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nanoparticlesims/growth_Melting_Silver_ICO_3269/meltingSims/run_48/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_48.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 = 48 ntipo2 = 0
read_input> Finish reading input
main_MD> Allocating global variables
main_MD> Number of outputs that will be created: 1800
main_MD> Size of nv and nvoiz: 48 4800
main_MD> Size of nv and nvoiz: 48 4800
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 = 48
main_MD> Consider changing parameter nsiz in module_parameters.f90 for performance
main_MD> collvar_wanted = F
main_MD> INPUT AND POTENTIAL FILE READING IS DONE
main_MD> THERMALIZATION IS STARTING
init> -2.0063130891128839E-002 -1.2212685546787819E-002 -1.8621404329330460E-002 initial drift of cluster / NP1 for coalescence
init> 0.30435104968986321 0.30959831231719942 0.29764809298004619 scaling for velocity /for coalescence NP1
init.f90 > facguy = 1.8440539439750602E-003
preparo> IN BIGVOI : LIMIT 1.2247448652052084 1.2247448652052084 1.2247448652052084
preparo> END t=0 TIME STEP
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.72241 -0.08837 1.68114
force_rgl> df(natom) -2.31395 0.47035 -0.32811
preparo> THERMALIZATION PROCESS AT 293.16322479879943
preparo> TOTAL ENERGY, KINETIC EN., POT. ENERGY, DELTA
5000 -118.33709794839550 1.6875081223937580 -120.02460607078925 3.8182736275315266E-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 36
MELTING PROCESS: loop number 1 T-loop= 320.00000000000000
main_MD> interactions number 1 at Temperature= 320.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.06217 0.24958 0.67899
force_rgl> df(natom) -0.28483 0.68910 -0.50507
5.0000 -120.36456 -118.08157 2.28299 1.77710 -118.12864 361.33297
10.0000 -120.21949 -118.37592 1.84357 1.76034 -118.34996 340.33815
15.0000 -120.75145 -118.34306 2.40839 1.74983 -118.48873 337.21838
20.0000 -120.34371 -118.43384 1.90987 1.75846 -118.37483 345.01875
25.0000 -120.71421 -118.96828 1.74593 1.72850 -118.77052 308.61991
30.0000 -120.62982 -118.43315 2.19668 1.75071 -118.47719 328.22434
35.0000 -120.33144 -118.13319 2.19825 1.77721 -118.12714 356.10230
40.0000 -120.78343 -118.50423 2.27920 1.73973 -118.62220 322.93011
45.0000 -120.58278 -118.68191 1.90087 1.73517 -118.68236 320.24011
50.0000 -120.78718 -118.45755 2.32963 1.73265 -118.71563 314.78621
55.0000 -120.51246 -118.41608 2.09638 1.75050 -118.47989 336.92771
60.0000 -120.43152 -118.66629 1.76522 1.74508 -118.55151 330.09708
65.0000 -120.95591 -118.98659 1.96932 1.72252 -118.84940 310.09969
70.0000 -120.74776 -118.55815 2.18961 1.73137 -118.73259 326.15759
75.0000 -120.44676 -118.43738 2.00937 1.74403 -118.56537 328.52738
80.0000 -121.12069 -119.09949 2.02120 1.72679 -118.79307 308.79332
85.0000 -120.79251 -119.05889 1.73362 1.71266 -118.97964 298.44372
90.0000 -120.62272 -118.35964 2.26308 1.72617 -118.80128 310.99817
95.0000 -120.83959 -118.99767 1.84192 1.73979 -118.62137 322.56808
100.0000 -120.20299 -118.06002 2.14298 1.74489 -118.55405 326.41412
105.0000 -120.66387 -117.81459 2.84929 1.79229 -117.92796 366.07115
110.0000 -120.33025 -118.03823 2.29202 1.76510 -118.28712 349.00935
115.0000 -120.81207 -118.65745 2.15462 1.75109 -118.47214 334.06189
120.0000 -120.41265 -118.54031 1.87234 1.73884 -118.63389 324.21392
125.0000 -121.38648 -119.05376 2.33272 1.72451 -118.82320 312.14819
130.0000 -120.58909 -118.84237 1.74673 1.73434 -118.69338 312.75197
135.0000 -120.46002 -118.72912 1.73090 1.72842 -118.77150 317.61854
140.0000 -120.47040 -118.36295 2.10745 1.75811 -118.37946 341.79282
145.0000 -120.68841 -118.79846 1.88995 1.73398 -118.69815 319.63831
150.0000 -120.72171 -118.88064 1.84107 1.72437 -118.82507 303.75610
155.0000 -120.63236 -118.57515 2.05721 1.73471 -118.68844 317.25643
160.0000 -120.67211 -118.63380 2.03830 1.70630 -119.06364 290.31820
165.0000 -120.80605 -118.46896 2.33709 1.75417 -118.43149 333.32765
170.0000 -120.56873 -118.54214 2.02658 1.75846 -118.37477 342.60103
175.0000 -120.97345 -119.08634 1.88711 1.73072 -118.74110 314.40328
180.0000 -120.28385 -118.37851 1.90534 1.73223 -118.72126 321.32433
185.0000 -120.84076 -118.77851 2.06225 1.76760 -118.25411 351.65493
190.0000 -120.86735 -119.02442 1.84293 1.72784 -118.77914 322.67503
195.0000 -120.83167 -118.93308 1.89859 1.71020 -119.01221 291.98756
200.0000 -120.61382 -118.62613 1.98768 1.72252 -118.84941 311.49395
205.0000 -120.65938 -119.03018 1.62920 1.72551 -118.81001 317.77623
210.0000 -120.53151 -118.53657 1.99494 1.72582 -118.80587 308.32832
215.0000 -120.15980 -117.99382 2.16598 1.76044 -118.34857 345.99704
220.0000 -120.80331 -119.01033 1.79298 1.73303 -118.71069 326.46012
225.0000 -120.91954 -118.78166 2.13787 1.72175 -118.85968 306.18200
230.0000 -120.59852 -118.69592 1.90259 1.72141 -118.86407 314.32804
235.0000 -120.52554 -118.35122 2.17432 1.76303 -118.31437 348.98405
240.0000 -120.80648 -118.68611 2.12037 1.73720 -118.65563 321.90786
245.0000 -120.44454 -118.61579 1.82875 1.72924 -118.76072 312.70542
250.0000 -120.84904 -119.03291 1.81614 1.72349 -118.83661 299.29219
MELTING PROCESS: loop number 2 T-loop= 345.00000000000000
main_MD> interactions number 2 at Temperature= 345.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.90976 1.04564 2.37623
force_rgl> df(natom) 1.19038 -0.36114 -0.91417
255.0000 -120.78848 -118.51080 2.27768 1.72361 -118.83511 312.28256
260.0000 -120.46514 -117.73803 2.72711 1.77986 -118.09211 368.37744
265.0000 -120.37515 -118.11789 2.25727 1.79400 -117.90537 390.34533
270.0000 -120.06418 -117.93071 2.13347 1.77825 -118.11343 365.68308
275.0000 -120.53975 -118.75223 1.78752 1.75889 -118.36915 340.03697
280.0000 -120.86929 -118.92176 1.94753 1.72657 -118.79602 309.65504
285.0000 -120.49222 -118.26149 2.23073 1.74151 -118.59864 321.68664
290.0000 -120.79815 -118.78322 2.01493 1.73913 -118.63007 317.99747
295.0000 -120.48513 -118.51789 1.96724 1.74177 -118.59522 316.36638
300.0000 -120.37346 -118.55263 1.82083 1.74916 -118.49757 319.81777
305.0000 -120.40646 -118.23843 2.16803 1.76445 -118.29562 338.76475
310.0000 -120.58207 -117.89415 2.68792 1.76683 -118.26425 340.72645
315.0000 -120.34093 -118.13513 2.20580 1.78662 -118.00278 367.93699
320.0000 -120.15146 -117.53748 2.61398 1.80165 -117.80428 383.67879
325.0000 -120.19011 -118.02777 2.16234 1.80949 -117.70072 392.46064
330.0000 -120.60010 -118.00911 2.59100 1.78502 -118.02397 367.13614
335.0000 -120.52156 -118.36778 2.15378 1.77031 -118.21829 355.20075
340.0000 -120.51258 -118.19026 2.32232 1.76831 -118.24465 352.12385
345.0000 -120.45684 -118.65062 1.80622 1.76396 -118.30207 347.09025
350.0000 -120.94886 -118.79679 2.15207 1.72595 -118.80412 310.69847
355.0000 -120.41407 -118.09919 2.31488 1.75484 -118.42256 342.84231
360.0000 -120.30754 -118.23285 2.07469 1.77265 -118.18736 354.54377
365.0000 -120.51559 -118.50156 2.01403 1.78479 -118.02704 363.41439
370.0000 -120.67467 -118.59071 2.08395 1.74261 -118.58407 320.45236
375.0000 -120.26757 -118.25144 2.01613 1.77313 -118.18097 360.05316
380.0000 -119.99527 -117.56376 2.43151 1.80560 -117.75210 386.77650
385.0000 -120.47655 -118.12164 2.35491 1.78426 -118.03406 370.46529
390.0000 -120.39958 -118.15499 2.24459 1.78659 -118.00328 378.08046
395.0000 -120.54348 -118.19645 2.34703 1.78286 -118.05254 367.84176
400.0000 -120.44789 -118.36476 2.08313 1.78147 -118.07080 363.87770
405.0000 -120.09633 -117.98501 2.11133 1.78408 -118.03637 363.64199
410.0000 -120.23061 -118.32524 1.90537 1.79368 -117.90960 374.90818
415.0000 -120.92872 -118.47257 2.45615 1.74701 -118.52605 332.14084
420.0000 -120.81398 -118.79078 2.02320 1.75722 -118.39109 338.44819
425.0000 -120.76541 -118.66590 2.09950 1.73839 -118.63985 315.21675
430.0000 -120.14608 -118.12832 2.01776 1.75561 -118.41237 337.71404
435.0000 -120.65021 -118.75335 1.89686 1.75375 -118.43694 341.60211
440.0000 -120.49255 -118.61173 1.88083 1.74217 -118.58995 320.15798
445.0000 -120.37744 -118.44719 1.93025 1.76169 -118.33209 338.53809
450.0000 -121.08171 -118.88488 2.19683 1.72852 -118.77022 306.49309
455.0000 -120.58728 -118.76983 1.81744 1.73750 -118.65160 315.93884
460.0000 -120.18809 -118.19839 1.98970 1.77074 -118.21257 361.69819
465.0000 -120.57772 -118.36626 2.21146 1.74215 -118.59019 326.76461
470.0000 -120.47585 -118.12890 2.34695 1.76292 -118.31587 344.25275
475.0000 -120.30983 -117.53602 2.77381 1.79847 -117.84638 380.59303
480.0000 -120.34338 -118.54934 1.79404 1.78631 -118.00693 367.76655
485.0000 -120.59084 -118.71981 1.87102 1.73065 -118.74210 310.17395
490.0000 -120.36567 -118.80687 1.55880 1.72281 -118.84559 305.59913
495.0000 -120.65924 -118.60518 2.05406 1.72348 -118.83683 304.33085
500.0000 -120.21191 -118.43697 1.77494 1.75458 -118.42606 339.14582
MELTING PROCESS: loop number 3 T-loop= 370.00000000000000
main_MD> interactions number 3 at Temperature= 370.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.18931 1.23698 -0.48298
force_rgl> df(natom) 0.97464 0.75950 -1.33108
505.0000 -121.05525 -118.72130 2.33394 1.75806 -118.38002 333.40021
510.0000 -120.40214 -118.35191 2.05022 1.74079 -118.60816 321.74610
515.0000 -120.80564 -118.69376 2.11188 1.78061 -118.08228 356.18443
520.0000 -120.89054 -118.88977 2.00077 1.73696 -118.65871 318.36001
525.0000 -120.43181 -118.15519 2.27663 1.75829 -118.37707 342.15808
530.0000 -120.60307 -118.43965 2.16342 1.76681 -118.26449 348.61706
535.0000 -120.64817 -118.33572 2.31245 1.75734 -118.38957 337.57793
540.0000 -120.37895 -118.31121 2.06774 1.77170 -118.19992 350.48536
545.0000 -120.55970 -118.54542 2.01428 1.73926 -118.62830 309.97902
550.0000 -119.67933 -117.62512 2.05422 1.79215 -117.92977 363.28782
555.0000 -120.58132 -118.45588 2.12544 1.79346 -117.91244 362.46983
560.0000 -120.53614 -118.44876 2.08738 1.74868 -118.50397 321.19335
565.0000 -120.22463 -117.96156 2.26307 1.76202 -118.32782 341.77280
570.0000 -120.42418 -117.94836 2.47582 1.80136 -117.80816 376.19366
575.0000 -120.22724 -117.81438 2.41286 1.78515 -118.02222 365.51842
580.0000 -120.09579 -118.03755 2.05825 1.78945 -117.96553 365.00416
585.0000 -119.70545 -117.58547 2.11998 1.79421 -117.90262 370.54931
590.0000 -120.34734 -117.86990 2.47743 1.80411 -117.77181 379.22970
595.0000 -120.30095 -118.07142 2.22953 1.78325 -118.04737 353.65299
600.0000 -120.30317 -118.60318 1.69999 1.75951 -118.36095 329.28019
605.0000 -119.92240 -117.62944 2.29296 1.76362 -118.30660 331.38444
610.0000 -120.10989 -118.09535 2.01454 1.79449 -117.89887 356.40383
615.0000 -119.76023 -117.53395 2.22628 1.81468 -117.63221 383.73138
620.0000 -120.42582 -118.04005 2.38577 1.78600 -118.01107 354.81809
625.0000 -119.92647 -117.63156 2.29491 1.80497 -117.76049 371.87902
630.0000 -119.49288 -117.07322 2.41966 1.83857 -117.31665 407.22173
635.0000 -120.39150 -117.87617 2.51534 1.81471 -117.63179 383.04436
640.0000 -120.57257 -118.58509 1.98748 1.77990 -118.09163 350.65832
645.0000 -120.11049 -118.14724 1.96325 1.75699 -118.39423 334.22641
650.0000 -120.13316 -118.14506 1.98809 1.76459 -118.29386 338.28279
655.0000 -120.51753 -118.28440 2.23314 1.77314 -118.18088 343.28601
660.0000 -120.31575 -117.99934 2.31641 1.78190 -118.06512 352.61971
665.0000 -120.43659 -118.40600 2.03059 1.77384 -118.17168 352.11363
670.0000 -120.38272 -118.00793 2.37479 1.77439 -118.16436 345.86261
675.0000 -120.62258 -118.44898 2.17359 1.77515 -118.15438 348.20190
680.0000 -119.77816 -117.38231 2.39586 1.79830 -117.84860 371.06587
685.0000 -119.89695 -117.42308 2.47388 1.83712 -117.33584 401.32975
690.0000 -119.87489 -116.94914 2.92576 1.86233 -117.00287 432.71587
695.0000 -120.51805 -118.13482 2.38323 1.81645 -117.60887 385.37393
700.0000 -120.26073 -118.12213 2.13860 1.77503 -118.15590 352.97388
705.0000 -120.35810 -118.52958 1.82852 1.79210 -117.93046 369.81564
710.0000 -120.33541 -117.92182 2.41359 1.78011 -118.08882 355.54061
715.0000 -120.23376 -117.92889 2.30487 1.80748 -117.72735 372.85540
720.0000 -120.49907 -118.12370 2.37537 1.78926 -117.96803 362.46984
725.0000 -120.18209 -118.03993 2.14216 1.80320 -117.78390 373.14171
730.0000 -120.38161 -117.89518 2.48644 1.77101 -118.20904 336.25106
735.0000 -119.87249 -117.72689 2.14559 1.80762 -117.72553 369.62355
740.0000 -119.98697 -117.27908 2.70789 1.82212 -117.53394 383.20619
745.0000 -119.55330 -117.54085 2.01246 1.84795 -117.19281 413.39332
750.0000 -119.93300 -117.14069 2.79231 1.82827 -117.45268 393.90236
MELTING PROCESS: loop number 4 T-loop= 395.00000000000000
main_MD> interactions number 4 at Temperature= 395.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.51487 -0.18005 -1.73506
force_rgl> df(natom) 0.32104 -0.67254 -2.06949
755.0000 -119.90035 -117.55244 2.34792 1.82458 -117.50146 389.16401
760.0000 -119.79905 -117.85147 1.94758 1.82103 -117.54830 387.61352
765.0000 -120.46809 -118.56425 1.90383 1.74645 -118.53341 317.31542
770.0000 -119.96380 -117.77484 2.18896 1.75987 -118.35609 332.51320
775.0000 -119.91037 -117.18213 2.72824 1.84406 -117.24417 415.13486
780.0000 -119.91030 -117.16688 2.74341 1.82418 -117.50682 393.26812
785.0000 -119.66929 -116.74805 2.92124 1.87120 -116.88572 433.67277
790.0000 -120.04924 -117.69828 2.35096 1.84363 -117.24993 410.27214
795.0000 -120.06804 -118.14200 1.92604 1.80497 -117.76045 377.91835
800.0000 -119.88844 -117.29264 2.59579 1.82846 -117.45021 406.50231
805.0000 -119.94704 -117.73362 2.21342 1.81523 -117.62493 382.87760
810.0000 -119.66770 -117.16737 2.50034 1.83266 -117.39481 395.73337
815.0000 -120.08182 -117.60712 2.47471 1.81972 -117.56569 377.09097
820.0000 -119.82926 -117.37797 2.45129 1.83810 -117.32288 396.40499
825.0000 -119.89439 -117.24910 2.64529 1.84048 -117.29148 389.96198
830.0000 -120.01983 -117.67659 2.34324 1.82036 -117.55723 379.09580
835.0000 -119.77549 -116.99719 2.77830 1.85037 -117.16090 412.12892
840.0000 -119.59897 -117.25908 2.33989 1.84689 -117.20679 412.12726
845.0000 -120.01715 -117.74390 2.27326 1.80819 -117.71798 362.45802
850.0000 -120.09245 -117.63757 2.45488 1.82147 -117.54257 384.83789
855.0000 -120.19134 -117.82146 2.36987 1.81590 -117.61610 382.36144
860.0000 -119.96740 -117.63020 2.33720 1.78940 -117.96618 345.63919
865.0000 -119.77609 -116.98988 2.78621 1.82544 -117.49011 375.00207
870.0000 -119.75281 -117.01302 2.73978 1.87396 -116.84930 418.51146
875.0000 -119.11357 -116.86228 2.25129 1.87099 -116.88846 412.57858
880.0000 -119.65504 -117.26276 2.39229 1.85371 -117.11674 394.52456
885.0000 -119.58563 -117.14196 2.44367 1.86302 -116.99377 406.58566
890.0000 -119.47456 -116.88724 2.58733 1.86740 -116.93590 412.61601
895.0000 -119.47129 -117.21314 2.25815 1.85276 -117.12923 392.24352
900.0000 -119.03151 -115.98585 3.04566 1.86507 -116.96673 414.39663
905.0000 -119.02198 -116.42045 2.60153 1.91164 -116.35168 449.74188
910.0000 -119.47019 -116.90716 2.56304 1.86681 -116.94372 419.00320
915.0000 -119.74828 -116.96645 2.78183 1.87169 -116.87930 422.18076
920.0000 -119.71782 -117.25682 2.46100 1.86811 -116.92657 414.66586
925.0000 -119.30403 -116.71241 2.59162 1.86485 -116.96961 414.71639
930.0000 -119.35869 -117.07354 2.28515 1.85484 -117.10179 397.11583
935.0000 -119.17129 -117.33317 1.83812 1.84398 -117.24522 378.66859
940.0000 -119.60403 -117.27569 2.32834 1.83918 -117.30865 376.41718
945.0000 -119.71831 -116.82188 2.89644 1.86343 -116.98842 401.51902
950.0000 -119.34930 -116.61504 2.73426 1.89597 -116.55855 431.44337
955.0000 -119.72710 -117.72119 2.00591 1.83120 -117.41398 367.90962
960.0000 -119.51691 -117.54435 1.97256 1.82936 -117.43831 372.93187
965.0000 -119.60692 -117.01145 2.59547 1.85544 -117.09393 400.07764
970.0000 -119.93727 -117.29735 2.63992 1.81842 -117.58288 371.45330
975.0000 -119.71157 -117.32958 2.38198 1.82265 -117.52696 377.88165
980.0000 -119.34923 -117.05342 2.29581 1.84484 -117.23389 409.82538
985.0000 -119.97858 -117.57865 2.39994 1.84119 -117.28209 385.99757
990.0000 -119.61823 -116.69735 2.92088 1.84434 -117.24043 378.54128
995.0000 -119.28787 -116.51366 2.77421 1.88747 -116.67090 402.99582
1000.0000 -119.73389 -117.22803 2.50587 1.88367 -116.72100 430.88394
MELTING PROCESS: loop number 5 T-loop= 420.00000000000000
main_MD> interactions number 5 at Temperature= 420.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.71183 0.90414 -1.10029
force_rgl> df(natom) -1.12519 -0.96856 -0.00294
1005.0000 -119.77049 -117.34987 2.42062 1.85592 -117.08749 402.29112
1010.0000 -119.79035 -117.12323 2.66712 1.86249 -117.00079 407.01028
1015.0000 -120.09766 -117.19914 2.89853 1.83087 -117.41842 396.42062
1020.0000 -120.34296 -117.38260 2.96036 1.84933 -117.17463 430.03759
1025.0000 -119.84348 -116.97304 2.87045 1.84480 -117.23444 430.18810
1030.0000 -120.07498 -117.29651 2.77846 1.85055 -117.15854 434.76988
1035.0000 -119.94755 -117.08890 2.85865 1.82819 -117.45386 409.81429
1040.0000 -119.32786 -116.94620 2.38167 1.85464 -117.10449 424.68338
1045.0000 -120.20251 -117.30052 2.90198 1.82118 -117.54644 404.95801
1050.0000 -120.03170 -117.31548 2.71622 1.82837 -117.45145 404.85618
1055.0000 -120.05648 -117.46932 2.58717 1.84107 -117.28375 425.98884
1060.0000 -119.81508 -116.85004 2.96504 1.85468 -117.10393 433.08942
1065.0000 -119.19503 -115.97450 3.22053 1.90209 -116.47769 466.93240
1070.0000 -120.35512 -117.77236 2.58276 1.84426 -117.24160 413.20285
1075.0000 -120.08404 -117.71770 2.36634 1.80836 -117.71574 381.84242
1080.0000 -120.19554 -117.92528 2.27027 1.78065 -118.08175 349.97697
1085.0000 -119.90805 -117.49942 2.40862 1.80251 -117.79291 373.67914
1090.0000 -119.46992 -116.22896 3.24096 1.90797 -116.40003 470.60249
1095.0000 -119.80327 -116.87547 2.92780 1.87644 -116.81656 446.06541
1100.0000 -119.42268 -116.16693 3.25575 1.90288 -116.46727 470.46303
1105.0000 -119.66418 -116.88618 2.77800 1.88156 -116.74896 436.27972
1110.0000 -120.32385 -117.86959 2.45426 1.82922 -117.44025 386.42545
1115.0000 -120.16112 -117.56285 2.59828 1.79706 -117.86494 362.79348
1120.0000 -120.43763 -117.62223 2.81540 1.84416 -117.24287 420.51385
1125.0000 -119.93128 -117.58979 2.34150 1.83324 -117.38715 424.08681
1130.0000 -120.28608 -117.62236 2.66372 1.79241 -117.92634 380.00326
1135.0000 -120.01886 -116.70076 3.31810 1.83911 -117.30956 430.60349
1140.0000 -119.41752 -116.78597 2.63155 1.90615 -116.42408 489.08727
1145.0000 -119.72084 -117.58532 2.13552 1.83589 -117.35210 426.20643
1150.0000 -120.21716 -117.81106 2.40610 1.83809 -117.32303 431.66158
1155.0000 -119.93585 -117.05593 2.87992 1.83805 -117.32361 428.96556
1160.0000 -120.29333 -117.55259 2.74075 1.83265 -117.39491 418.36652
1165.0000 -120.20945 -117.92638 2.28307 1.85289 -117.12757 440.38101
1170.0000 -120.28602 -117.25743 3.02860 1.83070 -117.42060 428.86145
1175.0000 -120.38713 -117.52857 2.85856 1.83063 -117.42160 421.97628
1180.0000 -120.08485 -117.37980 2.70506 1.83924 -117.30785 431.88723
1185.0000 -120.30511 -117.36163 2.94348 1.83226 -117.40002 423.32334
1190.0000 -120.15444 -117.77868 2.37576 1.82656 -117.47537 417.88677
1195.0000 -119.79559 -117.41371 2.38188 1.82146 -117.54267 412.46641
1200.0000 -119.95490 -117.44944 2.50547 1.84455 -117.23772 434.18441
1205.0000 -120.13503 -117.89796 2.23706 1.80396 -117.77381 393.83010
1210.0000 -120.42314 -117.71219 2.71095 1.80648 -117.74054 394.36174
1215.0000 -119.98850 -117.29930 2.68920 1.82054 -117.55478 412.14555
1220.0000 -119.91216 -117.20267 2.70949 1.84634 -117.21404 425.84735
1225.0000 -119.62034 -117.18683 2.43351 1.84371 -117.24886 441.54831
1230.0000 -119.66015 -116.67426 2.98589 1.89888 -116.52016 487.66492
1235.0000 -119.56273 -117.14886 2.41387 1.86818 -116.92559 458.61660
1240.0000 -119.93790 -117.14157 2.79633 1.84463 -117.23666 437.04657
1245.0000 -120.31902 -117.66014 2.65888 1.83341 -117.38487 427.49501
1250.0000 -120.10873 -116.95741 3.15132 1.83203 -117.40303 422.97780
MELTING PROCESS: loop number 6 T-loop= 445.00000000000000
main_MD> interactions number 6 at Temperature= 445.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.44475 2.34146 0.29654
force_rgl> df(natom) -0.35559 2.32786 0.61119
1255.0000 -119.30787 -116.34103 2.96684 1.86837 -116.92314 449.31350
1260.0000 -119.45618 -116.43841 3.01778 1.90218 -116.47650 479.04882
1265.0000 -119.84680 -117.17939 2.66741 1.85889 -117.04838 414.55343
1270.0000 -120.12561 -117.20563 2.91998 1.86504 -116.96710 417.41955
1275.0000 -119.77840 -117.16716 2.61124 1.84577 -117.22162 419.49075
1280.0000 -118.99317 -116.15875 2.83442 1.86558 -116.95996 421.95576
1285.0000 -119.52104 -116.78161 2.73942 1.90086 -116.49399 479.42213
1290.0000 -119.55969 -116.87726 2.68243 1.88548 -116.69710 474.82500
1295.0000 -119.72812 -117.34086 2.38727 1.84646 -117.21248 433.57754
1300.0000 -119.84600 -117.50371 2.34229 1.81706 -117.60083 405.52408
1305.0000 -119.68096 -116.77843 2.90253 1.83793 -117.32521 426.59243
1310.0000 -119.31678 -116.91204 2.40474 1.88434 -116.71220 457.97095
1315.0000 -119.11228 -116.50539 2.60689 1.88630 -116.68633 454.75064
1320.0000 -120.01445 -117.64887 2.36558 1.85448 -117.10657 440.67042
1325.0000 -119.70557 -117.65234 2.05323 1.83640 -117.34538 415.47067
1330.0000 -119.72269 -117.11966 2.60302 1.83395 -117.37770 418.91778
1335.0000 -119.69702 -116.90565 2.79138 1.86595 -116.95503 443.05400
1340.0000 -119.03392 -116.08816 2.94576 1.89553 -116.56434 464.85938
1345.0000 -119.52495 -116.28827 3.23668 1.92383 -116.19058 496.41659
1350.0000 -119.07774 -115.97082 3.10692 1.90018 -116.50297 473.56145
1355.0000 -119.29223 -116.45445 2.83778 1.94171 -115.95446 513.57554
1360.0000 -119.53136 -116.01935 3.51201 1.93420 -116.05367 505.77199
1365.0000 -118.93682 -115.86217 3.07465 1.94468 -115.91527 517.35118
1370.0000 -120.00504 -116.75913 3.24591 1.88998 -116.63767 471.03540
1375.0000 -119.62874 -117.06215 2.56659 1.86481 -116.97014 441.05246
1380.0000 -119.55431 -116.66780 2.88651 1.89425 -116.58130 473.85243
1385.0000 -119.91400 -117.24830 2.66570 1.84477 -117.23475 427.69749
1390.0000 -120.32332 -118.03006 2.29326 1.81923 -117.57209 400.69861
1395.0000 -119.19391 -116.36144 2.83247 1.84034 -117.29336 420.32191
1400.0000 -120.05751 -116.79287 3.26465 1.88232 -116.73890 459.99714
1405.0000 -119.68493 -116.79323 2.89170 1.89426 -116.58117 468.19445
1410.0000 -119.48182 -116.80501 2.67681 1.86491 -116.96880 437.20637
1415.0000 -119.33587 -116.25679 3.07907 1.88823 -116.66080 460.86104
1420.0000 -119.49456 -116.60696 2.88761 1.90131 -116.48800 471.23502
1425.0000 -119.51440 -116.51479 2.99961 1.88792 -116.66495 455.96577
1430.0000 -119.42172 -116.87377 2.54795 1.88871 -116.65446 449.73323
1435.0000 -119.87140 -117.06534 2.80606 1.88976 -116.64059 428.02859
1440.0000 -119.53621 -116.84754 2.68867 1.85329 -117.12230 402.19274
1445.0000 -118.67039 -115.77971 2.89068 1.90572 -116.42975 426.34287
1450.0000 -119.06999 -116.53465 2.53534 1.93338 -116.06447 456.82415
1455.0000 -119.41027 -116.80565 2.60462 1.88430 -116.71268 421.22044
1460.0000 -119.24306 -116.20566 3.03740 1.91634 -116.28948 451.73634
1465.0000 -118.47047 -115.77090 2.69957 1.95181 -115.82106 440.77688
1470.0000 -118.77513 -116.21596 2.55917 1.94126 -115.96035 444.89637
1475.0000 -117.84017 -115.45007 2.39010 1.93091 -116.09705 446.10470
1480.0000 -118.12406 -115.96207 2.16199 1.95577 -115.76869 455.86230
1485.0000 -118.49320 -115.36286 3.13034 1.97433 -115.52360 460.80088
1490.0000 -118.17829 -115.38597 2.79231 1.98338 -115.40413 459.51671
1495.0000 -118.48020 -115.62944 2.85076 1.97857 -115.46762 476.96611
1500.0000 -119.06613 -116.11216 2.95397 1.96093 -115.70059 468.26245
MELTING PROCESS: loop number 7 T-loop= 470.00000000000000
main_MD> interactions number 7 at Temperature= 470.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.23027 -1.30663 -0.26533
force_rgl> df(natom) 0.34931 0.15199 -1.64059
1505.0000 -118.51853 -115.58834 2.93019 1.95184 -115.82070 474.37431
1510.0000 -118.65333 -114.70810 3.94522 1.98084 -115.43762 501.63122
1515.0000 -118.65994 -115.00219 3.65775 2.01201 -115.02596 524.50857
1520.0000 -118.36175 -115.43453 2.92722 1.98920 -115.32723 502.30757
1525.0000 -118.92392 -115.80162 3.12230 1.95207 -115.81757 476.54996
1530.0000 -118.70545 -116.06010 2.64535 1.95567 -115.77002 452.43581
1535.0000 -118.81521 -115.73610 3.07911 1.94090 -115.96515 440.33161
1540.0000 -119.13001 -115.97472 3.15529 1.94928 -115.85442 456.81320
1545.0000 -119.30415 -116.40573 2.89842 1.90839 -116.39453 407.92445
1550.0000 -118.51670 -115.65976 2.85694 1.93031 -116.10498 456.35794
1555.0000 -118.75340 -115.61334 3.14007 1.94011 -115.97565 477.02640
1560.0000 -118.44604 -115.08479 3.36126 1.96762 -115.61219 498.42602
1565.0000 -118.40170 -115.82125 2.58045 1.93419 -116.05373 459.51953
1570.0000 -118.55871 -115.66998 2.88873 1.97130 -115.56367 488.29810
1575.0000 -118.11160 -114.85059 3.26101 1.96872 -115.59768 495.95840
1580.0000 -118.70160 -116.08780 2.61380 1.99710 -115.22287 513.03046
1585.0000 -118.53543 -115.11657 3.41886 1.97221 -115.55163 513.64944
1590.0000 -119.63754 -116.65301 2.98452 1.97942 -115.45645 533.51049
1595.0000 -119.61433 -116.35119 3.26314 1.91744 -116.27507 480.71106
1600.0000 -118.39386 -115.79933 2.59453 1.91057 -116.36575 463.42177
1605.0000 -119.61021 -116.22255 3.38765 1.93657 -116.02230 482.35912
1610.0000 -120.07701 -116.74534 3.33167 1.90111 -116.49068 467.45868
1615.0000 -119.63204 -117.04149 2.59054 1.85644 -117.08070 418.26346
1620.0000 -119.27077 -116.83751 2.43326 1.83027 -117.42637 389.67386
1625.0000 -119.56485 -116.87761 2.68724 1.82653 -117.47573 392.85800
1630.0000 -119.30543 -116.95908 2.34636 1.88754 -116.66992 442.56981
1635.0000 -119.19735 -116.22889 2.96846 1.89329 -116.59400 454.45816
1640.0000 -118.95764 -116.00267 2.95497 1.95937 -115.72125 495.86987
1645.0000 -119.28278 -116.34485 2.93793 1.91621 -116.29126 456.07884
1650.0000 -119.08435 -116.38948 2.69487 1.88469 -116.70751 435.93475
1655.0000 -119.96338 -117.17883 2.78456 1.86516 -116.96553 422.45699
1660.0000 -119.93974 -116.88239 3.05735 1.88476 -116.70659 462.84330
1665.0000 -119.27136 -116.98077 2.29059 1.86160 -117.01251 438.34439
1670.0000 -119.48011 -116.93951 2.54060 1.86938 -116.90972 462.61766
1675.0000 -119.19728 -116.21414 2.98315 1.87651 -116.81555 460.90374
1680.0000 -118.81365 -115.91539 2.89826 1.91121 -116.35725 487.05188
1685.0000 -119.27355 -116.60874 2.66481 1.93149 -116.08947 511.80835
1690.0000 -119.46827 -115.94878 3.51949 1.91456 -116.31303 490.18176
1695.0000 -119.70835 -116.10589 3.60246 1.90675 -116.41623 479.93816
1700.0000 -119.35183 -115.99841 3.35343 1.91283 -116.33584 502.79168
1705.0000 -119.95108 -116.98414 2.96694 1.89004 -116.63687 484.22411
1710.0000 -119.65848 -116.81933 2.83915 1.85696 -117.07387 443.42503
1715.0000 -119.21747 -116.31750 2.89997 1.90390 -116.45382 478.83894
1720.0000 -119.45795 -116.65119 2.80676 1.92928 -116.11865 500.14451
1725.0000 -119.62570 -117.40880 2.21690 1.85304 -117.12556 430.59934
1730.0000 -119.75419 -116.92284 2.83134 1.83425 -117.37379 405.82521
1735.0000 -120.03898 -117.51920 2.51978 1.82948 -117.43675 411.17676
1740.0000 -119.82984 -117.20967 2.62017 1.83607 -117.34967 415.82526
1745.0000 -119.72916 -117.48392 2.24524 1.83687 -117.33913 409.06695
1750.0000 -118.93222 -116.32173 2.61050 1.87598 -116.82267 432.23829
MELTING PROCESS: loop number 8 T-loop= 495.00000000000000
main_MD> interactions number 8 at Temperature= 495.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.51006 -1.57372 1.84500
force_rgl> df(natom) 1.29583 0.84279 0.52509
1755.0000 -119.59262 -116.66549 2.92713 1.89942 -116.51297 440.14547
1760.0000 -119.15029 -116.10552 3.04478 1.94271 -115.94122 506.54732
1765.0000 -118.57700 -115.46873 3.10827 1.96642 -115.62807 539.88833
1770.0000 -118.59184 -115.75568 2.83617 1.99556 -115.24323 550.30866
1775.0000 -119.63874 -116.52029 3.11844 1.94012 -115.97545 484.45352
1780.0000 -119.66420 -117.12823 2.53597 1.87520 -116.83293 437.30568
1785.0000 -119.30530 -116.69140 2.61390 1.85282 -117.12845 416.01142
1790.0000 -118.50960 -115.82022 2.68938 1.93572 -116.03353 468.86521
1795.0000 -119.07046 -116.27840 2.79206 1.92723 -116.14573 440.89696
1800.0000 -118.76224 -114.85141 3.91083 1.99365 -115.26842 514.05775
1805.0000 -118.51594 -114.90522 3.61072 2.02368 -114.87181 521.36289
1810.0000 -118.46860 -115.01926 3.44934 2.02601 -114.84103 506.71954
1815.0000 -118.08520 -115.04340 3.04180 2.04074 -114.64644 514.29782
1820.0000 -118.32779 -115.06498 3.26281 2.03988 -114.65781 532.48084
1825.0000 -117.30810 -113.68309 3.62501 2.05842 -114.41305 567.05549
1830.0000 -118.02782 -114.66286 3.36495 2.05760 -114.42382 565.98582
1835.0000 -118.65688 -115.05082 3.60605 2.03604 -114.70854 534.39298
1840.0000 -118.20604 -114.42477 3.78127 2.04952 -114.53052 554.61411
1845.0000 -118.88482 -116.22565 2.65918 1.95707 -115.75159 460.13031
1850.0000 -118.42266 -115.57145 2.85121 1.96410 -115.65875 473.92745
1855.0000 -119.08251 -115.83244 3.25007 1.92751 -116.14196 448.51319
1860.0000 -118.81764 -115.55929 3.25836 1.96237 -115.68155 485.11602
1865.0000 -118.30977 -115.56961 2.74016 1.94122 -115.96091 476.02936
1870.0000 -119.08777 -115.47326 3.61451 1.98676 -115.35949 508.78149
1875.0000 -117.89257 -114.92117 2.97141 2.01508 -114.98535 506.97242
1880.0000 -117.83319 -114.54428 3.28891 2.02504 -114.85381 521.57071
1885.0000 -118.28991 -115.39689 2.89301 1.99649 -115.23093 493.80840
1890.0000 -118.25093 -115.48415 2.76678 2.00660 -115.09736 501.95745
1895.0000 -118.68664 -115.88358 2.80306 1.97036 -115.57610 459.08271
1900.0000 -118.28077 -115.48531 2.79546 1.96257 -115.67897 462.85558
1905.0000 -118.79684 -115.64209 3.15475 1.96714 -115.61858 472.25264
1910.0000 -118.61651 -115.43450 3.18201 1.98340 -115.40390 494.83340
1915.0000 -118.48735 -115.69959 2.78776 1.98192 -115.42335 507.50331
1920.0000 -118.22952 -115.28749 2.94203 1.96109 -115.69846 481.48033
1925.0000 -118.65778 -115.85585 2.80193 1.96391 -115.66119 473.70745
1930.0000 -119.12698 -115.63422 3.49276 1.97402 -115.52777 484.73329
1935.0000 -119.04514 -115.89357 3.15156 1.95027 -115.84138 467.11904
1940.0000 -118.56360 -115.69911 2.86449 1.92759 -116.14097 461.10537
1945.0000 -118.23119 -115.31948 2.91172 1.95749 -115.74608 493.29002
1950.0000 -117.66489 -114.94954 2.71535 2.01636 -114.96848 512.76963
1955.0000 -117.86293 -114.68570 3.17723 2.03329 -114.74487 509.39535
1960.0000 -118.49852 -115.56600 2.93252 1.96305 -115.67265 482.35780
1965.0000 -118.80545 -115.54599 3.25946 1.99996 -115.18512 518.70710
1970.0000 -118.55424 -115.74838 2.80586 1.97111 -115.56611 481.67751
1975.0000 -118.10127 -114.65421 3.44705 2.00592 -115.10638 511.74147
1980.0000 -118.37956 -114.30081 4.07874 2.04636 -114.57223 561.77247
1985.0000 -118.78763 -115.27631 3.51132 2.01709 -114.95893 539.39082
1990.0000 -118.56616 -115.44143 3.12473 1.97366 -115.53250 485.53126
1995.0000 -118.22205 -114.91190 3.31014 2.01445 -114.99373 524.59092
2000.0000 -119.02038 -116.34801 2.67238 1.96112 -115.69804 488.43385
MELTING PROCESS: loop number 9 T-loop= 520.00000000000000
main_MD> interactions number 9 at Temperature= 520.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.26544 0.21047 0.22439
force_rgl> df(natom) 1.37877 1.59456 1.90506
2005.0000 -118.35683 -115.49301 2.86382 1.94894 -115.85898 492.26380
2010.0000 -119.28177 -115.85406 3.42771 1.94342 -115.93191 501.40234
2015.0000 -119.34231 -115.98893 3.35338 1.97998 -115.44905 532.35624
2020.0000 -119.39931 -116.56178 2.83753 1.92045 -116.23520 479.11822
2025.0000 -119.07176 -116.28631 2.78545 1.91099 -116.36015 493.58962
2030.0000 -119.54327 -116.46399 3.07928 1.92798 -116.13582 504.68922
2035.0000 -119.23342 -116.56807 2.66535 1.92893 -116.12325 510.65048
2040.0000 -118.97606 -116.59573 2.38033 1.94575 -115.90113 514.90753
2045.0000 -119.68962 -116.50701 3.18261 1.89440 -116.57936 464.97072
2050.0000 -119.51037 -116.62548 2.88489 1.90149 -116.48565 469.93403
2055.0000 -119.73582 -115.86222 3.87360 1.90789 -116.40116 482.03785
2060.0000 -119.23491 -115.71785 3.51706 1.93988 -115.97868 517.92338
2065.0000 -120.13090 -117.34508 2.78582 1.90254 -116.47178 465.51435
2070.0000 -118.50689 -115.70266 2.80423 1.89545 -116.56549 468.13430
2075.0000 -118.72395 -115.50443 3.21952 1.97319 -115.53862 551.19597
2080.0000 -119.04314 -115.61656 3.42658 1.95906 -115.72528 511.44501
2085.0000 -118.59858 -115.79689 2.80168 1.99829 -115.20710 516.54113
2090.0000 -118.52122 -115.25804 3.26318 1.96006 -115.71206 464.01129
2095.0000 -118.67373 -115.21735 3.45638 1.96883 -115.59625 484.91505
2100.0000 -119.00765 -116.11613 2.89152 1.95962 -115.71786 492.08382
2105.0000 -118.40788 -114.70307 3.70481 1.97831 -115.47107 503.37069
2110.0000 -117.97477 -114.97351 3.00126 2.04517 -114.58805 555.35735
2115.0000 -118.59245 -115.84029 2.75217 1.99905 -115.19712 512.42542
2120.0000 -118.91636 -115.45758 3.45878 1.97073 -115.57117 484.20322
2125.0000 -118.02674 -114.19702 3.82972 2.02303 -114.88035 543.09961
2130.0000 -118.93165 -116.01096 2.92069 2.02872 -114.80522 529.08404
2135.0000 -118.92040 -115.71522 3.20518 1.99051 -115.30989 517.06063
2140.0000 -118.26324 -115.34355 2.91969 1.98120 -115.43284 495.46435
2145.0000 -118.79703 -115.91317 2.88385 1.97375 -115.53122 496.24810
2150.0000 -117.53233 -114.26036 3.27198 2.03043 -114.78268 541.58859
2155.0000 -118.02973 -114.42223 3.60750 2.07412 -114.20565 582.80369
2160.0000 -118.89520 -115.27371 3.62148 2.01922 -114.93077 527.39605
2165.0000 -118.87630 -116.03914 2.83716 1.94896 -115.85873 469.82200
2170.0000 -117.98638 -115.44138 2.54500 1.95958 -115.71839 467.55739
2175.0000 -118.29551 -115.61399 2.68152 1.94677 -115.88762 462.67569
2180.0000 -118.64957 -115.80617 2.84340 1.97433 -115.52364 487.15509
2185.0000 -119.53935 -116.70424 2.83511 1.90843 -116.39401 457.55633
2190.0000 -119.25010 -116.12256 3.12754 1.90436 -116.44781 459.36836
2195.0000 -119.53824 -115.58177 3.95647 1.97860 -115.46719 512.87658
2200.0000 -118.58371 -115.13788 3.44583 1.99437 -115.25893 533.56498
2205.0000 -118.36128 -115.35510 3.00619 1.98712 -115.35465 516.97337
2210.0000 -118.55511 -115.31983 3.23528 1.98132 -115.43124 518.73322
2215.0000 -118.68930 -115.69809 2.99121 1.95262 -115.81041 492.79214
2220.0000 -118.89991 -115.87953 3.02038 1.97467 -115.51916 531.55688
2225.0000 -118.72942 -115.48827 3.24115 1.99506 -115.24983 523.23355
2230.0000 -117.90915 -114.82847 3.08068 1.99357 -115.26952 505.86874
2235.0000 -118.73809 -115.89864 2.83945 2.00373 -115.13528 514.98040
2240.0000 -118.17645 -115.44432 2.73213 1.97547 -115.50852 492.76681
2245.0000 -118.30806 -115.34286 2.96520 1.98154 -115.42839 487.90344
2250.0000 -118.71693 -115.64856 3.06837 2.01554 -114.97931 518.01773
MELTING PROCESS: loop number 10 T-loop= 545.00000000000000
main_MD> interactions number 10 at Temperature= 545.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.06787 0.11006 2.20614
force_rgl> df(natom) 0.80705 -1.15138 -1.43167
2255.0000 -118.39725 -114.67990 3.71734 2.00507 -115.11762 522.28668
2260.0000 -118.89977 -115.70733 3.19244 2.03160 -114.76718 545.23921
2265.0000 -118.21850 -115.35879 2.85971 1.96845 -115.60125 492.94752
2270.0000 -117.62273 -114.71412 2.90860 2.00468 -115.12278 521.57871
2275.0000 -118.04993 -115.14384 2.90609 2.00687 -115.09386 513.75064
2280.0000 -118.83635 -115.42968 3.40667 1.96622 -115.63075 488.16579
2285.0000 -118.45224 -115.12555 3.32669 2.00227 -115.15456 530.27964
2290.0000 -118.42288 -115.31184 3.11104 1.99194 -115.29110 509.61298
2295.0000 -118.39676 -114.61498 3.78179 2.00723 -115.08905 562.29813
2300.0000 -117.67667 -114.60149 3.07518 2.05566 -114.44942 586.92591
2305.0000 -117.75810 -114.20588 3.55221 2.07405 -114.20660 560.90425
2310.0000 -118.69919 -115.49612 3.20307 2.05129 -114.50719 555.30592
2315.0000 -118.27351 -114.60343 3.67008 2.00291 -115.14613 519.26983
2320.0000 -117.56646 -114.50857 3.05789 2.09305 -113.95557 590.09525
2325.0000 -118.33978 -114.61316 3.72662 2.06794 -114.28727 570.40536
2330.0000 -117.51997 -114.14193 3.37803 2.05050 -114.51753 546.79205
2335.0000 -117.72783 -114.16431 3.56352 2.09545 -113.92386 563.50471
2340.0000 -117.69212 -114.82107 2.87106 2.06842 -114.28094 555.61584
2345.0000 -118.24625 -115.35031 2.89594 2.01034 -115.04800 512.39993
2350.0000 -117.06047 -114.07731 2.98316 2.02623 -114.83810 526.31018
2355.0000 -118.43391 -114.58354 3.85038 2.07945 -114.13520 553.22734
2360.0000 -118.03799 -114.44789 3.59010 2.04251 -114.62309 560.37889
2365.0000 -117.40801 -114.02718 3.38083 2.05741 -114.42633 562.74765
2370.0000 -117.43578 -113.21662 4.21916 2.12144 -113.58066 639.36561
2375.0000 -117.99586 -113.96120 4.03466 2.12462 -113.53862 620.41454
2380.0000 -117.88666 -114.42580 3.46086 2.08557 -114.05441 595.81907
2385.0000 -118.23456 -115.11116 3.12340 2.04968 -114.52848 568.98391
2390.0000 -118.46611 -115.01870 3.44741 2.01141 -115.03383 540.45748
2395.0000 -118.71331 -114.98132 3.73199 2.00340 -115.13963 547.97677
2400.0000 -118.89769 -115.46023 3.43746 2.02567 -114.84552 577.77801
2405.0000 -118.29749 -115.14154 3.15595 1.98440 -115.39058 562.91602
2410.0000 -119.01517 -115.29097 3.72420 2.00325 -115.14162 574.04024
2415.0000 -118.49104 -114.75410 3.73694 1.99188 -115.29184 544.48973
2420.0000 -118.56795 -115.00890 3.55905 2.00326 -115.14150 528.31148
2425.0000 -118.20980 -114.22758 3.98222 2.07815 -114.15240 594.28204
2430.0000 -118.40259 -114.70258 3.70002 2.05320 -114.48191 561.84316
2435.0000 -118.54310 -115.06042 3.48268 2.04737 -114.55899 583.75367
2440.0000 -118.53968 -115.46105 3.07863 2.02923 -114.79846 532.22489
2445.0000 -118.42586 -114.81053 3.61533 2.01356 -115.00554 525.33772
2450.0000 -117.94357 -114.50367 3.43990 2.04985 -114.52623 564.00063
2455.0000 -118.39573 -115.61457 2.78116 2.04003 -114.65584 535.03055
2460.0000 -117.80215 -114.75767 3.04449 2.03969 -114.66032 546.26833
2465.0000 -118.48501 -114.92638 3.55863 2.00930 -115.06181 537.85375
2470.0000 -118.38029 -114.63772 3.74257 2.02886 -114.80337 547.87014
2475.0000 -117.83501 -114.29156 3.54345 2.05846 -114.41241 544.87637
2480.0000 -117.72316 -114.18385 3.53931 2.04971 -114.52799 571.07007
2485.0000 -118.85904 -116.15245 2.70660 2.00739 -115.08696 543.80351
2490.0000 -118.78385 -116.07730 2.70656 1.93174 -116.08620 482.05401
2495.0000 -118.37913 -115.11743 3.26171 1.97334 -115.53666 503.63255
2500.0000 -118.51912 -114.87412 3.64500 2.00042 -115.17908 548.47063
MELTING PROCESS: loop number 11 T-loop= 570.00000000000000
main_MD> interactions number 11 at Temperature= 570.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.73787 0.04574 -1.93352
force_rgl> df(natom) 3.79667 -4.31880 0.57401
2505.0000 -117.46409 -113.93661 3.52749 2.02862 -114.80653 559.98375
2510.0000 -117.94330 -114.30074 3.64256 2.04830 -114.54661 541.61730
2515.0000 -118.08023 -114.47250 3.60773 2.11300 -113.69209 609.98332
2520.0000 -118.31604 -115.17701 3.13904 2.00524 -115.11535 490.93240
2525.0000 -117.57326 -114.23020 3.34306 2.04500 -114.59029 548.75153
2530.0000 -116.89143 -112.37899 4.51244 2.12139 -113.58126 603.86196
2535.0000 -117.49765 -112.89284 4.60480 2.19720 -112.58008 642.43347
2540.0000 -117.61797 -113.56177 4.05620 2.14088 -113.32388 644.03188
2545.0000 -117.18696 -112.58487 4.60208 2.15355 -113.15658 611.24405
2550.0000 -117.63461 -113.82800 3.80661 2.16345 -113.02573 639.06067
2555.0000 -118.19739 -115.13604 3.06135 2.10190 -113.83868 604.11664
2560.0000 -117.92113 -114.72462 3.19651 1.99132 -115.29927 527.25806
2565.0000 -118.74834 -115.25926 3.48908 1.96819 -115.60466 500.20457
2570.0000 -118.44212 -115.34132 3.10081 2.00768 -115.08318 522.45109
2575.0000 -118.13809 -115.24339 2.89470 1.97852 -115.46834 483.91692
2580.0000 -118.14389 -114.59328 3.55060 2.04070 -114.64705 561.18641
2585.0000 -118.58431 -115.63886 2.94544 1.97896 -115.46250 504.39891
2590.0000 -119.11362 -115.95845 3.15517 1.97069 -115.57166 493.30977
2595.0000 -117.30330 -113.69275 3.61055 2.04496 -114.59075 548.22669
2600.0000 -118.08439 -114.55802 3.52637 2.09580 -113.91932 594.36209
2605.0000 -117.01792 -112.90959 4.10834 2.11051 -113.72505 592.44409
2610.0000 -118.00576 -114.01429 3.99147 2.12214 -113.57146 619.59416
2615.0000 -118.44823 -114.86825 3.57998 2.03166 -114.76641 554.73733
2620.0000 -118.09529 -114.38855 3.70674 2.03913 -114.66772 519.27182
2625.0000 -117.77848 -114.67763 3.10085 2.04296 -114.61713 567.60442
2630.0000 -118.17737 -114.89231 3.28506 2.03674 -114.69927 574.17987
2635.0000 -118.22754 -113.31727 4.91027 2.07727 -114.16406 601.76484
2640.0000 -116.74739 -113.31904 3.42835 2.14380 -113.28536 649.19224
2645.0000 -117.54695 -113.62461 3.92234 2.16418 -113.01609 639.87241
2650.0000 -117.44304 -113.90643 3.53660 2.11401 -113.67876 578.98395
2655.0000 -117.66923 -113.73174 3.93749 2.12108 -113.58540 617.26936
2660.0000 -117.56231 -114.41099 3.15132 2.07242 -114.22814 570.27958
2665.0000 -118.11987 -114.32742 3.79245 2.05518 -114.45581 571.05473
2670.0000 -118.25755 -114.23880 4.01875 2.04905 -114.53673 591.26122
2675.0000 -117.88680 -114.16166 3.72514 2.05996 -114.39267 559.09393
2680.0000 -117.78009 -114.64940 3.13069 2.05825 -114.41528 548.00057
2685.0000 -117.08462 -113.45146 3.63316 2.08398 -114.07536 567.28569
2690.0000 -117.69603 -114.14984 3.54620 2.10928 -113.74121 594.49394
2695.0000 -117.51345 -114.36292 3.15053 2.05496 -114.45874 533.24949
2700.0000 -117.54238 -114.26357 3.27881 2.04898 -114.53771 537.55226
2705.0000 -117.47756 -113.71169 3.76588 2.11964 -113.60443 604.55498
2710.0000 -118.14738 -114.21707 3.93031 2.04784 -114.55277 552.72235
2715.0000 -117.48903 -113.78961 3.69942 2.08830 -114.01836 588.19644
2720.0000 -118.00769 -114.45720 3.55049 2.07622 -114.17787 596.53586
2725.0000 -118.11929 -114.86952 3.24977 2.03516 -114.72019 557.40087
2730.0000 -117.62454 -114.74186 2.88268 1.99517 -115.24835 511.37992
2735.0000 -118.06061 -114.88401 3.17660 2.05248 -114.49144 563.46525
2740.0000 -117.67597 -113.64697 4.02899 2.08453 -114.06813 592.20743
2745.0000 -117.47268 -114.06036 3.41231 2.08990 -113.99716 606.65609
2750.0000 -117.26907 -113.64670 3.62237 2.10572 -113.78826 604.56629
MELTING PROCESS: loop number 12 T-loop= 595.00000000000000
main_MD> interactions number 12 at Temperature= 595.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.53466 0.41356 -0.15582
force_rgl> df(natom) -4.03035 2.37138 -1.84451
2755.0000 -117.32563 -113.34984 3.97579 2.11062 -113.72357 604.73713
2760.0000 -117.68322 -113.91834 3.76488 2.13579 -113.39114 623.67301
2765.0000 -118.21271 -113.67430 4.53841 2.10781 -113.76062 626.35128
2770.0000 -116.95302 -113.18083 3.77219 2.10609 -113.78339 596.96279
2775.0000 -117.47842 -112.70816 4.77026 2.12324 -113.55692 620.63193
2780.0000 -117.04687 -113.83322 3.21365 2.15408 -113.14954 626.55066
2785.0000 -116.70172 -113.35213 3.34960 2.13248 -113.43484 584.05796
2790.0000 -116.96399 -112.76185 4.20214 2.21161 -112.38976 665.80892
2795.0000 -117.64090 -113.34866 4.29224 2.15443 -113.14498 621.34085
2800.0000 -116.79884 -113.80681 2.99203 2.11677 -113.64228 610.30136
2805.0000 -117.77715 -114.23427 3.54288 2.09495 -113.93050 575.67199
2810.0000 -118.01093 -114.84530 3.16563 2.06062 -114.38396 550.46301
2815.0000 -117.52329 -113.69016 3.83313 2.04889 -114.53880 561.18282
2820.0000 -117.83480 -114.18894 3.64586 2.11622 -113.64958 595.09522
2825.0000 -116.24830 -111.89366 4.35464 2.18007 -112.80624 658.93669
2830.0000 -116.41838 -113.13710 3.28128 2.21297 -112.37173 658.10734
2835.0000 -116.10935 -112.27829 3.83106 2.17336 -112.89491 661.76463
2840.0000 -117.48427 -113.32104 4.16323 2.20001 -112.54286 692.02068
2845.0000 -118.10102 -114.35211 3.74890 2.09955 -113.86971 593.75230
2850.0000 -117.87836 -114.31910 3.55927 2.07312 -114.21882 580.66736
2855.0000 -117.88242 -114.25926 3.62316 2.06541 -114.32067 573.34945
2860.0000 -117.49447 -114.16025 3.33421 2.09899 -113.87711 607.38616
2865.0000 -117.28756 -114.13039 3.15717 2.08862 -114.01415 581.23769
2870.0000 -117.88842 -114.00898 3.87944 2.09652 -113.90975 581.71473
2875.0000 -117.06239 -113.22985 3.83255 2.11673 -113.64286 613.07249
2880.0000 -118.06388 -113.91999 4.14389 2.13023 -113.46452 624.27925
2885.0000 -118.08939 -114.02338 4.06601 2.09336 -113.95157 592.75700
2890.0000 -117.72180 -113.79446 3.92734 2.10887 -113.74671 597.24685
2895.0000 -117.55228 -114.29289 3.25939 2.08565 -114.05336 568.88551
2900.0000 -118.27184 -114.80378 3.46806 2.07058 -114.25244 571.40093
2905.0000 -116.93722 -113.54241 3.39481 2.05885 -114.40729 545.37059
2910.0000 -117.59494 -114.15595 3.43899 2.10905 -113.74427 612.24959
2915.0000 -117.40930 -114.37783 3.03147 2.07314 -114.21860 564.92616
2920.0000 -117.19733 -113.70776 3.48957 2.08212 -114.09995 589.57938
2925.0000 -117.13252 -113.60784 3.52468 2.13019 -113.46504 620.59199
2930.0000 -117.40244 -113.84785 3.55459 2.11020 -113.72907 608.03198
2935.0000 -118.16195 -114.13248 4.02947 2.07176 -114.23679 588.73114
2940.0000 -117.94264 -114.07395 3.86869 2.05396 -114.47192 561.68550
2945.0000 -116.81854 -113.47162 3.34692 2.10133 -113.84618 579.53233
2950.0000 -117.94135 -113.88960 4.05175 2.09881 -113.87949 576.35852
2955.0000 -116.93273 -113.43771 3.49502 2.11130 -113.71462 576.88513
2960.0000 -117.84543 -114.68345 3.16199 2.09276 -113.95947 573.57910
2965.0000 -117.41622 -114.29555 3.12068 2.06348 -114.34613 566.74509
2970.0000 -118.14944 -114.78615 3.36328 2.03508 -114.72124 543.55827
2975.0000 -118.15353 -114.70400 3.44952 2.04196 -114.63045 519.72261
2980.0000 -116.94823 -113.27324 3.67499 2.11994 -113.60051 592.61019
2985.0000 -116.64756 -113.01082 3.63675 2.15809 -113.09661 642.49056
2990.0000 -116.72538 -113.49728 3.22810 2.12346 -113.55398 562.24183
2995.0000 -117.27180 -112.97587 4.29593 2.17082 -112.92843 648.20815
3000.0000 -117.62736 -114.66505 2.96231 2.10435 -113.80629 609.30753
MELTING PROCESS: loop number 13 T-loop= 620.00000000000000
main_MD> interactions number 13 at Temperature= 620.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.04793 -0.56966 -2.18267
force_rgl> df(natom) 1.67949 -0.62494 -0.45045
3005.0000 -117.11776 -112.81628 4.30148 2.10053 -113.85683 618.15441
3010.0000 -117.00017 -113.28271 3.71746 2.18301 -112.76743 658.40227
3015.0000 -116.33953 -112.23510 4.10443 2.16270 -113.03563 624.25815
3020.0000 -117.12927 -112.34670 4.78257 2.23786 -112.04301 712.47573
3025.0000 -118.05402 -114.28467 3.76935 2.14270 -113.29985 596.81534
3030.0000 -117.51126 -114.12175 3.38951 2.09588 -113.91818 569.50911
3035.0000 -118.35256 -114.61382 3.73874 2.09268 -113.96055 605.67896
3040.0000 -117.03605 -112.55129 4.48476 2.10022 -113.86085 613.55576
3045.0000 -117.55593 -113.66935 3.88659 2.15156 -113.18288 628.58504
3050.0000 -117.04003 -112.92485 4.11518 2.13214 -113.43935 635.55405
3055.0000 -116.79891 -112.72689 4.07202 2.18256 -112.77332 672.49066
3060.0000 -116.10432 -111.26564 4.83868 2.21602 -112.33140 690.32502
3065.0000 -115.77788 -111.48155 4.29633 2.30219 -111.19331 745.83962
3070.0000 -117.65250 -112.73897 4.91353 2.19017 -112.67290 637.95513
3075.0000 -116.11391 -112.06091 4.05300 2.18611 -112.72644 657.55401
3080.0000 -116.56236 -111.89332 4.66903 2.23798 -112.04144 691.20193
3085.0000 -116.65773 -111.91788 4.73985 2.24483 -111.95090 707.89134
3090.0000 -116.14924 -111.42927 4.71997 2.22663 -112.19133 683.12241
3095.0000 -116.96016 -112.70774 4.25242 2.20955 -112.41692 678.29157
3100.0000 -117.52924 -112.89506 4.63418 2.14874 -113.22003 643.28954
3105.0000 -117.33787 -113.05808 4.27980 2.14144 -113.31646 630.98078
3110.0000 -118.39385 -114.07906 4.31479 2.10649 -113.77814 603.05531
3115.0000 -116.93896 -113.02680 3.91216 2.15247 -113.17076 642.83116
3120.0000 -117.27942 -112.21325 5.06617 2.18968 -112.67934 690.23367
3125.0000 -116.45326 -112.54937 3.90389 2.22739 -112.18127 693.07327
3130.0000 -116.42467 -112.99711 3.42756 2.18805 -112.70082 674.16774
3135.0000 -116.19334 -112.17991 4.01342 2.16374 -113.02199 657.86068
3140.0000 -117.19318 -113.62913 3.56405 2.20445 -112.48420 658.71751
3145.0000 -117.21946 -113.86250 3.35696 2.12889 -113.48219 582.66028
3150.0000 -117.07866 -113.63792 3.44074 2.10909 -113.74372 578.52630
3155.0000 -117.33838 -113.70290 3.63548 2.06824 -114.28330 536.99077
3160.0000 -117.29080 -113.90060 3.39020 2.10426 -113.80752 586.57612
3165.0000 -116.97216 -114.03070 2.94146 2.14232 -113.30490 649.47485
3170.0000 -117.89986 -113.82310 4.07676 2.10533 -113.79340 613.95352
3175.0000 -117.51263 -114.12653 3.38610 2.06968 -114.26430 575.78137
3180.0000 -117.04549 -114.05939 2.98610 2.08058 -114.12036 582.40239
3185.0000 -117.77950 -114.09931 3.68018 2.11846 -113.62003 623.71640
3190.0000 -117.22929 -113.70136 3.52793 2.05050 -114.51759 540.42289
3195.0000 -117.49545 -113.85914 3.63631 2.10896 -113.74552 586.84565
3200.0000 -116.77338 -112.91470 3.85868 2.12884 -113.48292 624.37154
3205.0000 -118.13807 -114.23133 3.90674 2.09634 -113.91214 595.00131
3210.0000 -117.22987 -113.39604 3.83383 2.12946 -113.47478 625.89542
3215.0000 -117.41161 -113.15627 4.25534 2.16068 -113.06232 647.72943
3220.0000 -118.11840 -114.46171 3.65669 2.13859 -113.35408 623.50736
3225.0000 -116.94846 -113.10075 3.84771 2.07778 -114.15731 564.41480
3230.0000 -117.14257 -113.61326 3.52931 2.13301 -113.42783 617.44833
3235.0000 -117.44716 -113.47755 3.96961 2.12941 -113.47543 610.64650
3240.0000 -117.44205 -112.87148 4.57057 2.18342 -112.76200 669.17720
3245.0000 -117.11554 -113.15278 3.96275 2.14417 -113.28041 608.90576
3250.0000 -117.29507 -113.57059 3.72448 2.14757 -113.23546 612.74327
MELTING PROCESS: loop number 14 T-loop= 645.00000000000000
main_MD> interactions number 14 at Temperature= 645.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.39398 2.80879 2.44108
force_rgl> df(natom) 0.05794 -2.09258 -1.55415
3255.0000 -117.05009 -113.13656 3.91353 2.13950 -113.34206 655.72179
3260.0000 -117.42010 -112.63801 4.78209 2.19785 -112.57144 682.68540
3265.0000 -117.72673 -114.34132 3.38541 2.10831 -113.75400 589.10276
3270.0000 -117.42035 -114.18189 3.23846 2.04557 -114.58275 568.40405
3275.0000 -117.46050 -113.54132 3.91918 2.08499 -114.06211 586.47318
3280.0000 -115.98331 -111.94316 4.04015 2.17341 -112.89426 658.07528
3285.0000 -116.16061 -111.95891 4.20170 2.24798 -111.90935 692.81073
3290.0000 -116.78400 -112.97160 3.81240 2.21875 -112.29533 694.22719
3295.0000 -117.36040 -113.64861 3.71178 2.13912 -113.34716 620.92398
3300.0000 -117.34715 -113.08157 4.26558 2.14298 -113.29612 612.38159
3305.0000 -117.18699 -113.55381 3.63318 2.11296 -113.69259 597.89935
3310.0000 -117.04689 -113.85073 3.19616 2.09105 -113.98196 598.19284
3315.0000 -117.44386 -113.53215 3.91172 2.10261 -113.82938 593.83781
3320.0000 -116.56015 -112.19908 4.36107 2.18535 -112.73652 689.48812
3325.0000 -117.25216 -113.28775 3.96441 2.15750 -113.10442 665.33963
3330.0000 -117.37179 -112.32248 5.04930 2.16080 -113.06082 660.53091
3335.0000 -116.30090 -111.72819 4.57271 2.22276 -112.24245 705.82233
3340.0000 -115.84027 -111.58759 4.25267 2.29063 -111.34606 743.80462
3345.0000 -116.31543 -112.13334 4.18209 2.23839 -112.03598 689.50628
3350.0000 -115.97357 -112.12159 3.85199 2.22234 -112.24797 688.13882
3355.0000 -116.22648 -113.24201 2.98447 2.19917 -112.55405 642.57633
3360.0000 -116.94537 -113.05737 3.88799 2.11185 -113.70730 584.03564
3365.0000 -116.36646 -112.17847 4.18800 2.16463 -113.01014 652.34338
3370.0000 -117.65762 -113.46811 4.18951 2.21530 -112.34094 714.80703
3375.0000 -116.97907 -112.86699 4.11208 2.09211 -113.96798 596.14477
3380.0000 -116.97498 -112.96240 4.01258 2.17972 -112.81088 652.91703
3385.0000 -117.16714 -112.78695 4.38019 2.17702 -112.84659 643.16906
3390.0000 -116.91107 -113.06863 3.84243 2.19843 -112.56384 651.18851
3395.0000 -116.25731 -112.53838 3.71893 2.19711 -112.58128 641.82802
3400.0000 -115.66533 -111.04137 4.62396 2.28401 -111.43341 725.71961
3405.0000 -117.36259 -112.48247 4.88013 2.24363 -111.96678 698.00000
3410.0000 -116.55348 -112.94406 3.60942 2.22617 -112.19743 707.46593
3415.0000 -117.30711 -113.75227 3.55485 2.11201 -113.70523 574.24049
3420.0000 -116.81427 -113.62696 3.18731 2.15322 -113.16084 639.83749
3425.0000 -117.26850 -113.50224 3.76626 2.11871 -113.61665 619.93967
3430.0000 -117.10876 -113.27253 3.83623 2.13746 -113.36905 603.13134
3435.0000 -116.42705 -112.71133 3.71572 2.14296 -113.29639 600.64437
3440.0000 -117.13725 -112.44968 4.68757 2.15618 -113.12186 626.20833
3445.0000 -118.34537 -114.49650 3.84887 2.11755 -113.63203 618.84530
3450.0000 -117.79481 -113.85726 3.93756 2.08364 -114.07983 615.81107
3455.0000 -117.02873 -112.09112 4.93762 2.18285 -112.76953 676.49543
3460.0000 -116.93919 -112.98279 3.95640 2.21956 -112.28470 701.96510
3465.0000 -117.62646 -113.32604 4.30042 2.17238 -112.90785 625.68905
3470.0000 -117.20923 -112.94987 4.25936 2.14316 -113.29373 638.85234
3475.0000 -117.19248 -113.10696 4.08551 2.17861 -112.82550 660.31261
3480.0000 -116.79495 -113.14452 3.65044 2.14362 -113.28773 625.98302
3485.0000 -116.63791 -112.17900 4.45891 2.16786 -112.96753 638.19140
3490.0000 -116.82672 -113.10546 3.72127 2.17415 -112.88447 644.16367
3495.0000 -116.85281 -112.87381 3.97900 2.17809 -112.83241 661.20542
3500.0000 -117.34405 -113.28559 4.05846 2.19474 -112.61249 663.96519
MELTING PROCESS: loop number 15 T-loop= 670.00000000000000
main_MD> interactions number 15 at Temperature= 670.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.19845 -0.95672 -1.58641
force_rgl> df(natom) 1.15519 -0.35130 -0.81772
3505.0000 -116.55345 -112.51040 4.04305 2.13916 -113.34657 642.90659
3510.0000 -117.00453 -113.15039 3.85414 2.16203 -113.04460 654.20575
3515.0000 -116.07384 -112.19532 3.87852 2.18944 -112.68248 654.32238
3520.0000 -115.61871 -111.64553 3.97318 2.24920 -111.89328 699.23465
3525.0000 -116.28320 -111.40177 4.88143 2.29266 -111.31918 733.21639
3530.0000 -117.02769 -112.88847 4.13922 2.23220 -112.11771 693.22817
3535.0000 -117.83475 -113.63994 4.19481 2.14235 -113.30446 658.51884
3540.0000 -117.45804 -113.14272 4.31532 2.11801 -113.62599 650.88433
3545.0000 -117.46456 -113.24431 4.22025 2.12816 -113.49183 624.04714
3550.0000 -116.98432 -112.88966 4.09465 2.15385 -113.15254 646.58341
3555.0000 -116.97342 -113.00296 3.97046 2.18659 -112.72010 666.97667
3560.0000 -117.07648 -113.07063 4.00585 2.16885 -112.95450 662.81814
3565.0000 -117.87959 -113.72065 4.15894 2.16424 -113.01530 651.46446
3570.0000 -116.44663 -112.82216 3.62447 2.14622 -113.25336 660.87825
3575.0000 -116.81440 -113.46765 3.34674 2.16576 -112.99521 683.44281
3580.0000 -117.30541 -113.58218 3.72323 2.14166 -113.31358 638.04152
3585.0000 -115.52406 -110.84929 4.67476 2.21349 -112.36485 675.79158
3590.0000 -115.55184 -110.96223 4.58961 2.32589 -110.88027 765.21363
3595.0000 -114.85105 -111.70313 3.14792 2.26534 -111.68002 719.06382
3600.0000 -117.30468 -114.00442 3.30026 2.21701 -112.31843 658.41890
3605.0000 -117.20380 -113.28936 3.91445 2.16678 -112.98186 656.68417
3610.0000 -117.26781 -113.57522 3.69258 2.11968 -113.60382 605.67144
3615.0000 -118.32372 -114.27018 4.05354 2.09403 -113.94268 592.69943
3620.0000 -116.26330 -112.79600 3.46730 2.12442 -113.54131 594.00583
3625.0000 -115.64347 -111.98345 3.66003 2.21268 -112.37557 656.99760
3630.0000 -115.89444 -111.90272 3.99172 2.23651 -112.06089 703.11567
3635.0000 -117.04293 -112.49653 4.54640 2.20971 -112.41475 649.96532
3640.0000 -116.57158 -111.90516 4.66642 2.23768 -112.04536 680.86375
3645.0000 -116.40453 -112.35597 4.04855 2.26384 -111.69982 678.61524
3650.0000 -116.17044 -111.68859 4.48185 2.24192 -111.98940 674.38804
3655.0000 -116.14649 -111.67194 4.47455 2.30244 -111.19007 717.89220
3660.0000 -116.95103 -112.28780 4.66322 2.24978 -111.88554 711.90281
3665.0000 -116.08152 -111.53401 4.54751 2.25685 -111.79212 709.29675
3670.0000 -114.89361 -110.40139 4.49221 2.34231 -110.66340 754.70980
3675.0000 -114.56059 -109.23038 5.33021 2.39748 -109.93481 806.51526
3680.0000 -115.79935 -111.50420 4.29515 2.36712 -110.33574 788.38956
3685.0000 -117.15362 -112.22960 4.92402 2.24931 -111.89178 685.74153
3690.0000 -116.69213 -112.05500 4.63713 2.20777 -112.44045 660.17000
3695.0000 -116.41038 -112.07819 4.33219 2.21800 -112.30531 659.52596
3700.0000 -116.84642 -113.27423 3.57218 2.18112 -112.79247 631.47513
3705.0000 -117.17967 -112.96956 4.21011 2.16971 -112.94304 641.88046
3710.0000 -116.97857 -112.90058 4.07798 2.19267 -112.63983 673.26241
3715.0000 -116.97197 -112.44291 4.52906 2.18324 -112.76441 667.46253
3720.0000 -116.54366 -112.31537 4.22829 2.19727 -112.57906 654.60406
3725.0000 -117.61824 -113.42952 4.18873 2.21566 -112.33620 693.44155
3730.0000 -116.66413 -113.25117 3.41296 2.15609 -113.12294 629.11829
3735.0000 -116.36899 -112.91929 3.44969 2.13898 -113.34897 616.78646
3740.0000 -117.00207 -113.29121 3.71085 2.15315 -113.16183 658.11816
3745.0000 -116.51614 -113.05167 3.46448 2.15405 -113.14990 675.76101
3750.0000 -117.06211 -112.90095 4.16116 2.16428 -113.01482 645.92608
MELTING PROCESS: loop number 16 T-loop= 695.00000000000000
main_MD> interactions number 16 at Temperature= 695.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -2.04477 -3.03593 -1.74569
force_rgl> df(natom) -1.29808 0.98769 -0.56540
3755.0000 -116.76419 -112.97529 3.78891 2.17395 -112.88704 632.10206
3760.0000 -115.52613 -111.86984 3.65629 2.22622 -112.19678 672.98990
3765.0000 -115.83794 -112.82701 3.01093 2.22801 -112.17311 676.38154
3770.0000 -116.59154 -112.58288 4.00866 2.19230 -112.64469 668.10574
3775.0000 -116.76134 -112.02187 4.73947 2.25106 -111.86866 699.33674
3780.0000 -116.31125 -111.67864 4.63262 2.20769 -112.44141 688.07046
3785.0000 -116.44181 -112.75635 3.68546 2.21099 -112.39786 663.90690
3790.0000 -117.86468 -113.55995 4.30474 2.14136 -113.31759 596.20995
3795.0000 -117.43442 -113.09870 4.33572 2.16426 -113.01513 648.63980
3800.0000 -116.88941 -111.48416 5.40524 2.24953 -111.88885 742.26634
3805.0000 -115.41884 -111.19573 4.22311 2.21376 -112.36131 645.66408
3810.0000 -116.23174 -111.67099 4.56075 2.30119 -111.20649 752.63408
3815.0000 -117.55191 -112.57696 4.97495 2.21909 -112.29089 711.15360
3820.0000 -117.08163 -113.11077 3.97085 2.16445 -113.01261 669.46986
3825.0000 -117.11240 -113.72624 3.38616 2.13825 -113.35864 621.99665
3830.0000 -116.65962 -112.56682 4.09280 2.14094 -113.32305 623.63883
3835.0000 -115.13687 -111.33206 3.80481 2.23368 -112.09817 672.67508
3840.0000 -116.52928 -110.70680 5.82248 2.34250 -110.66098 772.97404
3845.0000 -115.06723 -110.77002 4.29721 2.35554 -110.48865 783.43718
3850.0000 -117.17663 -112.80965 4.36698 2.24269 -111.97922 683.57683
3855.0000 -115.98962 -112.68384 3.30577 2.22877 -112.16309 660.78652
3860.0000 -116.36745 -113.04757 3.31987 2.18759 -112.70698 646.26621
3865.0000 -116.51812 -113.08205 3.43607 2.17851 -112.82690 637.54811
3870.0000 -115.82692 -111.42703 4.39989 2.23537 -112.07591 690.71031
3875.0000 -117.08451 -112.81261 4.27190 2.21882 -112.29453 677.11838
3880.0000 -116.39302 -112.47678 3.91624 2.19138 -112.65684 654.67140
3885.0000 -115.95149 -112.20621 3.74528 2.24350 -111.96844 686.37555
3890.0000 -116.19043 -112.30334 3.88710 2.18749 -112.70823 648.29877
3895.0000 -116.81518 -112.58046 4.23471 2.27167 -111.59638 748.32593
3900.0000 -116.77507 -112.26409 4.51098 2.20375 -112.49351 676.38227
3905.0000 -116.21858 -112.72787 3.49071 2.21648 -112.32533 695.61472
3910.0000 -117.20695 -113.34970 3.85724 2.19537 -112.60422 650.40976
3915.0000 -117.29355 -112.79592 4.49763 2.19613 -112.59416 680.60489
3920.0000 -116.70031 -112.14085 4.55946 2.20961 -112.41616 705.95243
3925.0000 -117.31959 -112.83433 4.48527 2.19302 -112.63530 670.18952
3930.0000 -115.91943 -110.80445 5.11498 2.27107 -111.60438 711.99403
3935.0000 -116.18074 -112.03140 4.14934 2.30151 -111.20231 759.84597
3940.0000 -117.12250 -113.58753 3.53498 2.19533 -112.60467 676.68818
3945.0000 -116.35558 -111.87152 4.48406 2.17663 -112.85176 639.79417
3950.0000 -115.47910 -110.71119 4.76791 2.27841 -111.50738 728.08150
3955.0000 -117.07090 -112.15707 4.91384 2.28291 -111.44805 743.94440
3960.0000 -116.89461 -112.97761 3.91700 2.18938 -112.68331 670.47875
3965.0000 -117.37698 -112.45032 4.92667 2.15999 -113.07148 630.92997
3970.0000 -116.63115 -112.32729 4.30386 2.20700 -112.45061 698.80082
3975.0000 -117.59736 -114.15890 3.43846 2.16319 -113.02917 657.22224
3980.0000 -117.33894 -112.70060 4.63834 2.17029 -112.93550 660.53428
3985.0000 -116.98912 -112.35167 4.63745 2.19524 -112.60596 662.03864
3990.0000 -116.62184 -111.88608 4.73575 2.23547 -112.07462 717.29652
3995.0000 -115.39144 -111.79468 3.59675 2.27667 -111.53042 756.84880
4000.0000 -116.82571 -112.58727 4.23844 2.17205 -112.91223 645.40586
MELTING PROCESS: loop number 17 T-loop= 720.00000000000000
main_MD> interactions number 17 at Temperature= 720.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.44888 1.63124 -0.68395
force_rgl> df(natom) 0.26389 -1.20573 1.32617
4005.0000 -117.82746 -113.41524 4.41222 2.17432 -112.88220 653.18933
4010.0000 -117.68442 -113.68502 3.99940 2.13936 -113.34389 642.65841
4015.0000 -116.54965 -113.03722 3.51243 2.10188 -113.83897 603.59374
4020.0000 -115.98798 -111.19939 4.78859 2.22780 -112.17582 692.41058
4025.0000 -116.00403 -111.70887 4.29516 2.27144 -111.59948 723.72887
4030.0000 -116.68548 -111.47909 5.20639 2.26776 -111.64814 740.43535
4035.0000 -115.86659 -111.38973 4.47687 2.27502 -111.55217 727.24082
4040.0000 -116.55456 -112.07895 4.47561 2.28602 -111.40697 764.58769
4045.0000 -115.31418 -110.30068 5.01350 2.29764 -111.25344 750.48854
4050.0000 -116.58546 -111.15483 5.43062 2.32499 -110.89227 794.42600
4055.0000 -116.30042 -111.67677 4.62365 2.27970 -111.49039 738.22955
4060.0000 -116.16515 -110.88840 5.27674 2.28996 -111.35493 731.36110
4065.0000 -115.62099 -111.26195 4.35905 2.31396 -111.03790 754.58992
4070.0000 -116.66346 -111.92881 4.73465 2.24950 -111.88926 703.73479
4075.0000 -117.33181 -112.08175 5.25006 2.28012 -111.48482 755.89137
4080.0000 -116.70507 -112.31772 4.38735 2.24323 -111.97208 718.60122
4085.0000 -115.48191 -112.17185 3.31006 2.19167 -112.65305 647.80737
4090.0000 -115.46960 -111.55814 3.91147 2.25812 -111.77538 689.14720
4095.0000 -117.17881 -113.22628 3.95253 2.21018 -112.40860 684.01268
4100.0000 -117.49397 -113.36220 4.13177 2.14466 -113.27399 642.42133
4105.0000 -115.34031 -110.96514 4.37517 2.25831 -111.77293 741.95061
4110.0000 -115.26063 -110.32955 4.93108 2.32925 -110.83592 755.64938
4115.0000 -114.89145 -110.56360 4.32786 2.32195 -110.93238 751.45011
4120.0000 -116.28085 -111.31822 4.96263 2.28600 -111.40720 742.53680
4125.0000 -115.33830 -111.52227 3.81603 2.29661 -111.26707 739.21032
4130.0000 -116.30253 -112.54997 3.75256 2.22164 -112.25720 673.26967
4135.0000 -115.87558 -112.11096 3.76462 2.20291 -112.50454 656.54377
4140.0000 -116.60917 -111.24976 5.35941 2.27887 -111.50130 757.88202
4145.0000 -115.95528 -111.60734 4.34794 2.26012 -111.74903 734.39952
4150.0000 -116.30401 -111.53926 4.76475 2.28363 -111.43845 726.22234
4155.0000 -115.68001 -111.60229 4.07771 2.25561 -111.80861 712.32416
4160.0000 -116.12128 -111.73895 4.38234 2.26603 -111.67099 679.76682
4165.0000 -115.83108 -111.06527 4.76581 2.29025 -111.35108 725.50085
4170.0000 -116.65319 -112.17055 4.48264 2.29083 -111.34332 751.54830
4175.0000 -115.48962 -111.63189 3.85773 2.21311 -112.36986 681.95159
4180.0000 -116.04143 -111.52677 4.51466 2.28674 -111.39736 721.99835
4185.0000 -116.40900 -110.97159 5.43742 2.24679 -111.92511 706.66736
4190.0000 -115.47257 -110.36293 5.10964 2.30785 -111.11861 754.81085
4195.0000 -115.95672 -111.08892 4.86780 2.30155 -111.20182 766.87179
4200.0000 -116.25512 -112.71498 3.54014 2.24230 -111.98440 714.22127
4205.0000 -116.85952 -112.58630 4.27323 2.15957 -113.07704 619.04375
4210.0000 -116.24012 -112.01549 4.22463 2.20234 -112.51218 656.72044
4215.0000 -116.57476 -111.79090 4.78385 2.24622 -111.93263 694.92410
4220.0000 -115.73067 -109.97933 5.75134 2.30754 -111.12269 769.22724
4225.0000 -115.14144 -109.47400 5.66744 2.41774 -109.66723 808.47816
4230.0000 -115.77437 -110.30276 5.47161 2.39363 -109.98568 820.22107
4235.0000 -115.33556 -109.62893 5.70663 2.39799 -109.92811 820.27110
4240.0000 -115.77022 -112.10932 3.66090 2.29505 -111.28766 735.32910
4245.0000 -116.37777 -111.84687 4.53090 2.21092 -112.39885 654.70145
4250.0000 -116.49545 -112.43850 4.05695 2.23096 -112.13419 694.59990
MELTING PROCESS: loop number 18 T-loop= 745.00000000000000
main_MD> interactions number 18 at Temperature= 745.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.31000 0.96199 0.24463
force_rgl> df(natom) 1.33363 -3.79238 1.08914
4255.0000 -116.29643 -111.23085 5.06558 2.26457 -111.69024 726.22261
4260.0000 -115.17422 -110.53760 4.63662 2.33294 -110.78715 746.80643
4265.0000 -116.83659 -112.18164 4.65495 2.30186 -111.19776 738.76508
4270.0000 -116.16059 -112.49749 3.66310 2.23301 -112.10699 690.40135
4275.0000 -114.71529 -110.58766 4.12762 2.25537 -111.81174 719.29079
4280.0000 -115.52667 -111.28513 4.24154 2.30276 -111.18582 749.32927
4285.0000 -114.70446 -109.73423 4.97022 2.40473 -109.83905 801.49630
4290.0000 -115.53201 -110.81812 4.71389 2.36018 -110.42740 753.46675
4295.0000 -115.77289 -111.21698 4.55591 2.34752 -110.59468 777.78281
4300.0000 -114.81273 -110.28143 4.53130 2.35220 -110.53283 783.80976
4305.0000 -116.07472 -110.96278 5.11194 2.33371 -110.77709 740.14017
4310.0000 -115.54830 -111.03058 4.51772 2.30947 -111.09716 724.81708
4315.0000 -117.33317 -112.30391 5.02926 2.27095 -111.60597 725.57506
4320.0000 -115.04781 -111.47582 3.57199 2.27286 -111.58067 725.76901
4325.0000 -116.43473 -112.57565 3.85908 2.25417 -111.82762 726.64027
4330.0000 -116.78239 -112.67756 4.10483 2.16987 -112.94101 657.25531
4335.0000 -115.71514 -111.10818 4.60696 2.28038 -111.48143 730.92496
4340.0000 -114.62801 -109.62140 5.00661 2.40062 -109.89330 818.29509
4345.0000 -116.26065 -111.46457 4.79607 2.32115 -110.94293 720.88056
4350.0000 -115.68783 -111.18135 4.50648 2.31280 -111.05325 736.03064
4355.0000 -116.11398 -111.62957 4.48441 2.26774 -111.64839 722.57136
4360.0000 -115.56570 -111.33591 4.22979 2.29058 -111.34663 752.40952
4365.0000 -116.26398 -111.27754 4.98644 2.27030 -111.61451 707.90735
4370.0000 -114.67182 -110.20166 4.47016 2.35643 -110.47690 783.67685
4375.0000 -115.90361 -111.69211 4.21150 2.28719 -111.39144 730.60560
4380.0000 -117.55139 -112.88991 4.66148 2.22951 -112.15323 695.21634
4385.0000 -116.54128 -112.11916 4.42212 2.16906 -112.95175 652.42841
4390.0000 -116.14375 -111.73379 4.40997 2.27367 -111.56999 744.91130
4395.0000 -116.25487 -112.58598 3.66888 2.21023 -112.40794 699.25988
4400.0000 -116.16693 -111.94455 4.22238 2.20375 -112.49345 664.90568
4405.0000 -117.16596 -111.98103 5.18493 2.24331 -111.97105 693.88746
4410.0000 -115.82148 -110.28790 5.53358 2.35820 -110.45353 817.39733
4415.0000 -115.94248 -111.67269 4.26979 2.34057 -110.68641 796.42045
4420.0000 -116.34110 -111.50886 4.83224 2.25467 -111.82097 724.76113
4425.0000 -115.46203 -111.58708 3.87495 2.32742 -110.86012 779.91134
4430.0000 -115.40553 -111.10098 4.30455 2.30476 -111.15944 758.89733
4435.0000 -114.87087 -109.68009 5.19077 2.34900 -110.57513 776.44755
4440.0000 -115.54712 -111.11867 4.42845 2.40329 -109.85809 798.72209
4445.0000 -115.70995 -110.51311 5.19684 2.29231 -111.32385 744.74640
4450.0000 -114.12001 -109.10427 5.01573 2.35240 -110.53019 770.77767
4455.0000 -116.20626 -111.32819 4.87807 2.32445 -110.89930 761.88847
4460.0000 -116.20034 -111.36054 4.83980 2.30129 -111.20522 761.05812
4465.0000 -116.43897 -111.16630 5.27267 2.30128 -111.20542 736.78396
4470.0000 -115.95337 -111.26334 4.69003 2.27311 -111.57736 710.34997
4475.0000 -116.79708 -111.32124 5.47584 2.27776 -111.51597 710.57675
4480.0000 -115.91124 -111.81897 4.09227 2.25737 -111.78528 721.59093
4485.0000 -115.87454 -110.47039 5.40415 2.33307 -110.78545 758.72744
4490.0000 -115.85704 -111.37651 4.48054 2.26429 -111.69397 739.83108
4495.0000 -115.25056 -111.53207 3.71850 2.32382 -110.90766 779.28424
4500.0000 -116.06762 -111.56636 4.50125 2.34343 -110.64869 790.52236
MELTING PROCESS: loop number 19 T-loop= 770.00000000000000
main_MD> interactions number 19 at Temperature= 770.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.15834 -1.55279 1.63970
force_rgl> df(natom) -2.90632 1.10882 -0.25524
4505.0000 -116.96318 -112.77569 4.18749 2.23671 -112.05822 687.65087
4510.0000 -115.99864 -109.84502 6.15362 2.30690 -111.13118 746.96366
4515.0000 -115.01563 -108.79293 6.22271 2.39948 -109.90833 830.82927
4520.0000 -115.25330 -109.46797 5.78532 2.41995 -109.63803 827.98440
4525.0000 -115.37278 -110.79769 4.57509 2.39484 -109.96967 840.48989
4530.0000 -116.02566 -110.55535 5.47031 2.34465 -110.63250 773.12903
4535.0000 -115.32870 -110.75266 4.57604 2.31653 -111.00392 764.59718
4540.0000 -114.64248 -110.35261 4.28987 2.35279 -110.52508 778.94122
4545.0000 -115.60016 -110.37462 5.22554 2.42803 -109.53127 850.00607
4550.0000 -114.25226 -109.14352 5.10874 2.38495 -110.10021 842.46663
4555.0000 -115.11883 -110.62983 4.48900 2.39967 -109.90581 823.90530
4560.0000 -115.85929 -111.69385 4.16544 2.28466 -111.42484 712.55808
4565.0000 -115.96721 -110.18184 5.78538 2.29894 -111.23632 740.48938
4570.0000 -114.93680 -110.54734 4.38945 2.36543 -110.35810 783.11066
4575.0000 -115.28932 -110.26807 5.02125 2.38714 -110.07135 823.72675
4580.0000 -114.91161 -110.64065 4.27096 2.34218 -110.66516 781.70448
4585.0000 -116.77368 -112.24941 4.52427 2.29034 -111.34980 729.33776
4590.0000 -116.14770 -111.15318 4.99453 2.26337 -111.70610 709.60619
4595.0000 -116.15804 -111.56594 4.59210 2.28225 -111.45666 745.83707
4600.0000 -116.27404 -111.67949 4.59455 2.27363 -111.57058 745.65304
4605.0000 -117.41800 -112.09854 5.31946 2.28422 -111.43070 732.58862
4610.0000 -115.95502 -111.52992 4.42510 2.25296 -111.84356 743.11470
4615.0000 -113.97446 -108.93782 5.03664 2.34002 -110.69366 782.53892
4620.0000 -115.28434 -111.00010 4.28424 2.39084 -110.02242 825.33713
4625.0000 -116.05217 -111.88235 4.16982 2.29523 -111.28528 777.82955
4630.0000 -116.04912 -110.99735 5.05177 2.29405 -111.30084 739.37041
4635.0000 -115.93243 -110.20878 5.72365 2.35435 -110.50443 797.22961
4640.0000 -115.45760 -111.44578 4.01182 2.31395 -111.03803 775.37487
4645.0000 -115.33435 -111.08387 4.25048 2.26650 -111.66475 735.18357
4650.0000 -115.23533 -110.07592 5.15941 2.36140 -110.41134 773.39249
4655.0000 -116.04125 -110.76340 5.27785 2.38058 -110.15802 773.57045
4660.0000 -116.19058 -111.62229 4.56828 2.27957 -111.49214 738.78655
4665.0000 -115.64443 -111.18817 4.45626 2.33868 -110.71141 774.52364
4670.0000 -115.85958 -111.14923 4.71035 2.29938 -111.23043 734.62774
4675.0000 -115.22904 -110.80944 4.41960 2.31814 -110.98272 775.58189
4680.0000 -114.83023 -110.44503 4.38520 2.31970 -110.96214 728.72116
4685.0000 -116.79513 -112.64941 4.14572 2.25446 -111.82373 699.93102
4690.0000 -115.46168 -111.20200 4.25968 2.24896 -111.89636 698.57272
4695.0000 -116.32656 -110.79582 5.53074 2.34119 -110.67818 785.51464
4700.0000 -114.77973 -109.17143 5.60830 2.41817 -109.66153 828.31196
4705.0000 -115.13155 -109.61296 5.51859 2.45208 -109.21366 859.50491
4710.0000 -113.10553 -108.31329 4.79224 2.47519 -108.90839 894.22282
4715.0000 -114.10744 -108.50044 5.60700 2.52025 -108.31321 892.54971
4720.0000 -115.18162 -110.60688 4.57474 2.44508 -109.30606 849.41770
4725.0000 -115.06854 -110.08591 4.98262 2.38837 -110.05508 840.53188
4730.0000 -116.16340 -112.01532 4.14809 2.29160 -111.33327 727.79994
4735.0000 -115.91976 -110.80411 5.11565 2.32409 -110.90411 767.98223
4740.0000 -115.34002 -110.95380 4.38622 2.38395 -110.11353 782.29313
4745.0000 -116.31245 -111.89408 4.41837 2.29561 -111.28027 735.97331
4750.0000 -115.65767 -110.56753 5.09014 2.35348 -110.51598 822.37751
MELTING PROCESS: loop number 20 T-loop= 795.00000000000000
main_MD> interactions number 20 at Temperature= 795.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -3.84310 -1.90152 -2.06795
force_rgl> df(natom) 4.62388 2.70806 3.83708
4755.0000 -115.32265 -109.62617 5.69648 2.39632 -109.95012 856.70451
4760.0000 -116.54230 -112.65825 3.88405 2.33745 -110.72768 799.23048
4765.0000 -117.26120 -112.99526 4.26594 2.14659 -113.24847 641.63914
4770.0000 -115.92965 -111.99252 3.93713 2.25220 -111.85364 737.96613
4775.0000 -116.29939 -111.74176 4.55762 2.23284 -112.10934 698.90430
4780.0000 -115.87681 -109.96554 5.91126 2.28089 -111.47472 728.10963
4785.0000 -115.47183 -110.51774 4.95409 2.34827 -110.58472 783.83074
4790.0000 -114.99393 -110.49589 4.49804 2.33928 -110.70352 750.22298
4795.0000 -115.39817 -111.33753 4.06064 2.31886 -110.97317 746.45409
4800.0000 -114.86386 -109.56399 5.29988 2.38720 -110.07052 803.09411
4805.0000 -113.98194 -107.73282 6.24912 2.53854 -108.07166 922.60203
4810.0000 -113.93801 -109.46865 4.46936 2.48420 -108.78935 888.81464
4815.0000 -114.71858 -109.91145 4.80712 2.39941 -109.90925 798.71500
4820.0000 -114.59546 -108.80880 5.78666 2.43742 -109.40722 831.91375
4825.0000 -114.51191 -108.98090 5.53100 2.45629 -109.15798 856.34958
4830.0000 -115.47189 -110.06921 5.40268 2.42464 -109.57611 843.77473
4835.0000 -115.20223 -109.92745 5.27478 2.37611 -110.21697 824.18610
4840.0000 -114.19276 -109.04322 5.14953 2.41805 -109.66306 854.89716
4845.0000 -114.53235 -109.23638 5.29597 2.40143 -109.88256 807.03036
4850.0000 -114.61568 -109.34922 5.26646 2.41753 -109.66994 829.40793
4855.0000 -115.25878 -110.28765 4.97113 2.40895 -109.78325 791.52012
4860.0000 -114.37854 -108.65281 5.72573 2.35444 -110.50328 788.69554
4865.0000 -114.42204 -108.45608 5.96596 2.51004 -108.44809 885.84945
4870.0000 -114.57537 -110.11238 4.46300 2.47479 -108.91365 869.67324
4875.0000 -115.25077 -111.06551 4.18526 2.36687 -110.33904 801.19842
4880.0000 -116.30821 -111.58852 4.71969 2.27400 -111.56562 758.10007
4885.0000 -116.70762 -112.06046 4.64716 2.21867 -112.29642 692.52314
4890.0000 -115.82155 -111.37081 4.45074 2.26458 -111.69013 726.09885
4895.0000 -115.32124 -110.61645 4.70479 2.31288 -111.05216 753.82851
4900.0000 -115.61064 -110.25529 5.35535 2.38113 -110.15067 797.04229
4905.0000 -114.96172 -109.75982 5.20190 2.41834 -109.65926 857.74396
4910.0000 -115.42702 -110.70220 4.72482 2.37327 -110.25453 803.48339
4915.0000 -115.93684 -110.55589 5.38095 2.40750 -109.80249 878.00585
4920.0000 -114.84838 -109.30027 5.54811 2.41070 -109.76015 852.23966
4925.0000 -115.30652 -111.09768 4.20884 2.35377 -110.51206 780.33927
4930.0000 -115.75356 -111.36455 4.38901 2.32262 -110.92346 765.78345
4935.0000 -117.42254 -112.45176 4.97078 2.26648 -111.66496 739.19960
4940.0000 -117.22939 -111.84856 5.38083 2.25901 -111.76360 728.57518
4945.0000 -115.62212 -110.35232 5.26980 2.26543 -111.67880 743.39163
4950.0000 -116.41462 -111.85430 4.56031 2.23176 -112.12350 723.41339
4955.0000 -114.72664 -110.34967 4.37697 2.35150 -110.54208 804.91709
4960.0000 -115.80336 -109.61670 6.18666 2.35515 -110.49386 776.12505
4965.0000 -116.48341 -111.11954 5.36388 2.41502 -109.70312 862.98121
4970.0000 -114.90571 -110.73347 4.17224 2.34761 -110.59351 755.88641
4975.0000 -114.68089 -109.55474 5.12616 2.40231 -109.87104 814.28860
4980.0000 -116.07222 -111.64399 4.42823 2.38816 -110.05794 806.88944
4985.0000 -114.87994 -109.52647 5.35348 2.33153 -110.80584 742.88315
4990.0000 -115.24131 -110.39230 4.84900 2.40214 -109.87326 832.48708
4995.0000 -116.04700 -110.67272 5.37428 2.37661 -110.21040 784.97189
5000.0000 -114.49444 -109.20557 5.28887 2.40191 -109.87628 801.31209
MELTING PROCESS: loop number 21 T-loop= 820.00000000000000
main_MD> interactions number 21 at Temperature= 820.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.22315 -2.78282 1.46130
force_rgl> df(natom) 1.74266 -1.95806 -1.02405
5005.0000 -114.58458 -110.82543 3.75915 2.39450 -109.97419 781.66130
5010.0000 -114.12557 -109.20755 4.91802 2.38382 -110.11514 817.95046
5015.0000 -115.13624 -110.02642 5.10982 2.41227 -109.73949 810.96803
5020.0000 -115.64839 -111.31193 4.33646 2.29472 -111.29197 761.59020
5025.0000 -116.56569 -110.91998 5.64571 2.31707 -110.99677 780.07507
5030.0000 -115.33602 -110.60480 4.73122 2.32556 -110.88463 790.74710
5035.0000 -115.64667 -110.76870 4.87797 2.36999 -110.29783 814.87208
5040.0000 -115.48978 -111.41202 4.07776 2.30633 -111.13873 748.02114
5045.0000 -115.29381 -111.53467 3.75914 2.31021 -111.08748 722.89602
5050.0000 -115.63952 -110.72947 4.91005 2.28411 -111.43209 720.48125
5055.0000 -116.39788 -111.53777 4.86011 2.33437 -110.76836 777.03703
5060.0000 -115.53348 -110.52920 5.00428 2.30453 -111.16249 758.22395
5065.0000 -114.75783 -109.29771 5.46012 2.37877 -110.18188 773.73420
5070.0000 -115.74419 -109.84597 5.89822 2.42129 -109.62026 888.73118
5075.0000 -114.77294 -110.52080 4.25214 2.41174 -109.74641 847.68543
5080.0000 -114.23683 -110.27391 3.96293 2.39156 -110.01292 804.61651
5085.0000 -114.60011 -110.66834 3.93177 2.38429 -110.10904 825.13780
5090.0000 -114.81560 -110.53110 4.28449 2.42086 -109.62598 840.85058
5095.0000 -113.63295 -108.85153 4.78142 2.46585 -109.03173 889.99989
5100.0000 -112.20078 -107.57428 4.62650 2.49464 -108.65149 905.60964
5105.0000 -114.29438 -109.53307 4.76131 2.49161 -108.69154 875.74748
5110.0000 -115.05366 -110.37445 4.67920 2.43619 -109.42349 830.18616
5115.0000 -115.31931 -111.29353 4.02577 2.34227 -110.66396 768.09697
5120.0000 -114.60746 -109.91276 4.69470 2.32638 -110.87382 750.66777
5125.0000 -113.84962 -109.81756 4.03207 2.42952 -109.51156 848.31744
5130.0000 -116.42512 -109.61123 6.81389 2.44435 -109.31580 843.47152
5135.0000 -115.50803 -110.41624 5.09179 2.35956 -110.43558 814.35996
5140.0000 -115.07762 -109.80283 5.27479 2.37283 -110.26037 822.94350
5145.0000 -115.19758 -110.11418 5.08340 2.36753 -110.33038 797.89027
5150.0000 -116.27846 -111.86923 4.40923 2.28768 -111.38499 765.74325
5155.0000 -116.04521 -110.55169 5.49352 2.29006 -111.35353 734.00755
5160.0000 -115.28882 -109.29537 5.99346 2.39600 -109.95438 815.91164
5165.0000 -113.43786 -109.04221 4.39565 2.46152 -109.08901 896.49076
5170.0000 -114.50541 -108.59146 5.91395 2.50465 -108.51927 920.32412
5175.0000 -114.44863 -110.30890 4.13974 2.45358 -109.19386 883.14333
5180.0000 -115.73363 -111.39746 4.33617 2.32732 -110.86144 754.42644
5185.0000 -113.63819 -109.32273 4.31546 2.37558 -110.22406 812.19447
5190.0000 -115.03009 -109.77518 5.25491 2.45552 -109.16825 857.77031
5195.0000 -114.91235 -110.28443 4.62792 2.42683 -109.54714 830.15481
5200.0000 -114.33687 -109.28713 5.04974 2.43929 -109.38263 848.16952
5205.0000 -114.99811 -110.30769 4.69042 2.40682 -109.81144 810.93251
5210.0000 -115.18760 -110.91900 4.26860 2.33842 -110.71485 764.49351
5215.0000 -114.79199 -110.27908 4.51291 2.36038 -110.42485 813.24055
5220.0000 -115.17073 -111.07688 4.09385 2.31667 -111.00214 766.22487
5225.0000 -115.25250 -110.27777 4.97472 2.37375 -110.24819 801.83468
5230.0000 -114.92388 -110.57704 4.34683 2.36790 -110.32548 776.80595
5235.0000 -114.62165 -110.13054 4.49111 2.41353 -109.72275 815.18134
5240.0000 -115.37891 -110.48311 4.89580 2.40777 -109.79889 815.81044
5245.0000 -113.63210 -109.60164 4.03047 2.36945 -110.30496 796.01859
5250.0000 -113.81373 -109.12187 4.69185 2.37245 -110.26535 785.91050
MELTING PROCESS: loop number 22 T-loop= 845.00000000000000
main_MD> interactions number 22 at Temperature= 845.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -5.63037 -3.12238 0.27175
force_rgl> df(natom) -0.05747 -0.61024 -4.49449
5255.0000 -113.38091 -107.99560 5.38531 2.45799 -109.13556 855.13841
5260.0000 -116.58323 -112.39845 4.18477 2.38721 -110.07039 835.90100
5265.0000 -114.83379 -110.19485 4.63894 2.30697 -111.13017 704.08538
5270.0000 -114.84201 -110.07996 4.76206 2.40609 -109.82102 818.54202
5275.0000 -115.90003 -111.01953 4.88051 2.37052 -110.29084 830.50687
5280.0000 -116.02886 -110.77222 5.25663 2.34019 -110.69139 811.00742
5285.0000 -115.17651 -110.49746 4.67905 2.36502 -110.36353 804.90885
5290.0000 -113.70968 -108.95568 4.75400 2.45974 -109.11248 844.59525
5295.0000 -114.12903 -109.52744 4.60159 2.45188 -109.21630 871.97793
5300.0000 -114.87422 -109.27823 5.59600 2.46565 -109.03435 910.43538
5305.0000 -113.91867 -108.18546 5.73321 2.48027 -108.84126 881.47195
5310.0000 -112.92771 -107.05212 5.87559 2.50955 -108.45453 882.11635
5315.0000 -113.60865 -107.98274 5.62591 2.56665 -107.70046 951.99247
5320.0000 -114.26490 -109.25266 5.01224 2.50758 -108.48060 927.87169
5325.0000 -114.89121 -110.42792 4.46329 2.43385 -109.45444 843.64121
5330.0000 -113.89967 -109.40229 4.49738 2.44420 -109.31772 841.53837
5335.0000 -113.41195 -108.14742 5.26454 2.45937 -109.11736 820.03756
5340.0000 -115.01850 -109.36152 5.65698 2.51996 -108.31704 860.68828
5345.0000 -115.68726 -111.07677 4.61048 2.36644 -110.34468 781.40886
5350.0000 -115.61494 -110.49509 5.11985 2.30992 -111.09119 750.26205
5355.0000 -114.37348 -109.12430 5.24918 2.39460 -109.97283 829.57787
5360.0000 -114.91387 -109.85948 5.05439 2.42438 -109.57949 830.39656
5365.0000 -115.38811 -110.64883 4.73928 2.40364 -109.85337 814.37740
5370.0000 -114.59012 -109.24755 5.34257 2.35604 -110.48216 779.15292
5375.0000 -115.89962 -111.26268 4.63694 2.35892 -110.44402 778.69069
5380.0000 -116.06279 -109.90316 6.15963 2.31496 -111.02464 740.64845
5385.0000 -114.97763 -109.54963 5.42799 2.39054 -110.02643 816.46493
5390.0000 -115.59419 -110.14800 5.44619 2.37809 -110.19084 795.48680
5395.0000 -113.76465 -109.66356 4.10109 2.37689 -110.20674 817.03665
5400.0000 -114.65217 -109.18439 5.46778 2.45651 -109.15510 885.11596
5405.0000 -115.68032 -111.02637 4.65394 2.36601 -110.35044 785.74987
5410.0000 -113.34368 -108.10573 5.23795 2.39732 -109.93694 818.16673
5415.0000 -112.85988 -107.89242 4.96746 2.52857 -108.20334 930.91385
5420.0000 -112.95687 -107.75266 5.20421 2.52512 -108.24894 882.56917
5425.0000 -115.39538 -109.23854 6.15684 2.48820 -108.73661 867.12187
5430.0000 -116.05297 -111.20652 4.84646 2.39218 -110.00475 839.71970
5435.0000 -114.54402 -109.05041 5.49361 2.38392 -110.11391 869.79707
5440.0000 -114.21510 -109.00427 5.21084 2.48261 -108.81038 880.46729
5445.0000 -114.07627 -109.83569 4.24058 2.42097 -109.62449 820.97599
5450.0000 -114.99301 -110.24150 4.75152 2.31778 -110.98738 730.79656
5455.0000 -113.86816 -108.44860 5.41956 2.42875 -109.52180 854.51637
5460.0000 -113.42912 -108.51092 4.91819 2.51346 -108.40301 930.93647
5465.0000 -114.40604 -107.41912 6.98692 2.54667 -107.96428 948.63566
5470.0000 -114.62020 -109.69221 4.92799 2.48959 -108.71818 869.23946
5475.0000 -114.73678 -110.02648 4.71030 2.37196 -110.27188 758.77760
5480.0000 -114.22440 -109.44618 4.77822 2.41858 -109.65608 797.58137
5485.0000 -114.63608 -109.66100 4.97508 2.42305 -109.59705 818.80249
5490.0000 -114.17864 -109.37326 4.80538 2.40391 -109.84980 813.00951
5495.0000 -114.65201 -108.41245 6.23956 2.40742 -109.80346 832.82823
5500.0000 -116.11628 -109.94247 6.17380 2.40378 -109.85161 841.02224
MELTING PROCESS: loop number 23 T-loop= 870.00000000000000
main_MD> interactions number 23 at Temperature= 870.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.34005 0.05135 0.15643
force_rgl> df(natom) 2.30098 0.02230 3.61086
5505.0000 -115.30722 -109.20493 6.10229 2.39227 -110.00361 824.07485
5510.0000 -113.94552 -108.95946 4.98605 2.43988 -109.37480 822.68744
5515.0000 -114.23591 -109.38673 4.84918 2.45233 -109.21038 870.47974
5520.0000 -114.32437 -109.56922 4.75514 2.45959 -109.11441 843.79370
5525.0000 -113.99717 -108.21994 5.77724 2.48565 -108.77020 882.95291
5530.0000 -114.73979 -108.81119 5.92860 2.48933 -108.72167 878.12519
5535.0000 -114.59703 -110.13624 4.46079 2.41415 -109.71459 833.81574
5540.0000 -114.36336 -109.22266 5.14070 2.39065 -110.02502 801.26030
5545.0000 -116.24666 -110.26293 5.98373 2.45259 -109.20684 838.48419
5550.0000 -114.83532 -109.93344 4.90188 2.41279 -109.73260 814.08657
5555.0000 -114.13692 -109.18845 4.94846 2.38892 -110.04783 772.13974
5560.0000 -114.31297 -109.44929 4.86368 2.38193 -110.14011 801.27223
5565.0000 -113.34470 -108.69121 4.65349 2.44277 -109.33654 823.25823
5570.0000 -112.79132 -107.40604 5.38528 2.54004 -108.05193 922.14181
5575.0000 -114.20088 -109.60009 4.60079 2.45244 -109.20894 829.35165
5580.0000 -114.63915 -109.75785 4.88130 2.41656 -109.68283 821.07279
5585.0000 -115.42279 -110.82037 4.60241 2.35954 -110.43590 771.38793
5590.0000 -115.63540 -110.07249 5.56291 2.35293 -110.52322 779.35975
5595.0000 -115.50065 -110.26334 5.23732 2.35702 -110.46915 823.99685
5600.0000 -114.82968 -109.76421 5.06546 2.38582 -110.08875 861.52438
5605.0000 -115.32389 -109.48953 5.83436 2.39279 -109.99677 847.07427
5610.0000 -113.05696 -108.29407 4.76289 2.45030 -109.23712 866.28960
5615.0000 -113.65960 -107.59143 6.06817 2.56509 -107.72101 926.71292
5620.0000 -114.48404 -108.23505 6.24899 2.47970 -108.84881 871.47817
5625.0000 -112.65745 -106.22593 6.43152 2.59578 -107.31572 977.24059
5630.0000 -113.99347 -107.96761 6.02586 2.56821 -107.67985 984.61051
5635.0000 -114.49364 -109.33347 5.16018 2.48183 -108.82067 882.14187
5640.0000 -114.69305 -108.83556 5.85749 2.42353 -109.59069 814.67034
5645.0000 -115.39927 -109.54064 5.85864 2.45795 -109.13615 877.40364
5650.0000 -113.50925 -107.75318 5.75607 2.47664 -108.88923 890.04448
5655.0000 -114.01475 -108.55415 5.46060 2.55318 -107.87835 938.78336
5660.0000 -113.55728 -107.82134 5.73595 2.54025 -108.04912 884.05438
5665.0000 -115.03806 -110.05773 4.98032 2.47754 -108.87732 904.24363
5670.0000 -114.50678 -108.39359 6.11319 2.45618 -109.15949 837.02891
5675.0000 -113.15271 -108.23369 4.91902 2.41987 -109.63903 850.57183
5680.0000 -114.37438 -109.43447 4.93991 2.48887 -108.72776 862.56560
5685.0000 -114.22979 -108.95531 5.27448 2.47325 -108.93406 884.83783
5690.0000 -114.54063 -108.83130 5.70933 2.46513 -109.04127 888.78549
5695.0000 -114.58338 -109.35078 5.23260 2.50101 -108.56742 899.75951
5700.0000 -115.32284 -110.07215 5.25069 2.41427 -109.71299 813.80624
5705.0000 -114.09523 -108.83510 5.26012 2.43824 -109.39645 809.96365
5710.0000 -114.21154 -107.77609 6.43544 2.54905 -107.93288 917.25457
5715.0000 -113.07352 -106.43721 6.63631 2.58395 -107.47196 961.48747
5720.0000 -114.35346 -109.03308 5.32038 2.50795 -108.47576 894.52233
5725.0000 -113.86245 -109.33979 4.52265 2.41232 -109.73880 814.47031
5730.0000 -114.23466 -109.11044 5.12423 2.47434 -108.91964 862.39067
5735.0000 -115.34845 -109.09670 6.25175 2.44443 -109.31470 844.95654
5740.0000 -114.18783 -109.81946 4.36836 2.43498 -109.43948 852.83759
5745.0000 -114.80966 -109.75516 5.05449 2.46000 -109.10905 868.87606
5750.0000 -115.88863 -111.03745 4.85118 2.32662 -110.87075 776.17609
MELTING PROCESS: loop number 24 T-loop= 895.00000000000000
main_MD> interactions number 24 at Temperature= 895.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 3.53813 0.71742 1.95721
force_rgl> df(natom) 0.74765 3.82867 -2.03887
5755.0000 -114.68074 -109.68575 4.99499 2.38735 -110.06856 830.15295
5760.0000 -115.94977 -110.82291 5.12686 2.41853 -109.65672 879.06883
5765.0000 -116.31411 -111.32610 4.98802 2.30896 -111.10396 752.81276
5770.0000 -114.30803 -109.10376 5.20427 2.41174 -109.74647 847.55616
5775.0000 -112.44732 -106.70051 5.74681 2.56706 -107.69503 925.38992
5780.0000 -113.29956 -107.81715 5.48241 2.62154 -106.97550 1000.06258
5785.0000 -113.81716 -107.00042 6.81674 2.60455 -107.19992 937.20165
5790.0000 -113.17582 -107.28704 5.88878 2.63341 -106.81862 979.12122
5795.0000 -113.35779 -106.52408 6.83371 2.62446 -106.93688 961.56508
5800.0000 -112.97311 -106.44456 6.52855 2.66189 -106.44255 990.10725
5805.0000 -113.58223 -106.71959 6.86263 2.61514 -107.06000 1013.75985
5810.0000 -114.87842 -108.96008 5.91834 2.53005 -108.18381 918.22999
5815.0000 -113.31756 -107.53479 5.78276 2.46896 -108.99063 883.23173
5820.0000 -113.67451 -108.57599 5.09852 2.47305 -108.93671 904.17812
5825.0000 -114.29747 -108.69548 5.60199 2.44767 -109.27185 870.46586
5830.0000 -112.95041 -106.48992 6.46049 2.61511 -107.06035 990.91166
5835.0000 -115.13338 -109.95736 5.17601 2.50990 -108.44995 896.09451
5840.0000 -115.12899 -109.64705 5.48194 2.44966 -109.24562 843.50026
5845.0000 -114.70541 -109.84297 4.86244 2.39805 -109.92723 809.92745
5850.0000 -114.84513 -109.27967 5.56546 2.43594 -109.42676 808.97642
5855.0000 -115.35653 -110.56411 4.79242 2.42861 -109.52367 829.67061
5860.0000 -114.80353 -110.02661 4.77691 2.39087 -110.02204 816.19725
5865.0000 -114.20020 -108.59536 5.60484 2.48072 -108.83531 875.95256
5870.0000 -113.72058 -108.55554 5.16504 2.49453 -108.65298 908.56041
5875.0000 -113.47853 -107.56780 5.91073 2.58269 -107.48858 928.59473
5880.0000 -115.29665 -109.23375 6.06290 2.45989 -109.11043 893.87475
5885.0000 -114.17354 -108.91106 5.26249 2.41592 -109.69126 826.50742
5890.0000 -114.90102 -108.63214 6.26888 2.49687 -108.62207 943.61544
5895.0000 -113.93461 -108.38603 5.54857 2.52122 -108.30042 929.53300
5900.0000 -114.03158 -108.89383 5.13775 2.48700 -108.75237 891.28264
5905.0000 -113.04094 -107.62020 5.42074 2.54562 -107.97820 932.00523
5910.0000 -113.09468 -107.76644 5.32824 2.56724 -107.69267 907.53907
5915.0000 -114.04803 -108.04336 6.00467 2.57321 -107.61381 944.44148
5920.0000 -114.25159 -109.08809 5.16350 2.48253 -108.81150 909.63300
5925.0000 -114.66867 -109.25964 5.40903 2.46983 -108.97922 885.55614
5930.0000 -115.93467 -110.27371 5.66096 2.41581 -109.69262 837.51490
5935.0000 -115.35813 -110.49877 4.85936 2.40395 -109.84939 788.59104
5940.0000 -114.85519 -109.28288 5.57231 2.37642 -110.21289 804.68958
5945.0000 -113.38338 -108.59339 4.78999 2.44913 -109.25258 858.72181
5950.0000 -114.01053 -108.74266 5.26787 2.54312 -108.01126 931.93248
5955.0000 -113.03442 -107.40861 5.62581 2.55242 -107.88835 920.80292
5960.0000 -114.05893 -108.72754 5.33139 2.57197 -107.63021 964.60119
5965.0000 -114.17607 -108.55925 5.61681 2.50616 -108.49942 888.19164
5970.0000 -115.21352 -110.27457 4.93895 2.43657 -109.41844 871.71529
5975.0000 -115.31368 -110.03407 5.27961 2.41014 -109.76754 818.09253
5980.0000 -114.46828 -109.08212 5.38616 2.44243 -109.34111 849.01015
5985.0000 -114.39405 -108.82834 5.56572 2.46953 -108.98320 859.62950
5990.0000 -114.91838 -109.08234 5.83603 2.48034 -108.84038 889.10240
5995.0000 -114.90008 -108.97640 5.92368 2.45847 -109.12920 895.48255
6000.0000 -114.73676 -108.46198 6.27478 2.50986 -108.45053 907.66094
MELTING PROCESS: loop number 25 T-loop= 920.00000000000000
main_MD> interactions number 25 at Temperature= 920.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 4.62168 2.93373 4.54819
force_rgl> df(natom) 0.08609 0.77802 1.85249
6005.0000 -113.54475 -108.21341 5.33135 2.50143 -108.56179 901.08106
6010.0000 -115.00269 -109.09414 5.90854 2.46773 -109.00696 851.52977
6015.0000 -115.71617 -110.71851 4.99766 2.41858 -109.65606 854.74637
6020.0000 -114.38409 -108.37552 6.00857 2.46649 -109.02336 848.03704
6025.0000 -113.26125 -107.24693 6.01432 2.53628 -108.10152 919.75202
6030.0000 -113.55646 -106.90736 6.64910 2.58504 -107.45760 985.82035
6035.0000 -112.97977 -107.54912 5.43064 2.56465 -107.72681 938.42065
6040.0000 -113.59762 -107.01079 6.58683 2.53852 -108.07191 874.34474
6045.0000 -113.60466 -108.56298 5.04168 2.56476 -107.72546 934.36831
6050.0000 -113.96804 -108.03416 5.93388 2.50592 -108.50259 910.96838
6055.0000 -112.71921 -107.12994 5.58927 2.55658 -107.83338 931.43526
6060.0000 -113.98222 -108.25876 5.72346 2.55454 -107.86033 921.37517
6065.0000 -113.55521 -107.55850 5.99671 2.57322 -107.61362 968.58471
6070.0000 -113.78437 -108.50806 5.27631 2.54498 -107.98660 932.08633
6075.0000 -113.77727 -108.29491 5.48235 2.52918 -108.19530 909.83275
6080.0000 -113.17226 -108.44371 4.72855 2.54501 -107.98619 928.61808
6085.0000 -114.16625 -108.51354 5.65271 2.46640 -109.02453 869.44030
6090.0000 -113.96684 -108.66256 5.30428 2.47436 -108.91938 860.94747
6095.0000 -114.10257 -108.25689 5.84568 2.51027 -108.44509 910.58835
6100.0000 -114.36201 -107.92309 6.43892 2.55529 -107.85052 934.19036
6105.0000 -112.55819 -105.72335 6.83484 2.62387 -106.94465 970.70379
6110.0000 -112.48298 -106.44302 6.03996 2.62615 -106.91457 969.41384
6115.0000 -113.63987 -106.67078 6.96908 2.66682 -106.37738 1041.91656
6120.0000 -113.64140 -107.25592 6.38548 2.61192 -107.10248 981.67146
6125.0000 -113.39218 -106.02247 7.36971 2.61415 -107.07312 989.64210
6130.0000 -112.66951 -106.71977 5.94973 2.67795 -106.23045 1031.70931
6135.0000 -113.38506 -107.99924 5.38582 2.56869 -107.67346 958.60323
6140.0000 -114.97449 -109.18712 5.78736 2.53627 -108.10168 933.60488
6145.0000 -113.75873 -107.91301 5.84573 2.47496 -108.91147 871.99858
6150.0000 -113.42268 -108.14525 5.27743 2.57477 -107.59318 955.28161
6155.0000 -113.92852 -107.69024 6.23828 2.52790 -108.21218 911.17797
6160.0000 -113.86939 -107.76919 6.10020 2.54724 -107.95680 953.33716
6165.0000 -114.88910 -109.72260 5.16650 2.46572 -109.03348 898.60452
6170.0000 -113.70801 -107.91690 5.79111 2.48895 -108.72667 846.33677
6175.0000 -113.28415 -107.41110 5.87305 2.60569 -107.18480 944.88170
6180.0000 -112.56110 -106.46771 6.09338 2.58134 -107.50643 944.25744
6185.0000 -113.64580 -107.84731 5.79850 2.58748 -107.42525 954.83664
6190.0000 -113.14924 -107.32856 5.82069 2.55039 -107.91515 915.34568
6195.0000 -112.98576 -107.75336 5.23240 2.62375 -106.94633 982.88406
6200.0000 -113.99070 -109.08056 4.91014 2.53251 -108.15139 872.86811
6205.0000 -112.83711 -107.26556 5.57155 2.52387 -108.26544 895.57268
6210.0000 -112.58674 -106.93649 5.65026 2.60034 -107.25552 948.57845
6215.0000 -115.57570 -108.91711 6.65859 2.53774 -108.08233 933.84521
6220.0000 -114.83504 -108.70275 6.13229 2.47481 -108.91342 906.40803
6225.0000 -113.24743 -107.80728 5.44015 2.56227 -107.75828 918.80685
6230.0000 -114.04469 -107.96357 6.08112 2.55114 -107.90523 920.41962
6235.0000 -113.81480 -108.83866 4.97614 2.51810 -108.34161 916.25858
6240.0000 -113.25948 -107.79155 5.46794 2.46197 -109.08303 856.36919
6245.0000 -113.28276 -105.94659 7.33617 2.60558 -107.18621 995.42517
6250.0000 -112.17218 -106.45510 5.71708 2.65014 -106.59776 987.78415
MELTING PROCESS: loop number 26 T-loop= 945.00000000000000
main_MD> interactions number 26 at Temperature= 945.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.48312 2.26213 2.39061
force_rgl> df(natom) 2.38167 4.02547 -0.23323
6255.0000 -111.46541 -106.83394 4.63147 2.66106 -106.45350 1007.84776
6260.0000 -113.94776 -106.69193 7.25583 2.62040 -106.99058 913.23776
6265.0000 -113.33036 -106.60799 6.72237 2.61280 -107.09087 1019.08020
6270.0000 -114.01132 -108.83866 5.17266 2.52218 -108.28782 936.01494
6275.0000 -114.74264 -110.21181 4.53083 2.42707 -109.54402 822.01616
6280.0000 -113.34526 -108.49361 4.85165 2.44448 -109.31406 823.72954
6285.0000 -112.55201 -107.15599 5.39602 2.54859 -107.93899 938.92940
6290.0000 -113.08793 -107.61856 5.46937 2.57927 -107.53371 981.54771
6295.0000 -111.25689 -106.09319 5.16370 2.63547 -106.79143 998.04023
6300.0000 -112.34955 -106.78124 5.56831 2.59871 -107.27702 952.11380
6305.0000 -113.51364 -107.91752 5.59612 2.57058 -107.64852 913.10462
6310.0000 -114.04035 -108.15576 5.88459 2.54321 -108.01007 916.22236
6315.0000 -112.30298 -106.33988 5.96311 2.59140 -107.37360 952.55285
6320.0000 -114.82065 -108.63928 6.18137 2.57248 -107.62344 960.37942
6325.0000 -113.45673 -107.78230 5.67443 2.48500 -108.77891 884.13386
6330.0000 -113.43839 -107.27421 6.16418 2.54894 -107.93440 938.21277
6335.0000 -111.96462 -104.98618 6.97844 2.67327 -106.29224 1025.08246
6340.0000 -112.48109 -106.52942 5.95166 2.75916 -105.15776 1039.09190
6345.0000 -112.51039 -106.14190 6.36849 2.62356 -106.94875 997.08795
6350.0000 -114.16679 -107.33561 6.83118 2.62133 -106.97819 965.29087
6355.0000 -114.07202 -108.44582 5.62621 2.53212 -108.15649 897.82617
6360.0000 -114.33357 -108.06495 6.26862 2.50830 -108.47113 903.98764
6365.0000 -114.44334 -109.37404 5.06930 2.49845 -108.60124 914.17684
6370.0000 -114.87305 -108.08763 6.78542 2.57987 -107.52588 984.83471
6375.0000 -113.72241 -107.46250 6.25991 2.58090 -107.51223 958.18253
6380.0000 -114.67397 -107.65476 7.01921 2.55056 -107.91294 920.81841
6385.0000 -113.63687 -107.88493 5.75194 2.56931 -107.66533 940.53559
6390.0000 -114.29309 -109.23520 5.05789 2.51742 -108.35061 890.36489
6395.0000 -113.95974 -108.51584 5.44390 2.46134 -109.09135 874.13552
6400.0000 -113.27247 -107.33953 5.93294 2.56741 -107.69042 975.06065
6405.0000 -113.21153 -107.53776 5.67377 2.59311 -107.35095 928.23827
6410.0000 -112.03433 -104.80177 7.23256 2.70215 -105.91085 1047.73085
6415.0000 -113.05532 -107.80708 5.24823 2.68080 -106.19279 1025.66702
6420.0000 -113.75450 -107.55994 6.19456 2.57018 -107.65378 904.02153
6425.0000 -113.05396 -107.31195 5.74201 2.56185 -107.76382 940.96727
6430.0000 -114.45235 -108.78680 5.66555 2.54134 -108.03467 909.44523
6435.0000 -113.14674 -108.50665 4.64009 2.51354 -108.40195 931.17900
6440.0000 -113.16817 -107.75846 5.40971 2.55792 -107.81572 940.60563
6445.0000 -113.79303 -107.70144 6.09159 2.56878 -107.67235 969.35544
6450.0000 -113.22869 -107.59999 5.62870 2.56536 -107.71742 943.70902
6455.0000 -113.66704 -107.23523 6.43181 2.54881 -107.93612 938.65878
6460.0000 -113.54803 -106.95110 6.59693 2.56702 -107.69553 993.17438
6465.0000 -114.13741 -107.96239 6.17502 2.56147 -107.76885 964.56631
6470.0000 -115.40922 -108.48865 6.92057 2.51650 -108.36274 913.15593
6475.0000 -115.02045 -109.01188 6.00857 2.47989 -108.84635 867.04121
6480.0000 -115.30103 -110.40766 4.89337 2.43761 -109.40472 869.33050
6485.0000 -114.64009 -110.04728 4.59281 2.37675 -110.20855 803.08296
6490.0000 -113.28808 -107.83474 5.45335 2.45840 -109.13018 865.87255
6495.0000 -114.38219 -109.16120 5.22099 2.56128 -107.77135 986.87395
6500.0000 -113.15975 -106.65968 6.50007 2.52743 -108.21841 928.33604
MELTING PROCESS: loop number 27 T-loop= 970.00000000000000
main_MD> interactions number 27 at Temperature= 970.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.01662 0.37959 2.26596
force_rgl> df(natom) -0.52747 -2.48073 0.40512
6505.0000 -114.23504 -108.40515 5.82989 2.53248 -108.15173 957.24082
6510.0000 -113.77116 -107.64767 6.12349 2.55945 -107.79553 905.31562
6515.0000 -113.53157 -107.42229 6.10927 2.57582 -107.57929 956.55318
6520.0000 -112.35949 -105.71115 6.64834 2.66713 -106.37328 1044.94699
6525.0000 -114.08942 -107.24720 6.84222 2.68989 -106.07275 1077.79162
6530.0000 -113.58086 -107.58998 5.99088 2.58317 -107.48224 942.20496
6535.0000 -112.94669 -106.99872 5.94798 2.65501 -106.53338 1012.77660
6540.0000 -115.03027 -107.85450 7.17577 2.58850 -107.41187 981.24007
6545.0000 -113.85940 -107.80385 6.05555 2.54955 -107.92633 952.94831
6550.0000 -112.36701 -105.90632 6.46069 2.59996 -107.26052 977.82471
6555.0000 -113.36285 -107.96518 5.39767 2.63130 -106.84658 991.74518
6560.0000 -113.39483 -107.93161 5.46322 2.59139 -107.37370 987.82980
6565.0000 -114.27201 -109.04457 5.22744 2.48685 -108.75436 863.70474
6570.0000 -113.76676 -109.01977 4.74699 2.51232 -108.41796 873.14471
6575.0000 -113.60584 -108.26397 5.34187 2.51406 -108.39508 872.46432
6580.0000 -113.54357 -107.24613 6.29744 2.50892 -108.46290 900.70861
6585.0000 -111.63035 -105.18985 6.44050 2.68854 -106.09057 1030.63805
6590.0000 -110.45724 -104.67786 5.77939 2.80103 -104.60484 1122.84624
6595.0000 -112.14107 -106.23380 5.90726 2.70949 -105.81381 1015.40468
6600.0000 -112.79391 -107.21402 5.57989 2.63995 -106.73226 986.23706
6605.0000 -113.50554 -107.24612 6.25941 2.57353 -107.60956 966.85930
6610.0000 -112.17718 -106.83068 5.34650 2.60537 -107.18900 965.92473
6615.0000 -113.43093 -107.67346 5.75747 2.57131 -107.63890 971.19277
6620.0000 -112.86008 -107.88033 4.97974 2.56526 -107.71884 935.99572
6625.0000 -114.43121 -107.19069 7.24051 2.58890 -107.40653 965.41571
6630.0000 -112.80854 -106.41841 6.39013 2.60181 -107.23599 1010.88002
6635.0000 -114.45482 -108.73792 5.71691 2.59155 -107.37154 975.55534
6640.0000 -115.21298 -109.97877 5.23422 2.40804 -109.79533 847.31029
6645.0000 -111.48160 -105.44715 6.03445 2.65148 -106.58001 1017.82071
6650.0000 -111.87686 -106.29072 5.58614 2.76110 -105.13222 1084.37156
6655.0000 -112.02316 -104.85506 7.16811 2.71061 -105.79909 1035.87536
6660.0000 -111.94478 -105.35654 6.58824 2.77248 -104.98184 1090.86860
6665.0000 -111.79971 -105.56105 6.23866 2.72590 -105.59704 1074.71352
6670.0000 -113.72031 -106.60223 7.11808 2.70495 -105.87379 1037.78609
6675.0000 -112.79205 -107.10985 5.68220 2.65000 -106.59961 995.80474
6680.0000 -114.75221 -108.70078 6.05143 2.54132 -108.03503 923.67532
6685.0000 -113.60202 -108.26392 5.33810 2.50121 -108.56471 927.58440
6690.0000 -113.41174 -106.37560 7.03614 2.57304 -107.61603 967.44276
6695.0000 -113.12097 -107.04467 6.07630 2.65577 -106.52335 958.16592
6700.0000 -113.14218 -107.28153 5.86065 2.65068 -106.59057 1017.44618
6705.0000 -114.37590 -108.45955 5.91636 2.59592 -107.31381 941.69198
6710.0000 -113.31980 -106.99115 6.32865 2.60772 -107.15804 996.54719
6715.0000 -114.83342 -108.84418 5.98924 2.55013 -107.91866 939.41313
6720.0000 -113.00792 -108.01623 4.99168 2.50582 -108.50390 911.18773
6725.0000 -114.25019 -108.50201 5.74817 2.53428 -108.12802 954.16662
6730.0000 -111.79888 -107.09763 4.70126 2.56475 -107.72547 973.82140
6735.0000 -113.76772 -108.97598 4.79174 2.55037 -107.91549 947.98398
6740.0000 -113.05631 -108.02088 5.03543 2.52479 -108.25334 881.95228
6745.0000 -114.88721 -109.48785 5.39936 2.44858 -109.25982 855.40261
6750.0000 -113.35330 -109.41818 3.93513 2.48625 -108.76228 886.99042
MELTING PROCESS: loop number 28 T-loop= 995.00000000000000
main_MD> interactions number 28 at Temperature= 995.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -2.26773 0.74103 -0.36002
force_rgl> df(natom) 1.92510 2.49610 0.57954
6755.0000 -112.81707 -107.49320 5.32388 2.50987 -108.45034 920.79673
6760.0000 -112.91359 -107.31156 5.60203 2.57432 -107.59907 960.02346
6765.0000 -112.56322 -106.80082 5.76240 2.59747 -107.29339 955.75410
6770.0000 -113.76508 -107.60155 6.16353 2.69078 -106.06091 1043.72145
6775.0000 -111.31491 -106.93095 4.38396 2.61258 -107.09386 974.63398
6780.0000 -112.63116 -106.34381 6.28735 2.64437 -106.67395 993.71313
6785.0000 -113.72101 -107.72911 5.99190 2.61271 -107.09207 994.53908
6790.0000 -114.33924 -106.64434 7.69490 2.61159 -107.10692 966.37434
6795.0000 -112.39348 -106.68421 5.70927 2.68614 -106.12222 1038.82859
6800.0000 -111.31265 -104.89639 6.41626 2.75324 -105.23601 1044.80118
6805.0000 -112.05252 -105.60419 6.44833 2.73227 -105.51303 1081.48915
6810.0000 -112.04624 -105.35499 6.69125 2.71888 -105.68980 1047.88159
6815.0000 -112.91988 -106.97784 5.94204 2.66320 -106.42525 1061.79533
6820.0000 -113.46730 -106.43701 7.03029 2.61141 -107.10920 970.63188
6825.0000 -112.15479 -105.73568 6.41911 2.68013 -106.20156 1054.56509
6830.0000 -112.59256 -107.16053 5.43203 2.63108 -106.84948 1033.10717
6835.0000 -113.62126 -108.06050 5.56075 2.59486 -107.32787 996.33883
6840.0000 -113.67176 -108.14922 5.52253 2.55402 -107.86730 935.79171
6845.0000 -113.43349 -108.59834 4.83515 2.55538 -107.84930 941.50059
6850.0000 -113.18994 -107.51648 5.67345 2.51269 -108.41316 899.35311
6855.0000 -113.82285 -107.46176 6.36109 2.58057 -107.51664 959.38521
6860.0000 -113.30806 -107.09369 6.21436 2.59609 -107.31158 992.36615
6865.0000 -113.03731 -106.77856 6.25876 2.61835 -107.01754 984.38010
6870.0000 -113.18636 -107.11935 6.06701 2.68408 -106.14948 1019.26967
6875.0000 -111.52799 -104.74906 6.77892 2.79398 -104.69787 1151.31963
6880.0000 -111.70490 -104.70248 7.00242 2.79348 -104.70459 1115.06590
6885.0000 -114.04720 -108.81981 5.22739 2.70213 -105.91103 1057.53922
6890.0000 -112.38514 -106.59810 5.78704 2.56986 -107.65799 940.53877
6895.0000 -110.96767 -103.37567 7.59200 2.80088 -104.60684 1131.68456
6900.0000 -113.67867 -107.87822 5.80045 2.70446 -105.88023 1040.28210
6905.0000 -113.37428 -107.20889 6.16539 2.59595 -107.31341 995.01826
6910.0000 -113.55531 -107.47418 6.08114 2.55554 -107.84713 940.50043
6915.0000 -113.73772 -107.96443 5.77329 2.56627 -107.70551 959.13355
6920.0000 -112.91263 -107.94766 4.96498 2.58861 -107.41041 966.70266
6925.0000 -113.03736 -107.26928 5.76808 2.58538 -107.45304 917.38283
6930.0000 -113.91361 -106.98439 6.92921 2.56958 -107.66171 979.78356
6935.0000 -113.81335 -107.86124 5.95211 2.59887 -107.27487 1011.36288
6940.0000 -114.40078 -107.80572 6.59506 2.54557 -107.97892 956.12585
6945.0000 -113.95501 -107.62013 6.33488 2.57432 -107.59916 960.55027
6950.0000 -114.06635 -108.52483 5.54151 2.53462 -108.12341 906.46719
6955.0000 -113.98694 -109.14466 4.84229 2.50076 -108.57074 888.17728
6960.0000 -114.17249 -108.25473 5.91776 2.49383 -108.66223 903.65018
6965.0000 -113.99924 -107.11222 6.88702 2.54653 -107.96619 938.54111
6970.0000 -112.50168 -105.75468 6.74700 2.70429 -105.88255 1050.58603
6975.0000 -112.62928 -105.27464 7.35464 2.78692 -104.79118 1112.60776
6980.0000 -113.26227 -106.86573 6.39653 2.72175 -105.65198 1078.93780
6985.0000 -112.89970 -106.35289 6.54681 2.67197 -106.30938 1002.33360
6990.0000 -113.67531 -106.46301 7.21230 2.68558 -106.12962 1042.54241
6995.0000 -114.82251 -108.52542 6.29708 2.56566 -107.71355 946.41675
7000.0000 -114.63071 -109.00252 5.62819 2.52771 -108.21476 902.41576
MELTING PROCESS: loop number 29 T-loop= 1020.0000000000000
main_MD> interactions number 29 at Temperature= 1020.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -3.88802 -0.78786 0.18498
force_rgl> df(natom) 0.46395 3.17838 -0.61544
7005.0000 -114.40852 -108.51426 5.89426 2.48530 -108.77488 890.91384
7010.0000 -113.06769 -108.68860 4.37909 2.49700 -108.62036 890.31478
7015.0000 -115.10683 -109.68958 5.41725 2.48937 -108.72113 894.79803
7020.0000 -112.67555 -108.28832 4.38723 2.51368 -108.40004 854.62605
7025.0000 -114.31621 -108.95199 5.36422 2.55760 -107.81999 957.39774
7030.0000 -113.97664 -107.68335 6.29329 2.53530 -108.11449 964.48201
7035.0000 -114.04294 -108.24590 5.79704 2.58099 -107.51100 958.37648
7040.0000 -112.00128 -105.93298 6.06829 2.63167 -106.84164 954.48862
7045.0000 -114.65582 -107.72217 6.93365 2.62835 -106.88552 972.21603
7050.0000 -112.22523 -106.09636 6.12888 2.63861 -106.75007 1026.53013
7055.0000 -112.35125 -104.64542 7.70583 2.76041 -105.14128 1136.97457
7060.0000 -113.19366 -106.04501 7.14865 2.79033 -104.74619 1139.61112
7065.0000 -113.33659 -107.29622 6.04037 2.56655 -107.70180 899.93472
7070.0000 -111.66476 -106.33629 5.32847 2.63430 -106.80698 1012.87833
7075.0000 -113.96822 -108.05508 5.91314 2.61891 -107.01020 986.78499
7080.0000 -112.81867 -107.39407 5.42460 2.60326 -107.21695 994.08820
7085.0000 -113.79215 -108.15459 5.63756 2.60175 -107.23688 984.40766
7090.0000 -112.15030 -105.36250 6.78780 2.68266 -106.16817 1027.52565
7095.0000 -112.73891 -106.21168 6.52724 2.67396 -106.28313 1015.20431
7100.0000 -110.80886 -104.96787 5.84099 2.74606 -105.33081 1067.47699
7105.0000 -112.57860 -106.61458 5.96402 2.70902 -105.82006 1077.92721
7110.0000 -111.49253 -105.43241 6.06012 2.68458 -106.14289 1023.70998
7115.0000 -110.73159 -104.50435 6.22723 2.77507 -104.94767 1089.14584
7120.0000 -112.48552 -104.85810 7.62742 2.79322 -104.70795 1147.94973
7125.0000 -111.04214 -104.15903 6.88311 2.79920 -104.62893 1138.86786
7130.0000 -111.68573 -105.60347 6.08226 2.78436 -104.82502 1075.26110
7135.0000 -113.08373 -106.52305 6.56069 2.64129 -106.71463 971.64110
7140.0000 -112.79931 -104.89070 7.90861 2.68142 -106.18453 1001.63112
7145.0000 -111.59631 -104.75323 6.84308 2.71291 -105.76868 1041.70184
7150.0000 -111.98321 -105.53215 6.45106 2.68682 -106.11323 1020.86550
7155.0000 -112.36590 -106.88679 5.47910 2.66491 -106.40267 1011.36779
7160.0000 -113.33050 -106.65823 6.67228 2.66537 -106.39661 1026.40922
7165.0000 -112.79618 -105.41656 7.37962 2.62035 -106.99114 1042.55107
7170.0000 -113.53239 -105.94983 7.58256 2.78220 -104.85350 1163.23507
7175.0000 -113.78374 -107.78760 5.99614 2.60679 -107.17033 931.64976
7180.0000 -113.27975 -105.38887 7.89088 2.63727 -106.76765 1000.50903
7185.0000 -112.49146 -105.97883 6.51263 2.70660 -105.85199 1057.54028
7190.0000 -111.38991 -104.90634 6.48357 2.80312 -104.57718 1093.06405
7195.0000 -112.98268 -105.71299 7.26970 2.70477 -105.87618 1030.63223
7200.0000 -112.03458 -107.02822 5.00636 2.63626 -106.78106 975.03037
7205.0000 -112.07311 -105.84473 6.22838 2.63676 -106.77441 982.45753
7210.0000 -113.53690 -106.08558 7.45132 2.71507 -105.74017 1072.13200
7215.0000 -111.90210 -106.28610 5.61601 2.72326 -105.63204 1084.54799
7220.0000 -111.88463 -106.02400 5.86063 2.69540 -105.99999 1018.86679
7225.0000 -112.60853 -105.90873 6.69981 2.71794 -105.70220 1042.17152
7230.0000 -112.50093 -106.17802 6.32290 2.68452 -106.14370 1022.06948
7235.0000 -112.76602 -107.31130 5.45472 2.63763 -106.76291 994.59987
7240.0000 -112.93371 -106.00206 6.93165 2.62111 -106.98120 985.63913
7245.0000 -112.36587 -106.40630 5.95957 2.64115 -106.71645 1024.41851
7250.0000 -111.72100 -104.69497 7.02603 2.78549 -104.81000 1153.20235
MELTING PROCESS: loop number 30 T-loop= 1045.0000000000000
main_MD> interactions number 30 at Temperature= 1045.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.54219 -1.59041 -0.23366
force_rgl> df(natom) -5.77511 0.43135 -2.37995
7255.0000 -111.52674 -104.78346 6.74328 2.78698 -104.79041 1136.68579
7260.0000 -110.89795 -103.92140 6.97655 2.77139 -104.99626 1103.97724
7265.0000 -111.20910 -103.86245 7.34665 2.86743 -103.72778 1209.92488
7270.0000 -113.20503 -107.14138 6.06365 2.69714 -105.97692 1040.96505
7275.0000 -111.34022 -104.84237 6.49785 2.70528 -105.86946 1063.56295
7280.0000 -112.61691 -106.15113 6.46578 2.75881 -105.16239 1074.52004
7285.0000 -111.86254 -105.28509 6.57744 2.66121 -106.45157 1041.05923
7290.0000 -112.57325 -106.50791 6.06534 2.72473 -105.61250 1037.85470
7295.0000 -113.43905 -107.56008 5.87897 2.65519 -106.53099 1016.21878
7300.0000 -112.98301 -105.62024 7.36276 2.59035 -107.38740 984.30696
7305.0000 -111.63529 -105.01946 6.61583 2.75917 -105.15769 1076.70572
7310.0000 -112.24230 -104.65248 7.58982 2.79089 -104.73877 1104.88231
7315.0000 -112.98458 -106.70657 6.27801 2.73375 -105.49340 1075.29058
7320.0000 -114.26313 -106.82912 7.43401 2.65560 -106.52565 1038.19151
7325.0000 -111.86320 -104.93822 6.92497 2.65321 -106.55713 1038.59551
7330.0000 -113.40214 -106.06701 7.33513 2.64198 -106.70554 1015.67072
7335.0000 -112.70684 -106.53454 6.17230 2.62753 -106.89640 1014.83185
7340.0000 -114.26130 -108.67153 5.58976 2.54634 -107.96871 975.84089
7345.0000 -114.41836 -108.99041 5.42795 2.45298 -109.20174 887.85026
7350.0000 -112.76440 -106.23824 6.52616 2.55053 -107.91340 948.29698
7355.0000 -114.17671 -107.45509 6.72162 2.62226 -106.96590 1006.63700
7360.0000 -113.49025 -107.78212 5.70813 2.53483 -108.12070 921.91705
7365.0000 -113.23889 -106.72932 6.50957 2.54729 -107.95613 909.79375
7370.0000 -112.98384 -105.91066 7.07317 2.62401 -106.94279 973.00322
7375.0000 -111.89484 -106.20614 5.68871 2.65589 -106.52175 998.02044
7380.0000 -112.97372 -105.57319 7.40053 2.69481 -106.00769 1036.27111
7385.0000 -111.31345 -103.95665 7.35680 2.74266 -105.37578 1064.86086
7390.0000 -112.64129 -105.17663 7.46466 2.86351 -103.77954 1195.64752
7395.0000 -113.08384 -107.01352 6.07032 2.63636 -106.77966 999.10380
7400.0000 -112.91412 -107.18223 5.73188 2.56930 -107.66543 963.53397
7405.0000 -112.17227 -106.30848 5.86379 2.63382 -106.81328 996.80341
7410.0000 -113.05788 -105.42664 7.63124 2.68571 -106.12787 1058.37461
7415.0000 -112.33300 -105.17389 7.15911 2.78739 -104.78499 1103.86623
7420.0000 -112.59895 -105.92688 6.67207 2.70917 -105.81802 1031.36808
7425.0000 -112.37423 -105.93730 6.43693 2.59600 -107.31281 957.23699
7430.0000 -112.53106 -106.32619 6.20487 2.67084 -106.32438 1080.02969
7435.0000 -113.13582 -106.45380 6.68202 2.62772 -106.89382 1015.36918
7440.0000 -112.25014 -106.82822 5.42193 2.62634 -106.91201 947.23791
7445.0000 -113.62252 -107.77640 5.84612 2.62470 -106.93370 983.61403
7450.0000 -112.87289 -106.59336 6.27954 2.59019 -107.38958 956.63979
7455.0000 -114.44788 -109.18738 5.26050 2.53145 -108.16533 954.20550
7460.0000 -112.17968 -107.00448 5.17520 2.51507 -108.38163 883.85715
7465.0000 -114.26654 -109.18038 5.08616 2.53954 -108.05852 948.03150
7470.0000 -112.13901 -106.65119 5.48782 2.49306 -108.67235 888.63193
7475.0000 -113.35947 -108.00442 5.35505 2.66511 -106.39999 1017.23539
7480.0000 -112.28800 -104.69749 7.59050 2.68961 -106.07638 1058.43861
7485.0000 -110.95514 -103.93156 7.02358 2.81547 -104.41405 1153.75497
7490.0000 -112.96579 -107.54779 5.41800 2.71726 -105.71117 1099.29195
7495.0000 -111.36633 -105.60245 5.76388 2.62321 -106.95345 974.51550
7500.0000 -112.39902 -106.54988 5.84914 2.69961 -105.94434 1048.69351
MELTING PROCESS: loop number 31 T-loop= 1070.0000000000000
main_MD> interactions number 31 at Temperature= 1070.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.67184 1.35678 3.33180
force_rgl> df(natom) -0.27884 1.33744 -1.66761
7505.0000 -112.63601 -106.54423 6.09179 2.68958 -106.07678 1055.04110
7510.0000 -114.73681 -108.43897 6.29784 2.58100 -107.51096 981.90627
7515.0000 -111.61441 -106.28198 5.33243 2.60855 -107.14708 1009.66049
7520.0000 -112.06339 -105.13977 6.92361 2.69801 -105.96547 1063.62696
7525.0000 -111.97986 -104.34576 7.63409 2.77003 -105.01429 1125.40882
7530.0000 -112.95399 -105.18191 7.77208 2.73211 -105.51511 1121.68614
7535.0000 -111.06931 -105.20674 5.86257 2.76119 -105.13095 1141.06570
7540.0000 -112.76961 -106.22113 6.54848 2.70864 -105.82511 1057.43624
7545.0000 -110.48137 -105.11990 5.36147 2.70823 -105.83053 1051.23675
7550.0000 -111.55224 -105.58587 5.96637 2.75556 -105.20541 1032.56077
7555.0000 -112.88525 -106.89547 5.98978 2.68980 -106.07392 1059.31101
7560.0000 -111.99680 -105.69161 6.30519 2.74647 -105.32542 1037.70553
7565.0000 -112.94313 -106.88788 6.05525 2.65587 -106.52203 997.78595
7570.0000 -113.34707 -106.52805 6.81901 2.65695 -106.50779 1009.16550
7575.0000 -113.47210 -106.26086 7.21124 2.65464 -106.53834 1026.50537
7580.0000 -113.49207 -107.53538 5.95668 2.64523 -106.66252 998.12468
7585.0000 -113.98270 -107.27249 6.71021 2.58291 -107.48573 960.93473
7590.0000 -113.56251 -107.63345 5.92906 2.57244 -107.62395 967.46027
7595.0000 -113.87509 -108.52902 5.34607 2.55849 -107.80825 942.90329
7600.0000 -110.56728 -104.08830 6.47898 2.67453 -106.27561 998.85411
7605.0000 -110.37802 -104.42706 5.95095 2.83076 -104.21208 1114.89270
7610.0000 -111.49704 -105.71684 5.78020 2.77939 -104.89065 1103.74416
7615.0000 -109.97398 -103.70914 6.26484 2.82464 -104.29302 1090.49267
7620.0000 -112.60618 -106.11190 6.49429 2.77574 -104.93886 1080.24012
7625.0000 -113.28651 -105.64390 7.64261 2.64134 -106.71393 1018.66003
7630.0000 -111.77114 -105.83673 5.93441 2.73333 -105.49901 1096.76070
7635.0000 -112.25070 -104.66166 7.58904 2.74218 -105.38211 1043.56539
7640.0000 -110.88820 -105.02292 5.86528 2.80205 -104.59127 1132.59377
7645.0000 -111.63837 -103.66266 7.97571 2.85622 -103.87592 1117.60193
7650.0000 -111.58435 -105.36445 6.21990 2.82581 -104.27746 1133.82345
7655.0000 -111.57678 -104.43050 7.14628 2.71676 -105.71788 1039.84233
7660.0000 -111.92739 -104.81106 7.11633 2.77082 -105.00375 1119.27718
7665.0000 -111.07368 -104.30744 6.76625 2.79648 -104.66491 1134.98341
7670.0000 -111.32668 -104.39890 6.92778 2.82786 -104.25048 1172.95223
7675.0000 -112.26964 -105.44708 6.82256 2.71993 -105.67601 1062.65133
7680.0000 -111.52429 -104.27745 7.24684 2.75482 -105.21514 1056.80840
7685.0000 -112.12303 -106.22867 5.89436 2.73188 -105.51806 1067.95623
7690.0000 -112.46397 -105.41066 7.05331 2.70133 -105.92155 1015.54830
7695.0000 -112.74352 -106.54222 6.20130 2.59894 -107.27390 980.65360
7700.0000 -111.26317 -103.41388 7.84929 2.72430 -105.61820 1050.39160
7705.0000 -111.88714 -104.40739 7.47975 2.81227 -104.45631 1130.47412
7710.0000 -110.43838 -103.41062 7.02775 2.90306 -103.25722 1212.00061
7715.0000 -108.96906 -102.89905 6.07000 2.82821 -104.24580 1155.17420
7720.0000 -111.00453 -103.55571 7.44882 2.79181 -104.72662 1138.31913
7725.0000 -112.03123 -104.85984 7.17140 2.82746 -104.25567 1091.26244
7730.0000 -114.00565 -108.62300 5.38265 2.65033 -106.59525 1012.03889
7735.0000 -113.55731 -106.57514 6.98216 2.61843 -107.01659 975.22977
7740.0000 -112.89883 -104.70254 8.19629 2.74315 -105.36930 1082.71965
7745.0000 -111.02351 -104.04994 6.97358 2.80112 -104.60363 1097.45294
7750.0000 -111.14411 -104.69289 6.45123 2.79655 -104.66400 1113.73337
MELTING PROCESS: loop number 32 T-loop= 1095.0000000000000
main_MD> interactions number 32 at Temperature= 1095.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.45822 0.31274 -0.27821
force_rgl> df(natom) -3.74808 1.99787 0.16103
7755.0000 -112.05854 -103.77532 8.28323 2.83175 -104.19909 1225.63268
7760.0000 -109.63397 -103.00198 6.63199 2.88543 -103.49014 1213.49422
7765.0000 -110.84585 -104.43846 6.40739 2.86376 -103.77626 1135.98415
7770.0000 -110.42606 -103.15612 7.26993 2.85420 -103.90259 1145.51412
7775.0000 -111.38329 -105.26886 6.11443 2.83962 -104.09508 1157.82108
7780.0000 -110.60751 -104.12046 6.48705 2.84474 -104.02750 1155.50172
7785.0000 -111.39141 -104.25607 7.13534 2.85501 -103.89181 1143.40078
7790.0000 -112.39689 -106.07835 6.31854 2.70471 -105.87699 1029.47851
7795.0000 -110.09938 -105.06878 5.03060 2.68241 -106.17156 1012.03114
7800.0000 -112.88358 -105.37619 7.50739 2.70675 -105.85007 1048.70832
7805.0000 -112.07466 -104.44766 7.62701 2.83241 -104.19037 1199.73934
7810.0000 -112.65909 -106.66934 5.98975 2.77776 -104.91217 1137.25431
7815.0000 -113.55358 -106.79521 6.75837 2.55859 -107.80691 913.08942
7820.0000 -112.19068 -105.45353 6.73715 2.72967 -105.54732 1082.18087
7825.0000 -111.33746 -105.41089 5.92657 2.76494 -105.08143 1108.17603
7830.0000 -111.01657 -104.46035 6.55622 2.74095 -105.39829 1106.28081
7835.0000 -111.38838 -104.54101 6.84737 2.86142 -103.80718 1174.17069
7840.0000 -112.51983 -106.86269 5.65714 2.66228 -106.43733 1050.43300
7845.0000 -112.50040 -105.67288 6.82752 2.67625 -106.25282 1045.10722
7850.0000 -111.82249 -106.28634 5.53615 2.70474 -105.87656 1104.71316
7855.0000 -113.13186 -105.89401 7.23785 2.72006 -105.67430 1088.72914
7860.0000 -112.25456 -106.20498 6.04958 2.73198 -105.51676 1074.35302
7865.0000 -111.49880 -104.59280 6.90600 2.81850 -104.37403 1106.64241
7870.0000 -113.74973 -107.52036 6.22937 2.69078 -106.06091 1046.85402
7875.0000 -113.15337 -106.79812 6.35524 2.59567 -107.31709 977.74289
7880.0000 -110.94803 -104.23107 6.71696 2.75311 -105.23773 1094.80621
7885.0000 -110.99351 -104.52385 6.46966 2.90642 -103.21286 1234.36815
7890.0000 -112.43576 -104.57052 7.86524 2.78033 -104.87821 1070.21969
7895.0000 -112.20860 -104.89662 7.31198 2.75342 -105.23358 1108.10675
7900.0000 -112.50762 -107.33535 5.17228 2.68500 -106.13727 1059.36689
7905.0000 -113.25256 -106.57081 6.68175 2.64447 -106.67257 1031.25314
7910.0000 -113.39667 -107.52132 5.87534 2.56770 -107.68662 972.42770
7915.0000 -113.84661 -107.34138 6.50523 2.64935 -106.60810 1027.10734
7920.0000 -112.10866 -106.13354 5.97511 2.70469 -105.87729 1085.57723
7925.0000 -112.90672 -106.74427 6.16244 2.69157 -106.05047 1083.39898
7930.0000 -110.50284 -105.63025 4.87259 2.67987 -106.20507 1001.85337
7935.0000 -112.95424 -105.18975 7.76449 2.75636 -105.19481 1048.94588
7940.0000 -111.87990 -105.52173 6.35818 2.73543 -105.47129 1082.25524
7945.0000 -112.37014 -105.53186 6.83827 2.72667 -105.58697 1064.63227
7950.0000 -111.60807 -105.24887 6.35920 2.72481 -105.61155 1101.80287
7955.0000 -109.39666 -103.30976 6.08690 2.78769 -104.78104 1138.47124
7960.0000 -112.30632 -104.90728 7.39903 2.80247 -104.58580 1146.15430
7965.0000 -110.90257 -103.28229 7.62027 2.85032 -103.95382 1181.81148
7970.0000 -108.86208 -103.50550 5.35658 2.88920 -103.44024 1144.47382
7975.0000 -109.72376 -102.50351 7.22025 2.89661 -103.34238 1214.66254
7980.0000 -111.92817 -105.06107 6.86709 2.81474 -104.42369 1174.09048
7985.0000 -114.02718 -106.80784 7.21934 2.69769 -105.96974 1019.42796
7990.0000 -112.88475 -106.29335 6.59140 2.60881 -107.14364 985.86081
7995.0000 -112.58765 -106.61059 5.97705 2.67404 -106.28206 1021.21928
8000.0000 -112.82787 -105.72843 7.09944 2.65477 -106.53662 1025.52685
MELTING PROCESS: loop number 33 T-loop= 1120.0000000000000
main_MD> interactions number 33 at Temperature= 1120.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.18703 -0.77919 2.65507
force_rgl> df(natom) -2.63316 -2.84879 -2.46663
8005.0000 -112.08750 -105.85655 6.23095 2.70743 -105.84105 1045.16512
8010.0000 -111.47062 -104.70024 6.77038 2.72191 -105.64983 1049.55937
8015.0000 -111.89096 -103.16379 8.72717 2.85406 -103.90444 1144.01720
8020.0000 -112.62209 -106.60649 6.01560 2.79781 -104.64735 1087.85086
8025.0000 -112.84028 -105.40684 7.43344 2.68463 -106.14221 1059.33150
8030.0000 -113.05019 -106.36452 6.68567 2.70474 -105.87663 1071.05411
8035.0000 -112.18906 -104.43802 7.75104 2.77304 -104.97452 1129.69255
8040.0000 -111.13617 -103.81262 7.32355 2.82149 -104.33452 1140.76431
8045.0000 -110.61193 -102.28932 8.32260 2.92676 -102.94420 1228.56877
8050.0000 -110.76270 -101.78929 8.97341 2.94996 -102.63778 1237.74694
8055.0000 -109.96817 -101.85003 8.11814 3.07404 -100.99903 1261.49858
8060.0000 -111.45871 -104.94288 6.51583 2.86145 -103.80683 1192.88774
8065.0000 -112.55515 -104.71952 7.83563 2.78392 -104.83081 1108.45777
8070.0000 -108.74760 -103.09507 5.65253 2.89172 -103.40702 1201.51927
8075.0000 -110.87330 -103.16233 7.71097 2.96175 -102.48207 1235.11808
8080.0000 -110.75571 -103.11812 7.63759 2.98103 -102.22737 1257.93740
8085.0000 -109.30319 -102.77824 6.52495 2.87858 -103.58055 1157.58807
8090.0000 -110.95203 -104.56846 6.38357 2.87808 -103.58716 1194.40507
8095.0000 -111.53597 -104.91616 6.61981 2.75893 -105.16090 1079.30030
8100.0000 -112.09901 -106.28425 5.81477 2.71680 -105.71731 1068.74373
8105.0000 -112.18239 -105.37043 6.81197 2.73711 -105.44899 1071.07067
8110.0000 -113.94864 -108.04590 5.90273 2.60730 -107.16356 960.32675
8115.0000 -113.23065 -108.64183 4.58882 2.54851 -107.94008 961.56973
8120.0000 -112.71384 -105.92630 6.78754 2.59265 -107.35700 982.67243
8125.0000 -110.47927 -103.91544 6.56383 2.77387 -104.96357 1105.65594
8130.0000 -109.92398 -102.60646 7.31752 2.82424 -104.29829 1154.38947
8135.0000 -110.96482 -103.10894 7.85588 2.94636 -102.68537 1251.82958
8140.0000 -110.45975 -102.74313 7.71662 2.88858 -103.44843 1191.11724
8145.0000 -111.29522 -102.73974 8.55548 2.94825 -102.66036 1238.54637
8150.0000 -112.35269 -103.66577 8.68692 2.89496 -103.36425 1247.86677
8155.0000 -110.27690 -104.09685 6.18005 2.80461 -104.55748 1124.62037
8160.0000 -111.48915 -103.88259 7.60655 2.83234 -104.19126 1181.62829
8165.0000 -111.56797 -103.56148 8.00650 2.81709 -104.39263 1132.69554
8170.0000 -111.99257 -106.30994 5.68263 2.73112 -105.52817 1061.44204
8175.0000 -113.42743 -106.44838 6.97905 2.65941 -106.47534 1030.45426
8180.0000 -111.60106 -106.04599 5.55506 2.67397 -106.28298 1036.71660
8185.0000 -112.24749 -106.89406 5.35343 2.69267 -106.03598 1050.50872
8190.0000 -112.67558 -106.24318 6.43240 2.67377 -106.28562 1066.04058
8195.0000 -112.80233 -106.32394 6.47839 2.64383 -106.68104 1000.47248
8200.0000 -111.41172 -104.66782 6.74390 2.69334 -106.02719 1053.40869
8205.0000 -112.20696 -105.51558 6.69138 2.83630 -104.13902 1159.59560
8210.0000 -112.21910 -106.49222 5.72688 2.61305 -107.08763 992.67243
8215.0000 -111.89288 -106.57927 5.31361 2.69028 -106.06751 1019.05955
8220.0000 -110.11389 -103.65153 6.46236 2.75788 -105.17473 1091.98205
8225.0000 -112.02692 -105.21194 6.81497 2.83311 -104.18108 1180.52708
8230.0000 -110.68849 -103.73796 6.95053 2.83256 -104.18835 1157.89360
8235.0000 -113.88603 -106.78245 7.10358 2.71255 -105.77346 1052.58926
8240.0000 -112.44694 -105.78266 6.66428 2.64680 -106.64183 986.01691
8245.0000 -109.99285 -104.36190 5.63095 2.76938 -105.02288 1066.17397
8250.0000 -111.97904 -105.36089 6.61815 2.76270 -105.11100 1082.68665
MELTING PROCESS: loop number 34 T-loop= 1145.0000000000000
main_MD> interactions number 34 at Temperature= 1145.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 3.26119 -7.53200 3.27024
force_rgl> df(natom) -2.07709 2.55737 -0.97781
8255.0000 -112.44443 -105.25022 7.19421 2.74071 -105.40147 1074.96173
8260.0000 -111.35145 -102.79543 8.55602 2.81904 -104.36691 1128.59286
8265.0000 -110.88112 -103.63831 7.24281 2.88419 -103.50648 1187.70167
8270.0000 -111.28135 -104.73927 6.54208 2.88003 -103.56143 1192.09854
8275.0000 -111.86050 -105.19137 6.66913 2.81141 -104.46772 1114.78206
8280.0000 -112.78288 -105.32832 7.45457 2.75488 -105.21434 1101.93498
8285.0000 -112.44273 -105.95917 6.48355 2.69612 -105.99041 1030.32988
8290.0000 -110.33483 -103.07703 7.25780 2.81898 -104.36774 1140.17450
8295.0000 -109.62964 -101.87844 7.75120 2.97858 -102.25976 1225.93137
8300.0000 -112.41882 -105.59862 6.82020 2.79811 -104.64340 1116.74444
8305.0000 -112.28004 -105.40668 6.87336 2.70830 -105.82952 1054.50921
8310.0000 -111.14392 -104.39464 6.74928 2.81211 -104.45844 1150.04839
8315.0000 -110.34677 -102.12307 8.22370 2.87257 -103.65989 1184.05892
8320.0000 -110.20599 -103.41347 6.79252 2.88471 -103.49956 1142.00817
8325.0000 -110.04392 -101.01857 9.02534 3.02176 -101.68946 1327.84899
8330.0000 -111.14772 -104.39157 6.75615 2.95390 -102.58578 1254.12911
8335.0000 -110.65228 -102.53077 8.12151 2.85892 -103.84027 1139.56768
8340.0000 -110.70372 -102.69642 8.00730 2.88131 -103.54445 1159.35448
8345.0000 -109.62295 -102.74129 6.88165 2.86861 -103.71224 1143.19963
8350.0000 -110.50892 -103.59684 6.91208 2.88129 -103.54478 1159.52493
8355.0000 -111.52545 -103.89762 7.62783 2.86512 -103.75837 1168.41139
8360.0000 -108.89739 -102.54308 6.35430 2.89746 -103.33115 1190.20430
8365.0000 -110.69001 -102.64757 8.04243 2.92610 -102.95289 1259.88682
8370.0000 -111.25407 -105.45413 5.79995 2.83078 -104.21190 1122.71783
8375.0000 -108.94225 -102.16771 6.77454 2.93259 -102.86723 1232.75124
8380.0000 -110.91635 -103.43767 7.47868 2.87407 -103.64014 1144.03380
8385.0000 -111.68514 -103.65147 8.03367 2.90179 -103.27403 1178.98256
8390.0000 -113.16150 -106.80076 6.36074 2.67429 -106.27875 1083.60600
8395.0000 -112.18192 -104.86134 7.32058 2.76704 -105.05368 1064.08757
8400.0000 -111.36497 -105.99525 5.36971 2.72697 -105.58295 1069.97288
8405.0000 -113.80623 -106.49534 7.31088 2.68156 -106.18277 1037.76150
8410.0000 -111.99905 -106.09472 5.90433 2.66826 -106.35844 1025.35381
8415.0000 -110.56933 -103.54450 7.02483 2.78114 -104.86746 1112.57806
8420.0000 -111.89504 -103.05520 8.83984 2.86198 -103.79981 1177.02915
8425.0000 -111.71316 -104.27928 7.43388 2.86765 -103.72485 1181.93123
8430.0000 -109.99762 -103.53359 6.46403 2.87625 -103.61132 1179.55964
8435.0000 -112.23641 -105.48964 6.74677 2.84617 -104.00855 1156.07191
8440.0000 -110.74636 -103.32982 7.41653 2.80879 -104.50235 1146.63083
8445.0000 -109.91860 -103.87656 6.04203 2.84028 -104.08639 1166.30457
8450.0000 -110.73353 -103.71551 7.01802 2.88880 -103.44555 1210.50060
8455.0000 -109.88089 -103.21456 6.66633 2.89102 -103.41621 1213.52219
8460.0000 -109.62876 -102.20176 7.42700 2.91961 -103.03868 1196.74947
8465.0000 -111.01627 -105.65342 5.36285 2.84732 -103.99348 1124.70864
8470.0000 -111.57694 -104.89178 6.68516 2.75086 -105.26742 1067.36469
8475.0000 -111.16838 -103.25417 7.91421 2.93375 -102.85193 1222.84681
8480.0000 -111.92672 -104.37577 7.55094 2.86181 -103.80209 1122.25077
8485.0000 -111.54103 -104.12866 7.41237 2.85564 -103.88358 1161.08608
8490.0000 -110.41481 -104.49388 5.92093 2.83250 -104.18919 1113.99456
8495.0000 -111.35282 -103.05530 8.29752 2.85516 -103.88987 1176.70849
8500.0000 -109.87503 -103.99931 5.87572 2.96331 -102.46149 1228.18934
MELTING PROCESS: loop number 35 T-loop= 1170.0000000000000
main_MD> interactions number 35 at Temperature= 1170.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.95372 -3.29484 -2.32544
force_rgl> df(natom) -1.11881 3.80060 6.13145
8505.0000 -110.02828 -102.32412 7.70416 2.92512 -102.96588 1163.87497
8510.0000 -111.00095 -104.00233 6.99862 2.85819 -103.84980 1164.83628
8515.0000 -111.78162 -104.67463 7.10699 2.77110 -105.00014 1129.18450
8520.0000 -111.17971 -104.72004 6.45966 2.80102 -104.60493 1117.48624
8525.0000 -110.21632 -103.70468 6.51164 2.83257 -104.18827 1205.57898
8530.0000 -109.52947 -103.48770 6.04177 2.94051 -102.76259 1215.80437
8535.0000 -112.39902 -104.91760 7.48142 2.83725 -104.12648 1153.89646
8540.0000 -111.99283 -104.39623 7.59660 2.77173 -104.99180 1111.01880
8545.0000 -110.43951 -103.59793 6.84158 2.82296 -104.31511 1166.82212
8550.0000 -111.24824 -105.25584 5.99241 2.84729 -103.99385 1137.19410
8555.0000 -110.34308 -103.10055 7.24252 2.74330 -105.36725 1109.76508
8560.0000 -111.31050 -103.11225 8.19825 2.90195 -103.27195 1166.69815
8565.0000 -110.59436 -102.24716 8.34720 2.90495 -103.23223 1206.75085
8570.0000 -112.46230 -104.74527 7.71703 2.83548 -104.14982 1165.81621
8575.0000 -111.06124 -103.31688 7.74436 2.83905 -104.10269 1129.38777
8580.0000 -112.61766 -105.15994 7.45772 2.80031 -104.61430 1143.85279
8585.0000 -112.24245 -103.45882 8.78362 2.78783 -104.77911 1087.86572
8590.0000 -111.42638 -104.44224 6.98414 2.87533 -103.62354 1214.13780
8595.0000 -111.03631 -103.46866 7.56766 2.87957 -103.56752 1190.76311
8600.0000 -109.70323 -102.69091 7.01232 2.84924 -103.96807 1158.79547
8605.0000 -108.89885 -101.43612 7.46273 2.99034 -102.10452 1257.72987
8610.0000 -109.53984 -102.53448 7.00536 3.00813 -101.86951 1277.75738
8615.0000 -112.52542 -103.84929 8.67613 2.91030 -103.16164 1234.12607
8620.0000 -110.13211 -102.52265 7.60946 2.98725 -102.14522 1297.59921
8625.0000 -111.05497 -101.75631 9.29866 2.96707 -102.41186 1268.63596
8630.0000 -109.94402 -102.68530 7.25872 2.98657 -102.15424 1275.51796
8635.0000 -110.75970 -104.33341 6.42629 2.90279 -103.26085 1194.16998
8640.0000 -110.50502 -102.47481 8.03021 2.87992 -103.56286 1211.60292
8645.0000 -110.04984 -102.47161 7.57823 2.99914 -101.98827 1235.41095
8650.0000 -111.30496 -103.44153 7.86343 2.94505 -102.70259 1227.46260
8655.0000 -108.56155 -99.78597 8.77558 2.98903 -102.12181 1267.06442
8660.0000 -109.15144 -103.19911 5.95233 3.07600 -100.97315 1312.11393
8665.0000 -111.61989 -104.41227 7.20761 2.82760 -104.25392 1142.92483
8670.0000 -109.87616 -102.25043 7.62573 2.97097 -102.36035 1251.00947
8675.0000 -109.19493 -103.66940 5.52553 2.87804 -103.58767 1145.40451
8680.0000 -113.32040 -105.39709 7.92332 2.81129 -104.46929 1146.21679
8685.0000 -111.14340 -102.70678 8.43661 2.78798 -104.77714 1138.96753
8690.0000 -110.99106 -103.68852 7.30253 2.93175 -102.87827 1234.87308
8695.0000 -110.92246 -102.42270 8.49976 2.93507 -102.83439 1267.88266
8700.0000 -110.93511 -103.25116 7.68394 2.90878 -103.18169 1227.47570
8705.0000 -109.29771 -102.09615 7.20156 2.98448 -102.18187 1241.66678
8710.0000 -111.49768 -104.64171 6.85597 2.84855 -103.97714 1190.63643
8715.0000 -112.27259 -105.21535 7.05724 2.81234 -104.45540 1125.45308
8720.0000 -111.56784 -104.62282 6.94502 2.79046 -104.74443 1151.97077
8725.0000 -110.92038 -104.36386 6.55652 2.73180 -105.51921 1062.79010
8730.0000 -111.14918 -103.74797 7.40120 2.82552 -104.28133 1131.36326
8735.0000 -109.89572 -102.46039 7.43532 2.91896 -103.04728 1233.03338
8740.0000 -111.10488 -102.76781 8.33707 2.94606 -102.68933 1227.45138
8745.0000 -111.67701 -104.80630 6.87071 2.89859 -103.31622 1190.31101
8750.0000 -112.23434 -105.80959 6.42475 2.76347 -105.10096 1120.45626
MELTING PROCESS: loop number 36 T-loop= 1195.0000000000000
main_MD> interactions number 36 at Temperature= 1195.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.88700 -2.96663 0.12087
force_rgl> df(natom) -0.36710 2.59024 1.01291
8755.0000 -111.80730 -103.55615 8.25115 2.79378 -104.70056 1128.55745
8760.0000 -109.43780 -102.24170 7.19610 2.89653 -103.34352 1191.55326
8765.0000 -109.61392 -102.39274 7.22118 2.97715 -102.27864 1246.68712
8770.0000 -111.50118 -104.32058 7.18060 2.98859 -102.12753 1269.57605
8775.0000 -110.27337 -102.77832 7.49505 2.91596 -103.08689 1209.13930
8780.0000 -111.28543 -104.19643 7.08900 2.87572 -103.61833 1178.56656
8785.0000 -110.60575 -101.94691 8.65884 2.93963 -102.77416 1243.24679
8790.0000 -110.99694 -105.33238 5.66456 2.79472 -104.68819 1089.44936
8795.0000 -112.48151 -105.90709 6.57442 2.73498 -105.47717 1008.19319
8800.0000 -111.31736 -104.88132 6.43604 2.73131 -105.52567 1058.18149
8805.0000 -110.84657 -104.50824 6.33833 2.89788 -103.32560 1197.02301
8810.0000 -110.33838 -103.52671 6.81167 2.80997 -104.48675 1107.35300
8815.0000 -107.48427 -98.86065 8.62361 2.98372 -102.19188 1293.68720
8820.0000 -108.41711 -98.04086 10.37624 3.24142 -98.78821 1447.42356
8825.0000 -109.87201 -102.65336 7.21864 3.13489 -100.19528 1363.09194
8830.0000 -109.42261 -102.07747 7.34515 2.88669 -103.47343 1174.34299
8835.0000 -107.85350 -101.01860 6.83490 3.01693 -101.75320 1243.07326
8840.0000 -110.61711 -102.11924 8.49786 3.04566 -101.37381 1302.39887
8845.0000 -110.90414 -104.73705 6.16709 2.83179 -104.19851 1152.91227
8850.0000 -112.05664 -104.32874 7.72790 2.86963 -103.69878 1117.33603
8855.0000 -109.69111 -101.89010 7.80100 2.90303 -103.25767 1218.81374
8860.0000 -111.49077 -103.52249 7.96828 2.88870 -103.44687 1208.34652
8865.0000 -112.28632 -105.61078 6.67554 2.78145 -104.86347 1131.98271
8870.0000 -111.22342 -103.87339 7.35003 2.81398 -104.43371 1138.44375
8875.0000 -111.39431 -104.34713 7.04718 2.84790 -103.98579 1169.69535
8880.0000 -112.22386 -103.85444 8.36942 2.86029 -103.82207 1169.91485
8885.0000 -111.04085 -104.16993 6.87092 2.89403 -103.37644 1170.52614
8890.0000 -110.71000 -103.24625 7.46375 2.79988 -104.62002 1105.37716
8895.0000 -110.80521 -102.18657 8.61864 2.95105 -102.62343 1218.65673
8900.0000 -110.05008 -102.34732 7.70276 2.96771 -102.40337 1236.24153
8905.0000 -111.77183 -104.22516 7.54667 2.96049 -102.49864 1265.49596
8910.0000 -112.68808 -105.02815 7.65992 2.80993 -104.48727 1144.24799
8915.0000 -109.87745 -102.02360 7.85385 2.87268 -103.65852 1193.57836
8920.0000 -108.09519 -99.62442 8.47077 3.08469 -100.85832 1309.40597
8925.0000 -108.71252 -100.83812 7.87440 3.09981 -100.65862 1328.98622
8930.0000 -109.86424 -103.31847 6.54578 2.99780 -102.00596 1252.40258
8935.0000 -109.92325 -102.51088 7.41237 2.94615 -102.68804 1278.85355
8940.0000 -110.74654 -102.93603 7.81051 3.00060 -101.96893 1285.33305
8945.0000 -111.39267 -102.76635 8.62632 2.94684 -102.67897 1218.55625
8950.0000 -110.48125 -102.95048 7.53077 2.91163 -103.14399 1201.39675
8955.0000 -111.38692 -103.63144 7.75548 2.95052 -102.63040 1282.40440
8960.0000 -110.46204 -103.57645 6.88559 2.89345 -103.38417 1235.58025
8965.0000 -111.97554 -103.84437 8.13117 2.83495 -104.15681 1160.62731
8970.0000 -110.73824 -103.86523 6.87301 2.79434 -104.69321 1171.21670
8975.0000 -109.34092 -101.00647 8.33445 2.95456 -102.57702 1272.76784
8980.0000 -110.96016 -103.47688 7.48328 2.95419 -102.58197 1239.03398
8985.0000 -111.27710 -104.21540 7.06170 2.87263 -103.65912 1179.71395
8990.0000 -111.18312 -103.07891 8.10421 2.82486 -104.29003 1140.12251
8995.0000 -112.51543 -105.48721 7.02822 2.79410 -104.69637 1098.40086
9000.0000 -111.15523 -102.47972 8.67551 2.85961 -103.83106 1228.63417
main_MD> EXECUTION TIME: 0 [day], 0 [hour], 9 [min], 22.0746397 [s].
main_MD> Deallocating global variables
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