -89.51503 1053.41559
8095.0000 -94.42916 -86.77423 7.65493 2.71231 -88.70012 1119.04555
8100.0000 -93.84830 -88.45075 5.39755 2.80370 -87.61342 1207.19827
8105.0000 -94.44552 -89.30759 5.13793 2.68423 -89.03395 1066.65398
8110.0000 -94.90674 -88.32256 6.58418 2.68607 -89.01205 1101.71596
8115.0000 -92.20241 -87.67708 4.52533 2.77729 -87.92751 1179.47185
8120.0000 -95.31148 -89.17106 6.14042 2.76442 -88.08046 1160.01709
8125.0000 -96.16009 -91.05515 5.10494 2.60439 -89.98328 1062.04149
8130.0000 -95.70769 -90.54627 5.16141 2.52228 -90.95961 944.52846
8135.0000 -95.88670 -90.61988 5.26681 2.59488 -90.09632 1039.02899
8140.0000 -94.28076 -87.67852 6.60224 2.68781 -88.99134 1091.22428
8145.0000 -94.22009 -88.37457 5.84552 2.75421 -88.20191 1122.19579
8150.0000 -94.67307 -88.90337 5.76970 2.70381 -88.80110 1097.30511
8155.0000 -94.70642 -88.59388 6.11254 2.66714 -89.23713 1147.71715
8160.0000 -93.63995 -88.30989 5.33006 2.70414 -88.79718 1117.75997
8165.0000 -93.53564 -87.85860 5.67704 2.79377 -87.73152 1180.86117
8170.0000 -94.71878 -89.36518 5.35359 2.69172 -88.94488 1115.46826
8175.0000 -95.43632 -90.65844 4.77788 2.66673 -89.24199 1076.74704
8180.0000 -94.31246 -87.95925 6.35321 2.64826 -89.46166 1088.59180
8185.0000 -94.88721 -87.86138 7.02583 2.74709 -88.28651 1139.09814
8190.0000 -94.81901 -87.90627 6.91274 2.79700 -87.69311 1231.89300
8195.0000 -94.52223 -89.21872 5.30351 2.70829 -88.74785 1085.06353
8200.0000 -96.77600 -91.02682 5.74917 2.61214 -89.89115 1055.52836
8205.0000 -96.21037 -90.46263 5.74774 2.54677 -90.66844 998.68399
8210.0000 -94.74407 -89.88810 4.85597 2.60559 -89.96898 1023.98083
8215.0000 -94.59588 -90.38903 4.20684 2.58650 -90.19595 1023.66215
8220.0000 -95.07975 -89.97677 5.10298 2.62907 -89.68985 1068.84970
8225.0000 -95.34635 -89.29071 6.05564 2.62079 -89.78834 1089.36349
8230.0000 -94.89548 -89.14684 5.74864 2.67570 -89.13542 1069.86701
8235.0000 -95.61302 -88.71881 6.89422 2.74216 -88.34519 1142.29294
8240.0000 -95.77808 -89.10200 6.67607 2.74588 -88.30095 1200.75636
8245.0000 -94.45724 -88.75101 5.70623 2.68064 -89.07663 1063.78103
8250.0000 -95.31494 -88.65403 6.66091 2.71457 -88.67319 1128.84685
MELTING PROCESS: loop number 34 T-loop= 1152.0000000000000
main_MD> interactions number 34 at Temperature= 1152.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.58574 0.12112 1.00120
force_rgl> df(natom) -2.89486 3.05524 2.09670
8255.0000 -95.27506 -89.73644 5.53863 2.68639 -89.00824 1141.08930
8260.0000 -94.29980 -89.11263 5.18717 2.67829 -89.10461 1095.71011
8265.0000 -93.06693 -87.78841 5.27852 2.69101 -88.95340 1109.63760
8270.0000 -94.34931 -88.67774 5.67156 2.77574 -87.94585 1178.09593
8275.0000 -94.77089 -89.62371 5.14718 2.67097 -89.19163 1087.77966
8280.0000 -94.21530 -88.08820 6.12710 2.71000 -88.72749 1093.07802
8285.0000 -93.89347 -87.64021 6.25326 2.78782 -87.80222 1188.64586
8290.0000 -93.48949 -87.39040 6.09909 2.85072 -87.05431 1223.12589
8295.0000 -92.52265 -86.04957 6.47307 2.87399 -86.77764 1196.90669
8300.0000 -93.40273 -86.40248 7.00025 2.93075 -86.10276 1314.33167
8305.0000 -91.82038 -85.98054 5.83984 2.87572 -86.75714 1249.99179
8310.0000 -93.80277 -88.50862 5.29415 2.85148 -87.04530 1259.08412
8315.0000 -93.10647 -86.64806 6.45841 2.81161 -87.51939 1212.08572
8320.0000 -94.63431 -88.08667 6.54765 2.87821 -86.72756 1242.69615
8325.0000 -95.07675 -88.91854 6.15821 2.65227 -89.41393 1056.25311
8330.0000 -94.04146 -87.92748 6.11399 2.73402 -88.44190 1148.15756
8335.0000 -92.02382 -86.92854 5.09529 2.85726 -86.97655 1223.22081
8340.0000 -93.81073 -88.20604 5.60468 2.86021 -86.94153 1192.30536
8345.0000 -94.35082 -87.26922 7.08160 2.75980 -88.13542 1120.17858
8350.0000 -92.47505 -86.43387 6.04118 2.85608 -86.99069 1213.16313
8355.0000 -93.26647 -86.37458 6.89189 2.91498 -86.29033 1293.22673
8360.0000 -93.82188 -88.16806 5.65381 2.78718 -87.80988 1175.19050
8365.0000 -93.89386 -88.71853 5.17533 2.72750 -88.51948 1076.12854
8370.0000 -95.37786 -88.69141 6.68644 2.72274 -88.57602 1123.94954
8375.0000 -95.09962 -89.41588 5.68374 2.68544 -89.01955 1063.54147
8380.0000 -94.88855 -88.50451 6.38404 2.70677 -88.76593 1102.06063
8385.0000 -95.10656 -88.37891 6.72765 2.78538 -87.83130 1206.64709
8390.0000 -94.28880 -87.38633 6.90246 2.82950 -87.30673 1265.33639
8395.0000 -94.84022 -89.72061 5.11961 2.76222 -88.10665 1196.82067
8400.0000 -93.70424 -89.09020 4.61404 2.72914 -88.50003 1128.50857
8405.0000 -95.20440 -88.09482 7.10959 2.69589 -88.89527 1108.42356
8410.0000 -94.22433 -88.44073 5.78360 2.67190 -89.18052 1076.82024
8415.0000 -94.92804 -88.91788 6.01016 2.71084 -88.71754 1136.82416
8420.0000 -93.33221 -88.13753 5.19468 2.79321 -87.73815 1217.17876
8425.0000 -96.95532 -89.87979 7.07554 2.70117 -88.83258 1126.28527
8430.0000 -93.36787 -87.27987 6.08799 2.61549 -89.85125 1053.30963
8435.0000 -93.36823 -86.29640 7.07183 2.89801 -86.49213 1252.73556
8440.0000 -91.84609 -85.59553 6.25056 2.89303 -86.55130 1268.51557
8445.0000 -93.76535 -87.17513 6.59021 2.93910 -86.00350 1333.85704
8450.0000 -94.55116 -87.94935 6.60181 2.79095 -87.76507 1201.33256
8455.0000 -95.54749 -90.47995 5.06754 2.65975 -89.32502 1078.37029
8460.0000 -94.15106 -89.15096 5.00010 2.65785 -89.34762 1072.53995
8465.0000 -94.24359 -88.74788 5.49570 2.65758 -89.35084 1069.09380
8470.0000 -95.08076 -88.57833 6.50243 2.68736 -88.99678 1103.78912
8475.0000 -94.96332 -89.30347 5.65985 2.71147 -88.71010 1155.94045
8480.0000 -95.17417 -89.06181 6.11236 2.68570 -89.01648 1106.90769
8485.0000 -94.59585 -87.62620 6.96965 2.72575 -88.54030 1132.78417
8490.0000 -92.94193 -86.24660 6.69533 2.92847 -86.12985 1290.28038
8495.0000 -94.72914 -88.39728 6.33186 2.82335 -87.37981 1175.30475
8500.0000 -94.44510 -88.31574 6.12936 2.78375 -87.85064 1186.63767
MELTING PROCESS: loop number 35 T-loop= 1177.0000000000000
main_MD> interactions number 35 at Temperature= 1177.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.54515 2.39191 1.74613
force_rgl> df(natom) -0.27861 0.62931 3.91607
8505.0000 -94.07284 -87.62104 6.45180 2.79042 -87.77140 1239.30639
8510.0000 -93.97077 -87.19371 6.77706 2.81142 -87.52162 1220.02228
8515.0000 -95.37528 -88.25439 7.12088 2.76325 -88.09434 1158.09153
8520.0000 -93.82681 -86.79135 7.03547 2.84044 -87.17657 1281.91729
8525.0000 -92.78909 -84.72829 8.06080 3.02228 -85.01454 1392.64953
8530.0000 -93.24268 -86.28531 6.95737 2.95749 -85.78490 1323.16671
8535.0000 -94.48874 -88.19050 6.29824 2.76631 -88.05803 1145.66340
8540.0000 -93.49312 -87.44619 6.04693 2.81147 -87.52111 1158.95017
8545.0000 -92.57261 -84.96754 7.60506 2.94060 -85.98562 1291.05428
8550.0000 -92.89832 -86.18472 6.71360 2.96565 -85.68779 1278.47541
8555.0000 -91.86843 -85.89952 5.96891 3.01554 -85.09460 1284.63837
8560.0000 -93.49140 -87.06722 6.42418 2.84275 -87.14914 1235.97041
8565.0000 -94.02808 -87.25117 6.77691 2.82534 -87.35608 1231.57914
8570.0000 -92.32188 -86.02314 6.29874 2.81069 -87.53035 1185.88822
8575.0000 -91.17559 -85.38941 5.78618 2.87737 -86.73754 1265.37198
8580.0000 -93.76544 -88.16858 5.59686 2.84525 -87.11945 1166.60266
8585.0000 -92.31289 -86.12602 6.18687 2.82055 -87.41314 1138.70261
8590.0000 -95.10074 -89.42717 5.67357 2.79996 -87.65791 1169.97845
8595.0000 -94.17743 -88.26018 5.91725 2.68735 -88.99685 1097.63367
8600.0000 -94.36018 -87.17950 7.18068 2.84634 -87.10645 1237.53844
8605.0000 -93.56976 -86.75598 6.81379 2.78561 -87.82851 1173.86326
8610.0000 -95.20392 -88.66489 6.53903 2.82019 -87.41736 1260.70602
8615.0000 -95.71733 -90.12822 5.58911 2.72467 -88.55318 1174.31636
8620.0000 -94.66685 -89.61894 5.04791 2.57741 -90.30408 1032.03473
8625.0000 -94.58282 -88.17318 6.40964 2.70289 -88.81206 1099.63387
8630.0000 -94.42099 -88.27996 6.14103 2.77143 -87.99712 1186.51707
8635.0000 -93.67213 -86.37586 7.29627 2.83002 -87.30048 1236.18911
8640.0000 -94.48087 -88.51419 5.96668 2.77763 -87.92343 1166.02559
8645.0000 -95.42246 -88.74777 6.67469 2.68605 -89.01231 1101.93111
8650.0000 -94.30864 -87.45741 6.85123 2.72375 -88.56406 1114.66476
8655.0000 -94.27702 -87.10186 7.17516 2.83345 -87.25974 1222.46583
8660.0000 -93.56537 -86.80161 6.76376 2.83700 -87.21753 1229.16694
8665.0000 -94.97434 -89.78307 5.19127 2.73874 -88.38586 1106.09218
8670.0000 -94.57515 -88.34438 6.23077 2.73017 -88.48770 1144.09459
8675.0000 -94.10652 -87.68596 6.42056 2.74477 -88.31407 1141.54785
8680.0000 -93.27783 -86.12670 7.15114 2.85446 -87.00995 1243.04040
8685.0000 -93.89976 -88.26930 5.63046 2.92290 -86.19614 1306.86078
8690.0000 -94.70440 -88.57598 6.12842 2.75850 -88.15086 1184.98140
8695.0000 -95.71497 -90.37653 5.33843 2.68707 -89.00022 1122.96259
8700.0000 -93.38938 -86.98956 6.39982 2.76526 -88.07054 1211.00824
8705.0000 -93.65606 -87.33127 6.32479 2.84297 -87.14649 1237.64154
8710.0000 -93.64621 -86.95872 6.68749 2.85063 -87.05540 1242.08299
8715.0000 -95.29076 -89.42081 5.86995 2.76695 -88.05037 1191.68484
8720.0000 -93.40018 -88.09412 5.30606 2.63683 -89.59755 1063.76278
8725.0000 -93.84904 -86.82145 7.02759 2.88707 -86.62213 1301.44921
8730.0000 -90.97456 -85.52274 5.45182 2.89178 -86.56612 1266.76266
8735.0000 -92.67286 -85.70130 6.97156 2.88251 -86.67632 1229.04558
8740.0000 -91.90203 -86.78828 5.11376 2.89698 -86.50433 1307.10882
8745.0000 -93.11450 -86.71663 6.39787 2.81414 -87.48927 1177.28656
8750.0000 -94.62968 -87.75728 6.87239 2.86447 -86.89093 1245.57650
main_MD> EXECUTION TIME: 0 [day], 0 [hour], 7 [min], 23.0091581 [s].
main_MD> Deallocating global variables
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