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nanoparticlesims/growth_Melting_Silver_ICO_3269/meltingSims/run_47/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_47.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 = 47 ntipo2 = 0
read_input> Finish reading input
main_MD> Allocating global variables
main_MD> Number of outputs that will be created: 1750
main_MD> Size of nv and nvoiz: 47 4700
main_MD> Size of nv and nvoiz: 47 4700
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 = 47
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> -3.3266987676156039E-002 -8.3417873271816566E-003 -7.7732469707746743E-003 initial drift of cluster / NP1 for coalescence
init> 0.30245819590660716 0.31546628550633338 0.29833227026091030 scaling for velocity /for coalescence NP1
init.f90 > facguy = 1.9206029980480502E-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) 0.87244 -0.63228 -0.57704
force_rgl> df(natom) 0.47312 1.85624 -0.84321
preparo> THERMALIZATION PROCESS AT 319.28461176723431
preparo> TOTAL ENERGY, KINETIC EN., POT. ENERGY, DELTA
5000 -115.73292645284143 2.0915817191634409 -117.82450817200487 3.8114829845842848E-004
preparo> END THERMALISATION ON NPAST DEFINE IN PARACLUSTER MODULE
main_MD> Time-loop is starting for melting
main_MD> Now the computation of EXECUTION TIME starts
main_MD> Running from loop 1 to 35
MELTING PROCESS: loop number 1 T-loop= 345.00000000000000
main_MD> interactions number 1 at Temperature= 345.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -2.69409 -1.84727 -1.14713
force_rgl> df(natom) 0.46489 -0.72898 -0.08339
5.0000 -117.52656 -114.82589 2.70067 1.81076 -115.06734 386.94925
10.0000 -117.64367 -115.33323 2.31044 1.82926 -114.82643 396.97671
15.0000 -117.30277 -114.87723 2.42554 1.79944 -115.21477 375.64330
20.0000 -117.49223 -115.06931 2.42292 1.81723 -114.98310 399.52714
25.0000 -117.65655 -115.45009 2.20646 1.78898 -115.35104 369.16752
30.0000 -117.38232 -115.30242 2.07991 1.78317 -115.42671 360.44626
35.0000 -117.10745 -115.13186 1.97559 1.79554 -115.26560 371.71796
40.0000 -117.85025 -115.72034 2.12992 1.79685 -115.24849 376.22380
45.0000 -117.74148 -115.88540 1.85608 1.73944 -115.99616 313.23434
50.0000 -117.60028 -115.58973 2.01056 1.75093 -115.84654 317.92260
55.0000 -117.74918 -115.34183 2.40735 1.77676 -115.51016 353.38551
60.0000 -117.53783 -115.60172 1.93612 1.78019 -115.46548 366.25643
65.0000 -117.46879 -115.58293 1.88586 1.77202 -115.57187 344.48447
70.0000 -117.74983 -115.48749 2.26234 1.77076 -115.58832 349.29889
75.0000 -117.70362 -115.95033 1.75329 1.75137 -115.84082 327.14191
80.0000 -117.93321 -115.65118 2.28203 1.75963 -115.73326 337.15293
85.0000 -117.63587 -115.80483 1.83104 1.75730 -115.76357 340.35568
90.0000 -117.87998 -116.13433 1.74565 1.75329 -115.81582 334.61578
95.0000 -117.54526 -115.15484 2.39041 1.78227 -115.43837 359.66520
100.0000 -117.57505 -115.71108 1.86397 1.78090 -115.45629 353.67005
105.0000 -117.31542 -115.21752 2.09790 1.80021 -115.20469 375.39029
110.0000 -117.67013 -115.80793 1.86220 1.77188 -115.57367 346.08883
115.0000 -117.75859 -115.54324 2.21535 1.74687 -115.89945 330.41705
120.0000 -117.98268 -115.93397 2.04871 1.74922 -115.86887 329.21753
125.0000 -117.73590 -115.89618 1.83972 1.75717 -115.76528 335.70123
130.0000 -118.08931 -116.27039 1.81892 1.73333 -116.07570 316.91690
135.0000 -118.26247 -115.81246 2.45002 1.76336 -115.68469 347.93794
140.0000 -117.88919 -115.33554 2.55364 1.76042 -115.72293 342.53563
145.0000 -117.68699 -115.53575 2.15124 1.78135 -115.45042 359.60342
150.0000 -117.86417 -115.78071 2.08346 1.75530 -115.78960 335.76699
155.0000 -118.00412 -116.15695 1.84717 1.72562 -116.17612 307.47401
160.0000 -117.59250 -116.05548 1.53702 1.73270 -116.08398 316.57061
165.0000 -118.00560 -116.09854 1.90706 1.71776 -116.27854 299.36960
170.0000 -117.41268 -115.60082 1.81186 1.75804 -115.75399 338.76251
175.0000 -117.77046 -115.57010 2.20036 1.79115 -115.32279 363.01445
180.0000 -117.81785 -115.72052 2.09732 1.77880 -115.48353 355.57579
185.0000 -117.47690 -115.10817 2.36874 1.78129 -115.45112 356.79014
190.0000 -117.36864 -114.76712 2.60151 1.81079 -115.06689 387.59157
195.0000 -117.67931 -115.49278 2.18653 1.80123 -115.19147 392.16214
200.0000 -117.79772 -115.19297 2.60475 1.77699 -115.50710 357.43740
205.0000 -117.42802 -115.05348 2.37455 1.81514 -115.01026 389.39118
210.0000 -117.67233 -115.41740 2.25493 1.79306 -115.29786 363.09793
215.0000 -117.75572 -115.46582 2.28990 1.76256 -115.69503 343.22361
220.0000 -117.11489 -114.98473 2.13017 1.79706 -115.24577 368.86071
225.0000 -117.31352 -115.66434 1.64919 1.81521 -115.00936 383.07573
230.0000 -117.65050 -115.80836 1.84215 1.74929 -115.86784 302.00407
235.0000 -117.82844 -115.93540 1.89304 1.75494 -115.79432 318.99175
240.0000 -117.29435 -115.60737 1.68698 1.76411 -115.67492 329.42232
245.0000 -117.94020 -115.60769 2.33251 1.78816 -115.36166 351.42330
250.0000 -117.53637 -115.55329 1.98308 1.77507 -115.53212 348.59486
MELTING PROCESS: loop number 2 T-loop= 370.00000000000000
main_MD> interactions number 2 at Temperature= 370.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.20245 6.62578 -1.87950
force_rgl> df(natom) -1.70567 -1.66405 -0.55104
255.0000 -117.60330 -114.87324 2.73006 1.79325 -115.29535 367.89223
260.0000 -117.37623 -115.13320 2.24302 1.79449 -115.27926 367.31531
265.0000 -117.38717 -115.32618 2.06100 1.81527 -115.00863 368.17075
270.0000 -117.16159 -114.96371 2.19789 1.79375 -115.28886 342.94092
275.0000 -117.01509 -114.83509 2.18001 1.81999 -114.94714 366.18149
280.0000 -116.81137 -114.60320 2.20816 1.82868 -114.83397 377.00854
285.0000 -117.64474 -115.69537 1.94937 1.78306 -115.42809 350.41194
290.0000 -117.52170 -115.12693 2.39477 1.77974 -115.47134 347.78849
295.0000 -117.60415 -115.32712 2.27703 1.78794 -115.36452 354.19881
300.0000 -117.81413 -115.80945 2.00469 1.78041 -115.46256 350.67959
305.0000 -117.76891 -115.46657 2.30234 1.78534 -115.39846 355.27771
310.0000 -117.44570 -115.52216 1.92354 1.78356 -115.42154 351.59463
315.0000 -117.94175 -116.02180 1.91995 1.76967 -115.60253 336.76440
320.0000 -117.89436 -115.51127 2.38309 1.77692 -115.50806 347.37208
325.0000 -117.58243 -115.31442 2.26801 1.78937 -115.34594 356.72476
330.0000 -117.36717 -115.05590 2.31127 1.81367 -115.02949 389.34143
335.0000 -117.17698 -114.93143 2.24556 1.80997 -115.07765 386.26169
340.0000 -117.27081 -114.83868 2.43214 1.81927 -114.95652 393.23799
345.0000 -117.54202 -115.51618 2.02585 1.77468 -115.53725 345.10867
350.0000 -117.02637 -115.15617 1.87020 1.80665 -115.12082 373.06837
355.0000 -117.93733 -115.71093 2.22640 1.79481 -115.27511 361.48408
360.0000 -117.71605 -115.43132 2.28473 1.75881 -115.74391 320.95579
365.0000 -117.26397 -115.28625 1.97772 1.78165 -115.44651 347.07674
370.0000 -117.40916 -114.75443 2.65473 1.82398 -114.89514 384.36688
375.0000 -117.27090 -115.46462 1.80628 1.82239 -114.91585 393.60253
380.0000 -117.91601 -115.99372 1.92229 1.75805 -115.75376 318.67353
385.0000 -117.48353 -115.62154 1.86199 1.78283 -115.43113 358.33145
390.0000 -117.31146 -114.66227 2.64919 1.80718 -115.11400 388.70288
395.0000 -117.43246 -115.32159 2.11088 1.80314 -115.16657 379.84424
400.0000 -117.95612 -115.55575 2.40037 1.78427 -115.41239 365.76158
405.0000 -117.52906 -115.11423 2.41483 1.79579 -115.26224 378.96704
410.0000 -117.48370 -115.05944 2.42426 1.82452 -114.88817 402.61563
415.0000 -117.44861 -115.31298 2.13563 1.80582 -115.13164 379.23542
420.0000 -117.45750 -114.73372 2.72379 1.81954 -114.95302 398.78916
425.0000 -117.90497 -115.25161 2.65337 1.81263 -115.04303 397.53925
430.0000 -117.37300 -115.31294 2.06006 1.78522 -115.40000 367.62347
435.0000 -117.61367 -115.44158 2.17209 1.79943 -115.21487 378.00839
440.0000 -117.53099 -115.44508 2.08591 1.79205 -115.31103 375.45474
445.0000 -117.72946 -115.77946 1.95000 1.74889 -115.87314 338.00226
450.0000 -117.38768 -115.17702 2.21065 1.76230 -115.69841 337.67660
455.0000 -117.68851 -115.28442 2.40409 1.79474 -115.27593 369.95460
460.0000 -118.14867 -115.86713 2.28153 1.78031 -115.46388 362.49083
465.0000 -117.45221 -115.38333 2.06888 1.76729 -115.63345 348.61099
470.0000 -117.18497 -114.96227 2.22270 1.80358 -115.16079 385.68925
475.0000 -117.93547 -115.99317 1.94231 1.80220 -115.17887 386.21584
480.0000 -117.61734 -115.41930 2.19804 1.76646 -115.64427 351.33272
485.0000 -117.37165 -115.03829 2.33336 1.78212 -115.44031 365.84719
490.0000 -117.87044 -115.35655 2.51389 1.80715 -115.11429 396.63094
495.0000 -117.47207 -115.69563 1.77643 1.76400 -115.67638 350.94953
500.0000 -117.93745 -115.45563 2.48182 1.76027 -115.72488 342.13634
MELTING PROCESS: loop number 3 T-loop= 395.00000000000000
main_MD> interactions number 3 at Temperature= 395.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.67360 -1.28648 1.46093
force_rgl> df(natom) -0.64789 0.37727 2.30473
505.0000 -117.72362 -115.85841 1.86521 1.75461 -115.79864 339.74789
510.0000 -117.57746 -115.13050 2.44695 1.77033 -115.59383 350.22732
515.0000 -117.27447 -114.95600 2.31847 1.81613 -114.99740 395.10156
520.0000 -117.94119 -116.01614 1.92505 1.77354 -115.55210 349.09884
525.0000 -117.28161 -115.16289 2.11872 1.76538 -115.65840 338.75308
530.0000 -117.90701 -115.47726 2.42975 1.78539 -115.39780 354.47186
535.0000 -118.04733 -115.73751 2.30982 1.75886 -115.74323 341.97815
540.0000 -117.69380 -115.03742 2.65638 1.80531 -115.13830 390.79411
545.0000 -117.25735 -115.32095 1.93639 1.80066 -115.19894 376.83047
550.0000 -117.44714 -115.02060 2.42654 1.78848 -115.35745 367.39917
555.0000 -117.50029 -115.28960 2.21069 1.79972 -115.21118 379.32989
560.0000 -117.16667 -114.72510 2.44157 1.82102 -114.93365 392.46975
565.0000 -116.89420 -114.39882 2.49538 1.85623 -114.47516 441.98103
570.0000 -117.73208 -115.24653 2.48555 1.83053 -114.80991 421.21194
575.0000 -117.50466 -115.05723 2.44743 1.81759 -114.97844 389.12000
580.0000 -117.24157 -114.75742 2.48414 1.82472 -114.88556 404.66925
585.0000 -117.22957 -114.86044 2.36913 1.81884 -114.96217 402.52389
590.0000 -117.39314 -115.01256 2.38058 1.82618 -114.86654 406.35034
595.0000 -117.51214 -115.18712 2.32502 1.79312 -115.29705 374.30206
600.0000 -117.68746 -115.36499 2.32246 1.77481 -115.53548 365.09533
605.0000 -117.60435 -115.29646 2.30789 1.78335 -115.42432 372.52373
610.0000 -117.78230 -115.53438 2.24793 1.80278 -115.17128 388.18999
615.0000 -117.76591 -115.43392 2.33199 1.79125 -115.32138 377.46650
620.0000 -117.39039 -114.53453 2.85587 1.82484 -114.88400 401.30623
625.0000 -117.28757 -114.73603 2.55154 1.84033 -114.68220 422.91026
630.0000 -117.52274 -115.08687 2.43587 1.82278 -114.91078 398.33876
635.0000 -117.37150 -114.97306 2.39844 1.78872 -115.35434 364.25328
640.0000 -117.50706 -114.98620 2.52086 1.80334 -115.16403 370.84394
645.0000 -117.41552 -114.40613 3.00939 1.82741 -114.85051 402.96978
650.0000 -117.05577 -114.87393 2.18184 1.82667 -114.86014 400.04733
655.0000 -116.92529 -114.80934 2.11594 1.82460 -114.88712 373.10912
660.0000 -117.10472 -114.61713 2.48759 1.82243 -114.91537 372.13262
665.0000 -117.12640 -114.86751 2.25889 1.81000 -115.07724 364.93738
670.0000 -116.64007 -114.38171 2.25836 1.83585 -114.74061 377.28987
675.0000 -117.26132 -114.63557 2.62575 1.84199 -114.66067 375.39566
680.0000 -117.17995 -114.82150 2.35845 1.83305 -114.77704 379.44457
685.0000 -117.50032 -114.82136 2.67896 1.82673 -114.85930 373.85489
690.0000 -116.98500 -114.48732 2.49768 1.84417 -114.63216 387.91590
695.0000 -117.46457 -114.97284 2.49172 1.83542 -114.74611 392.03392
700.0000 -116.42314 -113.85448 2.56866 1.87550 -114.22417 414.57591
705.0000 -116.93311 -114.08694 2.84617 1.90152 -113.88528 453.79992
710.0000 -116.91180 -114.90233 2.00947 1.88121 -114.14984 451.45217
715.0000 -117.68400 -114.86942 2.81459 1.81531 -115.00805 388.24499
720.0000 -116.98958 -114.67289 2.31669 1.82847 -114.83674 409.26725
725.0000 -117.03555 -114.26157 2.77398 1.84673 -114.59890 415.86457
730.0000 -117.06900 -114.27567 2.79334 1.86586 -114.34976 447.96010
735.0000 -117.35643 -114.81730 2.53913 1.83821 -114.70988 418.58285
740.0000 -117.24104 -114.64465 2.59639 1.82537 -114.87712 415.41215
745.0000 -117.40716 -115.06323 2.34393 1.82005 -114.94636 390.34229
750.0000 -117.38004 -114.81417 2.56587 1.83215 -114.78880 399.58947
MELTING PROCESS: loop number 4 T-loop= 420.00000000000000
main_MD> interactions number 4 at Temperature= 420.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.80566 0.66158 0.21340
force_rgl> df(natom) -0.02852 -0.25613 0.89598
755.0000 -117.12248 -114.69924 2.42324 1.84543 -114.61582 402.98439
760.0000 -117.22443 -114.38993 2.83449 1.86410 -114.37268 437.92144
765.0000 -116.82140 -114.24093 2.58048 1.86684 -114.33701 415.34802
770.0000 -116.46013 -114.32334 2.13679 1.88294 -114.12732 430.47160
775.0000 -116.73739 -113.86006 2.87733 1.87847 -114.18556 421.25543
780.0000 -117.20576 -114.33033 2.87543 1.88321 -114.12374 441.75525
785.0000 -117.02432 -114.61028 2.41404 1.84544 -114.61572 408.11415
790.0000 -116.43160 -113.39285 3.03875 1.87346 -114.25076 433.15840
795.0000 -116.35553 -113.46725 2.88828 1.92200 -113.61858 469.14597
800.0000 -116.62635 -113.58901 3.03734 1.91593 -113.69769 469.75761
805.0000 -116.39358 -113.75668 2.63690 1.93312 -113.47382 470.98125
810.0000 -116.87589 -114.18357 2.69232 1.89949 -113.91175 470.13467
815.0000 -116.57992 -113.50005 3.07987 1.91334 -113.73132 469.68996
820.0000 -116.66250 -113.88720 2.77530 1.90324 -113.86294 469.38359
825.0000 -117.40284 -114.80764 2.59519 1.87064 -114.28755 442.00920
830.0000 -116.97756 -114.26808 2.70948 1.85701 -114.46504 431.19015
835.0000 -117.31354 -114.85372 2.45982 1.84678 -114.59820 402.24920
840.0000 -116.72614 -114.00521 2.72093 1.86284 -114.38910 403.29235
845.0000 -116.91274 -114.43337 2.47937 1.88022 -114.16272 417.51856
850.0000 -116.88114 -114.34340 2.53774 1.84263 -114.65222 369.49893
855.0000 -116.92095 -114.11950 2.80146 1.86907 -114.30795 409.94322
860.0000 -116.90231 -115.07648 1.82583 1.84466 -114.62584 388.59569
865.0000 -116.95467 -114.82107 2.13359 1.84647 -114.60220 364.07579
870.0000 -116.80470 -114.31753 2.48718 1.85514 -114.48930 388.34440
875.0000 -117.11681 -114.63195 2.48486 1.85375 -114.50752 403.55747
880.0000 -117.15102 -114.80703 2.34400 1.81961 -114.95208 359.77281
885.0000 -116.41651 -114.55024 1.86627 1.83489 -114.75314 371.97127
890.0000 -116.73070 -114.23516 2.49554 1.87981 -114.16807 410.37570
895.0000 -116.56665 -113.57937 2.98728 1.87448 -114.23750 406.33297
900.0000 -116.06322 -113.56841 2.49481 1.92578 -113.56935 448.06208
905.0000 -116.99773 -114.53979 2.45794 1.88208 -114.13850 412.96146
910.0000 -117.24753 -114.60221 2.64532 1.86380 -114.37656 412.12463
915.0000 -117.25749 -114.75523 2.50226 1.83465 -114.75619 392.56220
920.0000 -117.43802 -114.85624 2.58177 1.83548 -114.74537 391.88255
925.0000 -116.48678 -113.73155 2.75523 1.88463 -114.10532 422.34384
930.0000 -116.49993 -114.38786 2.11206 1.89348 -113.99007 419.49679
935.0000 -116.33391 -114.08668 2.24724 1.90634 -113.82253 438.25201
940.0000 -116.53469 -114.20645 2.32824 1.89696 -113.94475 422.20844
945.0000 -116.21768 -113.01687 3.20081 1.90160 -113.88428 426.90551
950.0000 -116.25706 -113.71814 2.53892 1.94203 -113.35777 449.75736
955.0000 -116.26822 -113.69346 2.57475 1.90221 -113.87638 436.13359
960.0000 -116.77190 -114.34452 2.42737 1.88699 -114.07456 426.97639
965.0000 -116.96064 -114.62275 2.33789 1.85029 -114.55250 382.53106
970.0000 -116.42658 -113.84900 2.57758 1.89061 -114.02743 431.86412
975.0000 -116.72852 -114.06035 2.66817 1.90844 -113.79517 456.27317
980.0000 -116.42231 -113.62970 2.79260 1.86917 -114.30660 424.96967
985.0000 -115.93858 -113.69591 2.24267 1.89305 -113.99568 445.27190
990.0000 -116.97895 -114.37925 2.59970 1.90884 -113.79004 443.07957
995.0000 -116.87675 -114.28404 2.59271 1.85874 -114.44248 403.06038
1000.0000 -116.59668 -114.11176 2.48491 1.87000 -114.29584 417.11819
MELTING PROCESS: loop number 5 T-loop= 445.00000000000000
main_MD> interactions number 5 at Temperature= 445.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.32969 1.30899 -0.96377
force_rgl> df(natom) -1.59119 0.34624 0.76562
1005.0000 -116.47094 -113.82878 2.64215 1.93160 -113.49351 477.78557
1010.0000 -116.42472 -113.35227 3.07245 1.91836 -113.66596 463.72171
1015.0000 -116.32600 -112.95537 3.37064 1.94542 -113.31360 470.70289
1020.0000 -116.90328 -114.04116 2.86211 1.93277 -113.47827 456.36128
1025.0000 -116.01546 -113.34802 2.66744 1.90998 -113.77514 440.23536
1030.0000 -116.08208 -113.24968 2.83240 1.92919 -113.52492 441.16946
1035.0000 -116.39695 -113.79339 2.60356 1.93965 -113.38867 462.04595
1040.0000 -116.27370 -113.20416 3.06954 1.93387 -113.46404 461.19746
1045.0000 -115.93380 -113.26283 2.67097 1.93978 -113.38704 487.50033
1050.0000 -116.93524 -114.09232 2.84292 1.89356 -113.98901 445.41740
1055.0000 -116.55605 -114.23746 2.31859 1.87216 -114.26774 424.52674
1060.0000 -116.13559 -113.83575 2.29984 1.88792 -114.06238 435.79946
1065.0000 -116.46541 -113.69734 2.76807 1.90357 -113.85865 435.18140
1070.0000 -117.06881 -114.53741 2.53140 1.86505 -114.36024 403.76678
1075.0000 -116.82508 -113.85647 2.96862 1.87519 -114.22820 391.01056
1080.0000 -116.45318 -113.49533 2.95785 1.94128 -113.36749 477.14620
1085.0000 -115.89638 -112.57249 3.32389 1.97770 -112.89317 502.50476
1090.0000 -115.88517 -112.86504 3.02013 1.96580 -113.04810 496.71371
1095.0000 -116.89821 -113.87095 3.02726 1.95339 -113.20975 462.27808
1100.0000 -116.21209 -113.45853 2.75356 1.91782 -113.67303 432.54759
1105.0000 -116.43136 -113.56811 2.86325 1.90424 -113.84993 418.97424
1110.0000 -116.80166 -114.18292 2.61874 1.89188 -114.01086 430.03266
1115.0000 -116.06808 -113.08619 2.98188 1.93936 -113.39253 463.45761
1120.0000 -116.14673 -113.38727 2.75946 1.96271 -113.08845 487.39257
1125.0000 -116.37577 -113.50100 2.87477 1.96477 -113.06160 488.93562
1130.0000 -115.69259 -112.94542 2.74718 1.97426 -112.93793 499.33313
1135.0000 -117.05050 -114.48844 2.56206 1.92215 -113.61666 467.94862
1140.0000 -116.57971 -114.36286 2.21685 1.85449 -114.49786 401.73241
1145.0000 -116.36026 -113.69599 2.66427 1.92187 -113.62024 463.72049
1150.0000 -116.04786 -113.93487 2.11299 1.91043 -113.76932 444.93785
1155.0000 -116.06903 -113.79504 2.27399 1.90992 -113.77594 394.35169
1160.0000 -116.01339 -113.16629 2.84710 1.93036 -113.50973 438.96204
1165.0000 -116.02698 -113.36389 2.66309 1.96358 -113.07705 478.91239
1170.0000 -116.63052 -114.06282 2.56770 1.90664 -113.81861 447.27215
1175.0000 -116.16671 -113.65769 2.50902 1.89302 -113.99597 421.70427
1180.0000 -116.45994 -113.27142 3.18852 1.93962 -113.38909 453.81488
1185.0000 -116.17788 -112.75710 3.42078 1.96208 -113.09656 476.16124
1190.0000 -116.40533 -113.82512 2.58021 1.93577 -113.43929 456.54986
1195.0000 -116.16401 -112.93063 3.23338 1.92250 -113.61209 461.79784
1200.0000 -115.64316 -113.16551 2.47765 1.96696 -113.03308 493.14504
1205.0000 -116.02816 -113.01332 3.01484 1.93695 -113.42383 457.23674
1210.0000 -115.76644 -112.61077 3.15567 1.97064 -112.98514 474.01254
1215.0000 -117.13506 -114.17612 2.95894 1.90817 -113.79873 450.52614
1220.0000 -116.86518 -114.48236 2.38282 1.85604 -114.47769 413.05003
1225.0000 -116.61068 -113.60396 3.00671 1.87843 -114.18604 422.81602
1230.0000 -116.47305 -113.88404 2.58901 1.93044 -113.50868 455.65544
1235.0000 -117.07068 -114.08504 2.98563 1.87990 -114.16694 414.59383
1240.0000 -115.79725 -113.50521 2.29203 1.92610 -113.56522 465.89174
1245.0000 -116.24810 -113.71552 2.53259 1.92996 -113.51493 465.82121
1250.0000 -116.52116 -113.42450 3.09667 1.94511 -113.31767 486.96778
MELTING PROCESS: loop number 6 T-loop= 470.00000000000000
main_MD> interactions number 6 at Temperature= 470.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.33276 0.58170 -0.04244
force_rgl> df(natom) 0.64668 -0.86858 -0.52665
1255.0000 -116.17018 -112.69489 3.47529 1.93966 -113.38857 468.89774
1260.0000 -114.86428 -112.27105 2.59323 2.00825 -112.49530 528.58423
1265.0000 -116.54719 -113.46680 3.08039 1.99949 -112.60939 527.72756
1270.0000 -116.20747 -113.35218 2.85529 1.93458 -113.45469 466.87449
1275.0000 -116.65628 -113.85730 2.79898 1.89585 -113.95920 444.33298
1280.0000 -116.31794 -113.55738 2.76056 1.90251 -113.87245 433.70042
1285.0000 -116.30983 -113.24513 3.06470 1.92422 -113.58972 460.56606
1290.0000 -116.94305 -114.20112 2.74193 1.92272 -113.60924 449.92196
1295.0000 -116.67661 -114.63545 2.04116 1.85048 -114.55005 396.76721
1300.0000 -116.25760 -113.58508 2.67251 1.87052 -114.28903 415.80788
1305.0000 -116.61548 -113.65464 2.96083 1.90114 -113.89031 423.93656
1310.0000 -116.93645 -114.00521 2.93124 1.89538 -113.96528 426.59172
1315.0000 -116.66985 -114.11511 2.55474 1.89161 -114.01436 442.23960
1320.0000 -116.07215 -113.37980 2.69235 1.93249 -113.48192 475.70479
1325.0000 -116.15641 -113.14173 3.01468 1.93786 -113.41203 480.01298
1330.0000 -116.98238 -114.19862 2.78376 1.91333 -113.73147 467.20038
1335.0000 -116.62374 -114.05681 2.56692 1.86572 -114.35151 429.18932
1340.0000 -116.45493 -113.50321 2.95171 1.92885 -113.52942 492.45796
1345.0000 -116.63312 -113.66991 2.96321 1.91318 -113.73348 480.46502
1350.0000 -117.31780 -114.59707 2.72074 1.89215 -114.00733 464.45259
1355.0000 -117.10393 -114.27596 2.82797 1.85787 -114.45382 429.89801
1360.0000 -116.61166 -114.09514 2.51652 1.87893 -114.17946 448.37589
1365.0000 -117.21445 -114.27660 2.93785 1.89480 -113.97286 481.28795
1370.0000 -116.70734 -113.92737 2.77997 1.88998 -114.03557 468.15611
1375.0000 -117.49651 -113.38214 4.11437 1.89051 -114.02869 479.26118
1380.0000 -116.45334 -113.59932 2.85402 1.94286 -113.34696 513.27278
1385.0000 -116.65091 -113.32167 3.32924 1.97579 -112.91800 542.40682
1390.0000 -116.56719 -113.86225 2.70494 1.92133 -113.62726 468.26689
1395.0000 -115.55932 -112.92637 2.63295 1.93736 -113.41853 483.75593
1400.0000 -116.15613 -113.20310 2.95302 1.95771 -113.15349 508.67017
1405.0000 -115.32907 -111.94828 3.38079 2.02233 -112.31200 518.76555
1410.0000 -114.87065 -112.20713 2.66352 2.04559 -112.00895 535.86991
1415.0000 -116.05449 -112.92949 3.12500 2.02505 -112.27649 495.41214
1420.0000 -115.50981 -112.93278 2.57702 1.96579 -113.04829 470.28758
1425.0000 -115.83488 -113.29927 2.53560 1.94325 -113.34188 462.04892
1430.0000 -115.98158 -112.99658 2.98499 1.98314 -112.82236 496.72604
1435.0000 -116.25547 -112.90540 3.35007 1.97524 -112.92518 493.24647
1440.0000 -116.35763 -113.48719 2.87044 1.94622 -113.30319 495.92006
1445.0000 -116.46125 -113.52448 2.93677 1.92188 -113.62012 463.86234
1450.0000 -115.73149 -112.82714 2.90435 1.97521 -112.92563 514.58573
1455.0000 -116.27314 -112.71409 3.55905 1.97320 -112.95184 503.31717
1460.0000 -116.26189 -112.82504 3.43685 1.99825 -112.62550 542.14637
1465.0000 -116.34072 -113.43542 2.90530 1.93465 -113.45387 484.33347
1470.0000 -116.65647 -114.12171 2.53476 1.89979 -113.90790 479.65457
1475.0000 -116.92879 -114.40623 2.52257 1.85399 -114.50427 430.65432
1480.0000 -117.08186 -114.03328 3.04858 1.87818 -114.18935 449.93172
1485.0000 -117.41687 -114.89981 2.51706 1.85200 -114.53026 429.97017
1490.0000 -116.87027 -113.96728 2.90299 1.85408 -114.50312 441.31979
1495.0000 -116.69766 -113.52200 3.17566 1.87997 -114.16592 463.76365
1500.0000 -117.23368 -114.17498 3.05870 1.90098 -113.89230 487.63245
MELTING PROCESS: loop number 7 T-loop= 495.00000000000000
main_MD> interactions number 7 at Temperature= 495.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.43564 -0.22256 0.78511
force_rgl> df(natom) 0.72578 2.07198 -0.51929
1505.0000 -117.64824 -114.54263 3.10561 1.87809 -114.19045 461.85233
1510.0000 -117.25101 -113.60591 3.64511 1.89475 -113.97346 470.86765
1515.0000 -116.58398 -112.70317 3.88081 1.94595 -113.30667 512.84198
1520.0000 -115.49897 -112.74989 2.74908 1.99984 -112.60481 560.54924
1525.0000 -116.10106 -112.42835 3.67271 2.00925 -112.48232 524.94371
1530.0000 -115.06430 -111.85525 3.20906 2.04265 -112.04734 564.20770
1535.0000 -116.44045 -113.38033 3.06012 2.02251 -112.30953 541.44126
1540.0000 -115.48100 -112.42466 3.05634 1.98069 -112.85420 514.27564
1545.0000 -116.07442 -112.47631 3.59811 2.00613 -112.52290 532.00931
1550.0000 -115.59877 -112.13037 3.46840 2.01309 -112.43222 525.04453
1555.0000 -116.33836 -112.84753 3.49083 2.02100 -112.32929 537.35977
1560.0000 -116.69767 -113.34789 3.34979 1.93966 -113.38864 492.19155
1565.0000 -115.89515 -113.45485 2.44031 1.93603 -113.43587 462.00533
1570.0000 -115.97895 -113.12273 2.85621 1.95298 -113.21508 456.69863
1575.0000 -116.00915 -112.92752 3.08163 1.98419 -112.80865 511.42585
1580.0000 -116.44642 -114.14663 2.29979 1.90437 -113.84816 439.06524
1585.0000 -116.14871 -113.44934 2.69937 1.90910 -113.78656 437.64850
1590.0000 -117.10076 -113.98267 3.11809 1.92223 -113.61559 461.30800
1595.0000 -115.44138 -112.51760 2.92378 1.92007 -113.64375 458.85455
1600.0000 -115.99460 -112.74118 3.25342 1.97619 -112.91290 505.79484
1605.0000 -115.80447 -112.75719 3.04728 1.98088 -112.85174 506.45179
1610.0000 -115.98439 -112.72875 3.25564 1.97746 -112.89625 501.49911
1615.0000 -116.10660 -113.21089 2.89572 1.98413 -112.80945 512.10465
1620.0000 -115.30078 -112.37179 2.92899 1.95074 -113.24425 473.77977
1625.0000 -116.18599 -112.86524 3.32076 1.99782 -112.63117 512.24636
1630.0000 -115.70644 -112.39476 3.31168 1.99318 -112.69153 515.57376
1635.0000 -115.63034 -112.15554 3.47480 2.01894 -112.35603 517.13002
1640.0000 -115.27454 -111.70572 3.56882 2.02109 -112.32803 532.17440
1645.0000 -115.64160 -112.82829 2.81331 2.07169 -111.66914 573.85268
1650.0000 -116.38784 -113.17846 3.20938 1.98949 -112.73958 496.50467
1655.0000 -116.90116 -113.93252 2.96864 1.96277 -113.08767 489.87108
1660.0000 -116.65287 -113.58509 3.06778 1.91804 -113.67012 451.10329
1665.0000 -116.31869 -113.75490 2.56380 1.92840 -113.53519 469.11642
1670.0000 -115.83908 -112.87889 2.96019 1.93201 -113.48826 471.12541
1675.0000 -115.93243 -113.02578 2.90665 1.97532 -112.92420 478.21733
1680.0000 -116.01739 -113.25790 2.75949 1.99924 -112.61262 518.34016
1685.0000 -116.27059 -113.72097 2.54962 1.92851 -113.53386 470.01573
1690.0000 -116.35877 -113.91267 2.44609 1.91254 -113.74184 457.13373
1695.0000 -117.19293 -114.17930 3.01363 1.88453 -114.10663 424.66989
1700.0000 -116.63233 -114.10670 2.52563 1.89396 -113.98382 456.49020
1705.0000 -116.10424 -113.31142 2.79282 1.92286 -113.60742 464.03715
1710.0000 -116.43519 -113.72788 2.70732 1.93055 -113.50730 473.99271
1715.0000 -116.30412 -113.48092 2.82319 1.94871 -113.27069 490.57502
1720.0000 -115.55778 -112.37893 3.17885 1.95801 -113.14965 476.49110
1725.0000 -115.62821 -112.74744 2.88077 2.00521 -112.53492 511.57749
1730.0000 -115.52884 -112.35482 3.17402 2.00788 -112.50011 518.11266
1735.0000 -116.18872 -112.69611 3.49261 2.00947 -112.47941 530.07872
1740.0000 -115.94135 -113.03615 2.90521 1.97837 -112.88446 502.47143
1745.0000 -116.47551 -113.81011 2.66540 1.93814 -113.40845 475.28198
1750.0000 -116.19996 -113.82114 2.37882 1.89741 -113.93882 427.86756
MELTING PROCESS: loop number 8 T-loop= 520.00000000000000
main_MD> interactions number 8 at Temperature= 520.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.91896 0.12665 2.40637
force_rgl> df(natom) -0.03520 1.79413 2.69651
1755.0000 -115.89273 -112.98098 2.91174 1.94312 -113.34348 467.81677
1760.0000 -115.76472 -113.21086 2.55386 1.96326 -113.08123 490.73418
1765.0000 -115.99615 -113.30752 2.68864 1.97419 -112.93888 532.32393
1770.0000 -115.49605 -112.15574 3.34030 1.97171 -112.97117 480.60691
1775.0000 -115.24145 -112.22941 3.01205 2.00661 -112.51671 510.45337
1780.0000 -115.91241 -112.91937 2.99304 1.99084 -112.72208 496.49370
1785.0000 -115.69823 -112.85222 2.84600 1.95452 -113.19510 484.75187
1790.0000 -115.84125 -112.75811 3.08314 1.98932 -112.74178 520.29267
1795.0000 -116.90913 -113.67946 3.22966 1.94796 -113.28056 491.93208
1800.0000 -116.77060 -113.51035 3.26025 1.93892 -113.39822 473.76746
1805.0000 -115.31429 -111.89248 3.42182 1.99615 -112.65283 521.50517
1810.0000 -115.27638 -112.04246 3.23392 2.05391 -111.90067 547.83962
1815.0000 -115.84715 -113.35978 2.48737 1.97911 -112.87487 486.12932
1820.0000 -115.91692 -113.17391 2.74301 1.94647 -113.29986 467.37239
1825.0000 -116.39857 -113.34174 3.05683 1.92478 -113.58238 453.84912
1830.0000 -115.48709 -112.98549 2.50160 1.95677 -113.16578 499.87473
1835.0000 -115.97365 -112.75636 3.21729 1.96357 -113.07720 487.26277
1840.0000 -115.85065 -112.39447 3.45617 1.99850 -112.62232 514.56973
1845.0000 -115.49033 -111.71498 3.77536 2.08969 -111.43461 589.12129
1850.0000 -114.99736 -111.20513 3.79223 2.08946 -111.43760 575.95071
1855.0000 -115.91248 -112.11369 3.79880 2.08083 -111.55010 602.23224
1860.0000 -115.09625 -112.17127 2.92498 1.99934 -112.61132 534.54841
1865.0000 -114.51602 -111.32504 3.19098 2.04225 -112.05246 573.17612
1870.0000 -114.73670 -111.13245 3.60426 2.09582 -111.35488 572.22622
1875.0000 -116.14362 -113.18557 2.95804 2.03896 -112.09538 546.95019
1880.0000 -115.25939 -111.81408 3.44531 1.99992 -112.60375 510.96758
1885.0000 -114.96541 -112.36597 2.59945 2.06053 -111.81441 551.50229
1890.0000 -115.06278 -111.64425 3.41853 2.01784 -112.37043 516.28272
1895.0000 -115.40058 -112.83061 2.56997 2.03471 -112.15075 530.50392
1900.0000 -115.34458 -112.52526 2.81932 2.01175 -112.44974 519.07564
1905.0000 -115.67644 -113.49967 2.17677 1.95896 -113.13724 467.47417
1910.0000 -116.11149 -113.18277 2.92872 1.93507 -113.44836 445.69071
1915.0000 -115.07556 -112.42735 2.64821 2.00590 -112.52586 516.76310
1920.0000 -115.45559 -112.06518 3.39041 2.02985 -112.21404 526.37109
1925.0000 -115.22479 -111.68128 3.54351 2.06171 -111.79906 558.14838
1930.0000 -115.41821 -112.71286 2.70535 2.01136 -112.45482 509.48705
1935.0000 -115.36666 -112.72917 2.63750 2.00303 -112.56329 505.22951
1940.0000 -115.44341 -112.39208 3.05133 2.01554 -112.40032 503.57705
1945.0000 -115.34733 -113.20325 2.14408 1.97448 -112.93512 480.77754
1950.0000 -116.26215 -113.27930 2.98285 1.95569 -113.17989 483.80124
1955.0000 -115.80148 -112.57048 3.23100 2.00911 -112.48416 521.54673
1960.0000 -116.37714 -112.70825 3.66889 2.00900 -112.48550 540.33106
1965.0000 -115.97119 -112.44670 3.52449 2.00961 -112.47757 540.17125
1970.0000 -116.05699 -112.43575 3.62124 1.95183 -113.23014 489.09319
1975.0000 -116.62663 -113.31309 3.31354 1.94332 -113.34093 482.77856
1980.0000 -116.27402 -113.44332 2.83071 1.93424 -113.45913 454.19210
1985.0000 -116.03119 -112.64822 3.38296 1.98307 -112.82321 497.25802
1990.0000 -115.43772 -112.09253 3.34519 2.00570 -112.52857 517.06377
1995.0000 -115.50410 -112.07383 3.43027 2.02836 -112.23345 506.51753
2000.0000 -115.48346 -112.78745 2.69601 1.99359 -112.68627 498.67098
MELTING PROCESS: loop number 9 T-loop= 545.00000000000000
main_MD> interactions number 9 at Temperature= 545.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.66063 1.72424 0.52101
force_rgl> df(natom) 0.35947 -2.12750 -0.92785
2005.0000 -115.32610 -112.71273 2.61338 1.96547 -113.05245 477.16047
2010.0000 -115.69277 -111.51069 4.18207 2.05369 -111.90353 564.22993
2015.0000 -116.21095 -113.02608 3.18488 2.03652 -112.12710 543.61949
2020.0000 -115.35992 -111.64967 3.71025 2.03708 -112.11986 547.71368
2025.0000 -115.45358 -111.56511 3.88846 2.06176 -111.79841 591.57348
2030.0000 -115.60934 -112.31527 3.29407 2.02300 -112.30320 570.74975
2035.0000 -115.61953 -112.12791 3.49162 2.02850 -112.23163 553.56158
2040.0000 -115.33352 -111.80453 3.52899 2.04289 -112.04422 595.66162
2045.0000 -115.81240 -112.88904 2.92335 2.00746 -112.50564 550.02600
2050.0000 -115.83101 -112.43643 3.39458 1.99925 -112.61247 535.22629
2055.0000 -115.83269 -112.53907 3.29362 2.00406 -112.54981 528.76288
2060.0000 -115.79107 -112.71783 3.07324 1.98030 -112.85929 521.33820
2065.0000 -115.91820 -112.92056 2.99763 1.96393 -113.07257 496.36585
2070.0000 -116.10474 -112.97674 3.12800 1.96193 -113.09857 485.71475
2075.0000 -115.30071 -111.98440 3.31631 2.03000 -112.21206 545.73879
2080.0000 -115.59523 -112.28073 3.31450 2.03690 -112.12218 557.29680
2085.0000 -115.02316 -111.75445 3.26871 2.02326 -112.29980 536.29886
2090.0000 -116.14793 -113.09715 3.05078 2.02461 -112.28219 515.41525
2095.0000 -115.99249 -112.86136 3.13114 1.98763 -112.76389 511.20759
2100.0000 -115.38815 -111.68729 3.70087 2.00687 -112.51332 538.74576
2105.0000 -115.55962 -112.03596 3.52365 2.04028 -112.07820 542.81955
2110.0000 -116.04474 -113.03785 3.00690 2.01698 -112.38164 534.88555
2115.0000 -116.38687 -112.92848 3.45839 1.95174 -113.23133 498.13060
2120.0000 -115.85546 -112.01816 3.83730 1.98588 -112.78666 545.69261
2125.0000 -114.64070 -111.78119 2.85951 2.03472 -112.15063 546.59037
2130.0000 -115.17713 -112.29289 2.88424 2.05836 -111.84266 570.22358
2135.0000 -115.81041 -112.78021 3.03020 1.96559 -113.05089 500.92481
2140.0000 -116.05073 -112.46839 3.58234 2.01355 -112.42632 527.80945
2145.0000 -115.99966 -112.83653 3.16313 1.98960 -112.73818 507.30350
2150.0000 -115.29534 -111.77014 3.52521 1.99421 -112.67817 510.00287
2155.0000 -115.18192 -111.67276 3.50916 2.04125 -112.06558 559.70932
2160.0000 -115.99233 -112.78097 3.21135 2.00530 -112.53373 499.94458
2165.0000 -115.86056 -112.61956 3.24100 1.99626 -112.65147 535.58658
2170.0000 -115.37865 -112.11928 3.25937 1.99398 -112.68116 523.49983
2175.0000 -114.20763 -111.14360 3.06403 2.07872 -111.57758 593.56875
2180.0000 -114.12702 -110.84219 3.28484 2.07131 -111.67404 556.07008
2185.0000 -114.60215 -111.22095 3.38120 2.12233 -111.00955 616.94406
2190.0000 -115.48515 -112.25413 3.23103 2.08627 -111.47919 581.19998
2195.0000 -115.70626 -112.04290 3.66336 2.05698 -111.86063 548.12919
2200.0000 -115.25013 -111.32408 3.92605 2.05542 -111.88104 557.21791
2205.0000 -114.66144 -111.43682 3.22462 2.09816 -111.32437 579.37504
2210.0000 -115.18818 -111.58603 3.60215 2.06414 -111.76743 564.58130
2215.0000 -116.22862 -112.78986 3.43876 2.01755 -112.37412 525.77314
2220.0000 -115.88652 -112.62991 3.25661 2.01339 -112.42842 529.38911
2225.0000 -115.75901 -112.69107 3.06794 2.01129 -112.45566 534.35893
2230.0000 -115.69054 -112.65473 3.03581 1.99883 -112.61801 524.07927
2235.0000 -116.66253 -113.74705 2.91548 1.94683 -113.29517 471.69861
2240.0000 -115.52957 -112.17427 3.35530 1.96155 -113.10351 497.23289
2245.0000 -116.19787 -112.70123 3.49663 2.00826 -112.49524 560.36112
2250.0000 -115.93019 -112.83119 3.09900 1.96862 -113.01145 535.64192
MELTING PROCESS: loop number 10 T-loop= 570.00000000000000
main_MD> interactions number 10 at Temperature= 570.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.41709 0.28808 1.31526
force_rgl> df(natom) 3.23862 -2.01519 -3.69078
2255.0000 -115.48279 -112.19563 3.28716 1.99286 -112.69579 549.57006
2260.0000 -116.23845 -112.55525 3.68320 2.02157 -112.32176 570.90798
2265.0000 -116.04311 -112.70164 3.34146 1.99927 -112.61230 548.27555
2270.0000 -116.38122 -112.84033 3.54089 2.01874 -112.35875 565.43343
2275.0000 -116.53178 -112.75375 3.77803 2.02194 -112.31696 580.68856
2280.0000 -115.88668 -112.43560 3.45108 2.01564 -112.39904 582.48760
2285.0000 -116.46411 -113.40199 3.06213 2.01304 -112.43287 588.75137
2290.0000 -116.18705 -112.36436 3.82269 1.95735 -113.15815 544.02009
2295.0000 -116.32283 -113.75015 2.57268 1.96724 -113.02938 541.42892
2300.0000 -116.09255 -112.80317 3.28938 1.97062 -112.98545 520.75537
2305.0000 -116.59891 -113.00550 3.59341 2.00671 -112.51537 549.09543
2310.0000 -115.49254 -112.70647 2.78606 1.99381 -112.68336 550.58058
2315.0000 -115.86174 -112.40656 3.45517 1.97990 -112.86454 532.84759
2320.0000 -114.60165 -111.00089 3.60076 2.04615 -112.00169 554.78056
2325.0000 -115.84273 -112.32179 3.52094 2.06776 -111.72025 578.46985
2330.0000 -115.58175 -113.01937 2.56237 2.02107 -112.32833 524.73755
2335.0000 -115.31847 -112.41587 2.90260 2.01462 -112.41231 500.68090
2340.0000 -115.42271 -112.19521 3.22751 2.03015 -112.21012 547.94031
2345.0000 -115.36818 -112.29123 3.07696 1.99208 -112.70589 509.83288
2350.0000 -115.53028 -111.59956 3.93072 2.05925 -111.83105 585.78599
2355.0000 -114.78853 -111.89273 2.89580 2.05592 -111.87452 563.80545
2360.0000 -115.43807 -112.42420 3.01387 2.05049 -111.94515 543.09427
2365.0000 -114.75282 -112.15277 2.60005 2.00124 -112.58659 507.65669
2370.0000 -115.39380 -111.56013 3.83367 2.04484 -112.01873 574.24267
2375.0000 -115.26332 -111.64234 3.62098 2.05928 -111.83066 561.34098
2380.0000 -115.00404 -111.19892 3.80513 2.06517 -111.75395 540.24801
2385.0000 -115.51467 -111.56792 3.94675 2.08625 -111.47941 605.27715
2390.0000 -114.61874 -111.78264 2.83610 2.08000 -111.56092 579.28863
2395.0000 -114.91382 -111.51059 3.40323 2.02978 -112.21496 526.37568
2400.0000 -115.75645 -112.11417 3.64228 2.00539 -112.53258 537.62355
2405.0000 -115.91841 -111.68140 4.23701 2.04841 -111.97232 568.34658
2410.0000 -115.45264 -112.14971 3.30292 2.09701 -111.33939 582.45060
2415.0000 -115.36365 -111.93553 3.42812 2.02126 -112.32580 526.63710
2420.0000 -115.55620 -111.48205 4.07415 2.03859 -112.10015 547.99795
2425.0000 -115.43950 -110.69557 4.74393 2.07592 -111.61400 587.71030
2430.0000 -114.81623 -111.27397 3.54227 2.12995 -110.91030 625.70739
2435.0000 -115.11772 -111.45957 3.65815 2.07139 -111.67301 594.28233
2440.0000 -115.66676 -111.65495 4.01181 2.07186 -111.66684 579.22905
2445.0000 -115.18590 -111.62821 3.55769 2.07252 -111.65832 554.48964
2450.0000 -114.65564 -110.99875 3.65689 2.09019 -111.42817 589.15150
2455.0000 -115.40657 -111.60674 3.79982 2.09921 -111.31074 608.88865
2460.0000 -114.42794 -111.22661 3.20133 2.08837 -111.45179 586.39734
2465.0000 -115.04769 -111.39812 3.64957 2.12022 -111.03708 597.01308
2470.0000 -114.73993 -110.68843 4.05150 2.12545 -110.96889 632.17045
2475.0000 -115.14916 -111.47835 3.67081 2.12007 -111.03906 621.36809
2480.0000 -115.11851 -110.62422 4.49429 2.14447 -110.72125 650.05130
2485.0000 -113.90105 -110.25686 3.64419 2.12075 -111.03012 568.67492
2490.0000 -114.87422 -111.09334 3.78088 2.15649 -110.56471 579.32592
2495.0000 -114.04209 -110.83294 3.20915 2.14158 -110.75891 611.52978
2500.0000 -114.51180 -111.18185 3.32994 2.08139 -111.54279 583.12102
MELTING PROCESS: loop number 11 T-loop= 595.00000000000000
main_MD> interactions number 11 at Temperature= 595.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.81324 -2.26302 1.23507
force_rgl> df(natom) 0.01235 0.57768 1.09571
2505.0000 -113.60566 -109.88686 3.71880 2.13754 -110.81145 603.46270
2510.0000 -115.79184 -112.47020 3.32164 2.14682 -110.69066 633.66244
2515.0000 -114.77408 -111.04824 3.72584 2.08763 -111.46152 593.54076
2520.0000 -114.89874 -111.15595 3.74279 2.08584 -111.48485 586.82860
2525.0000 -115.14038 -111.92895 3.21143 2.08546 -111.48981 597.89046
2530.0000 -115.32375 -111.65928 3.66447 2.10044 -111.29462 599.23979
2535.0000 -113.93799 -109.96392 3.97407 2.15492 -110.58512 612.48743
2540.0000 -114.97380 -111.60658 3.36721 2.17170 -110.36659 636.17640
2545.0000 -115.37251 -111.15625 4.21626 2.11261 -111.13621 624.89302
2550.0000 -114.96564 -110.47266 4.49298 2.12658 -110.95419 671.90480
2555.0000 -114.39900 -110.59743 3.80157 2.15797 -110.54535 665.12609
2560.0000 -115.03275 -110.56109 4.47165 2.17032 -110.38453 645.94487
2565.0000 -115.43314 -111.38740 4.04574 2.12264 -111.00559 639.58786
2570.0000 -114.73663 -111.30657 3.43006 2.11699 -111.07911 609.58738
2575.0000 -115.49452 -112.28717 3.20734 2.01101 -112.45938 522.76172
2580.0000 -115.21600 -111.41337 3.80263 2.02586 -112.26601 538.88422
2585.0000 -114.44271 -109.78389 4.65882 2.13483 -110.84677 639.96640
2590.0000 -114.93950 -110.43160 4.50791 2.20636 -109.91515 677.53126
2595.0000 -114.20632 -110.02527 4.18106 2.16795 -110.41545 659.65927
2600.0000 -114.91866 -111.51015 3.40851 2.15522 -110.58129 638.02617
2605.0000 -114.69447 -111.47460 3.21987 2.09331 -111.38749 569.54533
2610.0000 -113.60397 -109.91838 3.68558 2.14026 -110.77601 590.13575
2615.0000 -114.55076 -111.01830 3.53246 2.15957 -110.52463 626.81402
2620.0000 -115.58919 -111.84412 3.74508 2.10347 -111.25523 572.17135
2625.0000 -115.55044 -111.51212 4.03832 2.07333 -111.64775 558.37816
2630.0000 -115.57780 -112.48436 3.09345 2.01971 -112.34606 539.65649
2635.0000 -115.09821 -111.39556 3.70265 2.03330 -112.16909 538.62799
2640.0000 -115.34361 -112.20533 3.13828 2.07327 -111.64850 594.28877
2645.0000 -115.45804 -111.74746 3.71057 2.03940 -112.08962 564.71539
2650.0000 -115.61458 -111.79850 3.81608 2.05832 -111.84327 560.10272
2655.0000 -114.55660 -110.98086 3.57574 2.09838 -111.32143 570.92106
2660.0000 -114.52204 -111.70583 2.81621 2.10969 -111.17415 603.07111
2665.0000 -114.10694 -110.38419 3.72275 2.15724 -110.55492 657.93059
2670.0000 -115.63161 -111.86433 3.76728 2.11419 -111.11560 566.27571
2675.0000 -114.80537 -110.97060 3.83478 2.09479 -111.36818 566.01023
2680.0000 -115.41755 -111.79984 3.61772 2.10041 -111.29502 586.50870
2685.0000 -115.49951 -111.93815 3.56136 2.08886 -111.44541 593.26393
2690.0000 -114.81429 -111.07272 3.74157 2.10631 -111.21824 581.93465
2695.0000 -114.89395 -111.23856 3.65539 2.07848 -111.58063 559.68074
2700.0000 -115.06029 -111.38448 3.67582 2.06302 -111.78201 558.52711
2705.0000 -115.46516 -111.69779 3.76736 2.09019 -111.42818 589.49528
2710.0000 -115.31034 -111.56501 3.74534 2.08135 -111.54334 569.13880
2715.0000 -114.20797 -109.97667 4.23130 2.11818 -111.06355 593.31351
2720.0000 -114.59948 -110.99894 3.60054 2.18794 -110.15503 650.60991
2725.0000 -114.64816 -111.46624 3.18192 2.10122 -111.28448 581.08258
2730.0000 -114.76753 -110.64181 4.12572 2.14331 -110.73636 608.14252
2735.0000 -115.58818 -112.20016 3.38802 2.09815 -111.32452 571.38066
2740.0000 -115.99725 -112.06866 3.92859 2.01408 -112.41943 514.60909
2745.0000 -114.71828 -111.26582 3.45246 2.08290 -111.52307 561.62852
2750.0000 -114.63882 -111.37246 3.26636 2.08008 -111.55981 547.29992
MELTING PROCESS: loop number 12 T-loop= 620.00000000000000
main_MD> interactions number 12 at Temperature= 620.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.32911 -1.38907 -1.79948
force_rgl> df(natom) -2.45598 2.45751 -3.36889
2755.0000 -114.83506 -110.93580 3.89926 2.08785 -111.45858 595.06967
2760.0000 -114.42075 -110.87292 3.54783 2.07801 -111.58680 582.08736
2765.0000 -114.68666 -110.53645 4.15021 2.18621 -110.17765 651.63915
2770.0000 -114.93576 -111.26442 3.67134 2.07528 -111.62237 556.59837
2775.0000 -113.63913 -110.04785 3.59128 2.11345 -111.12524 594.38772
2780.0000 -115.11665 -111.16246 3.95420 2.15979 -110.52173 677.22949
2785.0000 -114.46595 -110.99392 3.47203 2.11093 -111.15806 623.37751
2790.0000 -115.25226 -111.45951 3.79275 2.11689 -111.08048 596.11612
2795.0000 -114.20990 -110.55117 3.65873 2.18103 -110.24509 656.79151
2800.0000 -114.60528 -110.68714 3.91814 2.12342 -110.99536 624.62599
2805.0000 -115.69393 -111.93850 3.75543 2.10512 -111.23376 585.03003
2810.0000 -114.89954 -110.66801 4.23153 2.13066 -110.90102 613.20989
2815.0000 -115.23425 -111.42938 3.80487 2.12838 -110.93079 638.80861
2820.0000 -114.32810 -110.89707 3.43104 2.13972 -110.78304 637.26485
2825.0000 -114.52818 -111.06315 3.46503 2.07477 -111.62899 574.21384
2830.0000 -113.76375 -110.47042 3.29333 2.13010 -110.90843 615.33684
2835.0000 -114.59084 -110.36071 4.23013 2.17800 -110.28459 640.99861
2840.0000 -114.30362 -109.81094 4.49268 2.21095 -109.85542 680.07269
2845.0000 -114.41419 -110.83808 3.57610 2.14768 -110.67937 637.26935
2850.0000 -114.04223 -110.00920 4.03303 2.16618 -110.43842 646.63626
2855.0000 -114.16831 -110.68103 3.48728 2.17086 -110.37747 633.23211
2860.0000 -115.13967 -111.62308 3.51659 2.12641 -110.95637 628.55553
2865.0000 -115.18304 -111.48637 3.69667 2.07880 -111.57644 602.47512
2870.0000 -115.15446 -111.59843 3.55603 2.06909 -111.70289 569.29855
2875.0000 -115.41479 -112.07923 3.33556 2.02242 -112.31071 547.10165
2880.0000 -113.90370 -110.52910 3.37460 2.11667 -111.08333 601.92893
2885.0000 -113.60818 -110.31424 3.29394 2.12737 -110.94387 622.44151
2890.0000 -113.21217 -109.48409 3.72807 2.20921 -109.87811 633.24597
2895.0000 -115.38453 -111.25281 4.13172 2.15496 -110.58462 630.07821
2900.0000 -114.44231 -110.27997 4.16234 2.16560 -110.44604 640.48260
2905.0000 -114.95594 -111.47559 3.48034 2.14349 -110.73396 626.34971
2910.0000 -113.84848 -110.62423 3.22426 2.14065 -110.77092 621.22745
2915.0000 -114.23803 -110.46262 3.77541 2.15243 -110.61754 601.84473
2920.0000 -114.83953 -110.68895 4.15058 2.20095 -109.98567 694.37477
2925.0000 -115.05537 -111.22504 3.83034 2.14750 -110.68178 640.33054
2930.0000 -114.22788 -110.72744 3.50045 2.13350 -110.86410 606.93943
2935.0000 -113.98805 -110.67564 3.31242 2.13352 -110.86390 616.79242
2940.0000 -114.96450 -111.19969 3.76481 2.12226 -111.01045 614.85251
2945.0000 -114.59454 -110.73684 3.85771 2.13151 -110.88996 628.65368
2950.0000 -115.34670 -112.00853 3.33818 2.08569 -111.48680 601.37294
2955.0000 -115.86784 -111.55562 4.31223 2.05946 -111.82839 578.06773
2960.0000 -114.75243 -111.31046 3.44197 2.09909 -111.31217 616.45848
2965.0000 -115.37269 -111.75073 3.62195 2.08724 -111.46656 599.82348
2970.0000 -114.63734 -111.12001 3.51732 2.10423 -111.24523 623.10139
2975.0000 -115.77524 -112.73815 3.03708 2.06594 -111.74392 582.78470
2980.0000 -115.79888 -112.39111 3.40778 2.00042 -112.59722 534.57050
2985.0000 -115.46201 -111.43587 4.02614 2.04564 -112.00840 560.86348
2990.0000 -114.87849 -111.01898 3.85951 2.12353 -110.99400 632.43531
2995.0000 -115.59680 -111.99569 3.60111 2.05699 -111.86057 601.81521
3000.0000 -114.97808 -111.56335 3.41473 2.05436 -111.89480 584.96302
MELTING PROCESS: loop number 13 T-loop= 645.00000000000000
main_MD> interactions number 13 at Temperature= 645.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.27187 -0.58256 -0.27486
force_rgl> df(natom) 0.52907 0.05899 -1.10669
3005.0000 -114.63789 -110.64870 3.98919 2.08169 -111.53881 577.66318
3010.0000 -114.67909 -110.91788 3.76121 2.16596 -110.44129 642.58671
3015.0000 -113.78282 -110.25742 3.52539 2.18776 -110.15745 659.58406
3020.0000 -113.85182 -109.36000 4.49183 2.20333 -109.95471 636.14491
3025.0000 -114.91678 -110.67280 4.24398 2.17396 -110.33720 641.24452
3030.0000 -114.56592 -110.84570 3.72021 2.16434 -110.46251 668.17895
3035.0000 -114.57871 -111.31940 3.25931 2.09860 -111.31858 580.55023
3040.0000 -115.10860 -111.65631 3.45229 2.07230 -111.66115 558.77463
3045.0000 -115.19383 -111.73963 3.45420 2.10684 -111.21137 596.11130
3050.0000 -115.04800 -111.48542 3.56258 2.10912 -111.18158 616.23839
3055.0000 -114.79583 -111.02550 3.77033 2.14498 -110.71464 630.83417
3060.0000 -113.86189 -109.17564 4.68625 2.21403 -109.81524 696.23002
3065.0000 -113.87182 -109.70490 4.16693 2.21707 -109.77567 684.41630
3070.0000 -114.44944 -110.21676 4.23268 2.17749 -110.29113 662.95080
3075.0000 -114.79076 -110.60489 4.18587 2.15723 -110.55507 635.69126
3080.0000 -114.12569 -109.92693 4.19876 2.16432 -110.46267 668.75063
3085.0000 -113.85247 -109.10635 4.74612 2.20513 -109.93122 666.43975
3090.0000 -114.14866 -110.75882 3.38984 2.18445 -110.20050 681.87037
3095.0000 -114.78958 -111.72033 3.06925 2.08080 -111.55039 574.45622
3100.0000 -115.09736 -111.45102 3.64635 2.08828 -111.45306 586.47716
3105.0000 -114.70660 -111.48128 3.22531 2.11352 -111.12426 588.44285
3110.0000 -113.58518 -109.20393 4.38125 2.21063 -109.85956 678.13795
3115.0000 -114.26882 -110.24953 4.01929 2.23391 -109.55645 688.55448
3120.0000 -113.54452 -110.05390 3.49063 2.16880 -110.40439 673.07580
3125.0000 -113.88864 -109.95440 3.93424 2.20685 -109.90884 674.32661
3130.0000 -113.64008 -109.69539 3.94469 2.19966 -110.00248 677.89530
3135.0000 -114.12333 -110.12892 3.99441 2.20871 -109.88465 671.95260
3140.0000 -113.63106 -109.40295 4.22811 2.22175 -109.71481 680.32123
3145.0000 -113.40568 -109.66003 3.74565 2.21536 -109.79804 672.29442
3150.0000 -114.79247 -110.15074 4.64174 2.20454 -109.93887 680.87962
3155.0000 -114.67472 -109.88389 4.79083 2.23541 -109.53689 711.46563
3160.0000 -114.16437 -110.29141 3.87296 2.22264 -109.70317 670.83564
3165.0000 -114.53612 -110.30919 4.22693 2.19205 -110.10155 624.87802
3170.0000 -115.14023 -111.75175 3.38848 2.12483 -110.97703 616.73240
3175.0000 -114.22831 -110.55453 3.67379 2.15700 -110.55805 640.90119
3180.0000 -114.06094 -110.10587 3.95506 2.17180 -110.36530 654.95420
3185.0000 -115.26008 -110.57460 4.68548 2.18715 -110.16544 649.62080
3190.0000 -113.70382 -109.86436 3.83947 2.21717 -109.77445 677.14076
3195.0000 -113.03716 -108.75242 4.28473 2.23069 -109.59827 700.04859
3200.0000 -113.82981 -110.25419 3.57562 2.23797 -109.50352 691.71829
3205.0000 -113.71117 -108.87098 4.84019 2.22213 -109.70977 671.92646
3210.0000 -113.71864 -109.59291 4.12573 2.26757 -109.11807 700.79158
3215.0000 -113.74214 -110.52156 3.22058 2.19106 -110.11446 640.80088
3220.0000 -114.24886 -110.73555 3.51331 2.15089 -110.63761 627.99187
3225.0000 -114.99169 -111.38702 3.60467 2.13186 -110.88539 618.63606
3230.0000 -114.69014 -110.63887 4.05127 2.14439 -110.72231 647.18288
3235.0000 -114.06744 -109.76669 4.30076 2.20389 -109.94733 663.84426
3240.0000 -114.46978 -110.64998 3.81980 2.17429 -110.33281 628.96745
3245.0000 -114.36714 -110.42763 3.93951 2.15758 -110.55051 636.89963
3250.0000 -113.91902 -110.27338 3.64564 2.15791 -110.54617 641.30632
MELTING PROCESS: loop number 14 T-loop= 670.00000000000000
main_MD> interactions number 14 at Temperature= 670.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.27397 -0.00241 3.71156
force_rgl> df(natom) 0.62517 1.16115 2.14164
3255.0000 -113.85094 -110.05028 3.80066 2.20901 -109.88071 679.62205
3260.0000 -115.19833 -111.15388 4.04445 2.15677 -110.56101 647.53362
3265.0000 -114.79295 -111.35962 3.43333 2.13214 -110.88174 626.90795
3270.0000 -114.76916 -111.50932 3.25984 2.10561 -111.22728 619.03002
3275.0000 -114.60987 -110.96974 3.64014 2.15325 -110.60691 643.88261
3280.0000 -114.45012 -109.92346 4.52666 2.16931 -110.39771 653.88677
3285.0000 -115.13634 -111.01786 4.11847 2.16377 -110.46984 693.59151
3290.0000 -115.09923 -111.10926 3.98997 2.11942 -111.04751 636.68815
3295.0000 -114.22601 -109.81197 4.41404 2.13900 -110.79244 635.49807
3300.0000 -112.90474 -109.09822 3.80652 2.28265 -108.92156 754.52917
3305.0000 -113.35744 -109.31597 4.04147 2.24311 -109.43654 694.69030
3310.0000 -112.85834 -109.63167 3.22666 2.21598 -109.78990 671.48843
3315.0000 -114.35566 -110.31855 4.03711 2.17572 -110.31418 638.41060
3320.0000 -114.24255 -110.29568 3.94687 2.17206 -110.36190 641.14029
3325.0000 -113.85215 -110.00988 3.84227 2.14445 -110.72152 626.11252
3330.0000 -113.35118 -108.85400 4.49718 2.20049 -109.99170 684.63554
3335.0000 -114.62013 -109.57266 5.04747 2.26225 -109.18733 711.87012
3340.0000 -114.24513 -110.87962 3.36551 2.17565 -110.31512 651.60154
3345.0000 -114.68901 -111.06916 3.61985 2.13576 -110.83464 622.84136
3350.0000 -113.77471 -109.71725 4.05746 2.18326 -110.21600 661.05439
3355.0000 -114.68397 -110.77421 3.90976 2.18231 -110.22838 683.54437
3360.0000 -114.15563 -110.43108 3.72455 2.16849 -110.40841 632.43930
3365.0000 -114.72140 -110.26059 4.46081 2.17883 -110.27373 671.54384
3370.0000 -115.28603 -111.91339 3.37263 2.10050 -111.29388 589.09069
3375.0000 -114.90268 -111.61871 3.28398 2.08017 -111.55870 598.72043
3380.0000 -113.80251 -110.70089 3.10162 2.11237 -111.13933 591.78625
3385.0000 -114.19382 -109.75731 4.43651 2.16895 -110.40240 644.93759
3390.0000 -113.47767 -108.79325 4.68443 2.24324 -109.43490 707.05358
3395.0000 -113.29372 -109.36285 3.93088 2.28827 -108.84838 750.07647
3400.0000 -114.47465 -110.36487 4.10978 2.21387 -109.81735 676.61387
3405.0000 -114.14169 -110.59417 3.54753 2.15037 -110.64437 609.04822
3410.0000 -113.75052 -108.94262 4.80790 2.18833 -110.15002 665.12940
3415.0000 -114.40828 -110.01660 4.39168 2.24180 -109.45358 711.61229
3420.0000 -113.82037 -109.94347 3.87690 2.16830 -110.41090 675.17259
3425.0000 -114.41174 -110.57782 3.83392 2.19006 -110.12754 701.20154
3430.0000 -115.69270 -111.85719 3.83551 2.12563 -110.96665 653.54119
3435.0000 -114.08787 -109.84309 4.24478 2.10800 -111.19620 614.37081
3440.0000 -113.15879 -109.02589 4.13290 2.23435 -109.55065 704.87477
3445.0000 -114.88788 -110.77687 4.11101 2.19875 -110.01428 688.24323
3450.0000 -114.81479 -110.28301 4.53178 2.13788 -110.80712 661.36804
3455.0000 -113.20636 -108.82821 4.37815 2.21063 -109.85959 688.22197
3460.0000 -113.77375 -108.87336 4.90039 2.28970 -108.82986 743.83490
3465.0000 -114.78795 -111.01859 3.76936 2.21042 -109.86230 681.71955
3470.0000 -113.98957 -110.14766 3.84191 2.19596 -110.05065 673.04070
3475.0000 -113.76155 -109.22930 4.53225 2.21151 -109.84815 689.25247
3480.0000 -113.64802 -109.17042 4.47760 2.26046 -109.21068 715.95031
3485.0000 -113.95029 -108.70181 5.24848 2.27365 -109.03885 714.04795
3490.0000 -114.47217 -110.30999 4.16218 2.23503 -109.54185 714.38186
3495.0000 -113.50379 -109.60605 3.89774 2.19382 -110.07852 686.28802
3500.0000 -114.59071 -110.44828 4.14242 2.16920 -110.39917 664.91195
MELTING PROCESS: loop number 15 T-loop= 695.00000000000000
main_MD> interactions number 15 at Temperature= 695.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.51435 -1.44026 -0.14986
force_rgl> df(natom) 2.79406 -3.92705 -8.08974
3505.0000 -114.88055 -110.74547 4.13508 2.13880 -110.79511 626.83688
3510.0000 -113.68506 -109.00319 4.68187 2.19505 -110.06255 670.82123
3515.0000 -112.97306 -109.56047 3.41260 2.27207 -109.05936 725.87996
3520.0000 -114.12479 -109.80152 4.32327 2.24711 -109.38452 727.39907
3525.0000 -114.44662 -110.19314 4.25347 2.18211 -110.23101 663.51014
3530.0000 -113.89170 -109.30563 4.58607 2.25668 -109.25984 728.15606
3535.0000 -113.51185 -108.67409 4.83776 2.26858 -109.10489 693.66423
3540.0000 -112.23445 -107.62410 4.61035 2.33730 -108.20984 756.25723
3545.0000 -112.63441 -108.37077 4.26364 2.35947 -107.92110 785.05666
3550.0000 -112.85532 -107.49803 5.35729 2.39779 -107.42208 792.87810
3555.0000 -112.16394 -107.87666 4.28728 2.37300 -107.74500 783.28150
3560.0000 -112.92299 -109.09527 3.82772 2.29189 -108.80134 735.47446
3565.0000 -113.55114 -109.28799 4.26315 2.25204 -109.32028 711.43601
3570.0000 -113.44867 -109.06576 4.38291 2.25986 -109.21846 720.01815
3575.0000 -112.72785 -108.90222 3.82563 2.30203 -108.66924 741.09944
3580.0000 -114.16107 -110.27734 3.88373 2.25130 -109.32990 678.91413
3585.0000 -114.14619 -108.88435 5.26184 2.28588 -108.87949 711.49827
3590.0000 -114.19880 -109.78887 4.40992 2.19715 -110.03520 667.94057
3595.0000 -113.38356 -108.62739 4.75617 2.27323 -109.04436 685.87308
3600.0000 -113.72980 -108.88240 4.84740 2.29150 -108.80630 743.59122
3605.0000 -114.48986 -110.60704 3.88282 2.23651 -109.52252 695.64816
3610.0000 -114.83854 -110.44663 4.39190 2.15017 -110.64693 644.26511
3615.0000 -114.88533 -111.19530 3.69002 2.15364 -110.60186 629.23495
3620.0000 -114.75777 -110.66449 4.09328 2.17492 -110.32470 657.06869
3625.0000 -114.56216 -109.73910 4.82306 2.20479 -109.93563 704.99644
3630.0000 -113.73113 -109.23982 4.49131 2.26405 -109.16380 726.19258
3635.0000 -114.09880 -109.78817 4.31063 2.20802 -109.89355 703.96925
3640.0000 -114.28167 -110.03545 4.24621 2.19700 -110.03712 687.04137
3645.0000 -114.00970 -109.83214 4.17756 2.20527 -109.92940 690.07355
3650.0000 -114.45379 -109.95297 4.50082 2.19491 -110.06426 693.49501
3655.0000 -114.18985 -109.10707 5.08278 2.24307 -109.43716 720.23121
3660.0000 -113.75557 -109.13098 4.62459 2.27908 -108.96809 726.20410
3665.0000 -114.42142 -110.05627 4.36515 2.25528 -109.27803 716.32385
3670.0000 -114.12992 -109.33122 4.79870 2.22143 -109.71897 709.40659
3675.0000 -113.84210 -109.19946 4.64263 2.22682 -109.64867 690.25893
3680.0000 -114.02823 -108.61081 5.41742 2.27769 -108.98616 744.28350
3685.0000 -113.73665 -109.31997 4.41668 2.26190 -109.19186 718.90867
3690.0000 -114.36949 -110.26033 4.10916 2.22405 -109.68474 680.20305
3695.0000 -113.85990 -110.25649 3.60341 2.16918 -110.39941 652.74844
3700.0000 -113.08292 -109.70480 3.37812 2.17848 -110.27830 655.42355
3705.0000 -112.67909 -108.98007 3.69902 2.25272 -109.31144 707.12411
3710.0000 -113.73782 -109.27763 4.46019 2.27957 -108.96178 745.57177
3715.0000 -114.03232 -109.31869 4.71362 2.24396 -109.42556 718.80451
3720.0000 -113.21152 -109.20156 4.00996 2.29256 -108.79252 766.72124
3725.0000 -114.29757 -109.87357 4.42401 2.25856 -109.23540 723.88581
3730.0000 -114.44766 -109.84154 4.60612 2.18703 -110.16698 679.97922
3735.0000 -114.23834 -109.67949 4.55885 2.21701 -109.77651 707.33975
3740.0000 -114.75101 -110.82895 3.92206 2.23197 -109.58163 721.84815
3745.0000 -113.88612 -109.11295 4.77317 2.20861 -109.88587 676.86998
3750.0000 -113.79847 -109.55039 4.24808 2.24246 -109.44500 716.12888
MELTING PROCESS: loop number 16 T-loop= 720.00000000000000
main_MD> interactions number 16 at Temperature= 720.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.29486 -2.57722 -0.35508
force_rgl> df(natom) 4.68894 -0.11575 0.71546
3755.0000 -113.50232 -107.87309 5.62922 2.29244 -108.79413 766.00673
3760.0000 -114.78967 -108.84644 5.94323 2.31258 -108.53179 765.14800
3765.0000 -113.47022 -109.70271 3.76751 2.24923 -109.35689 735.49849
3770.0000 -114.24822 -110.36932 3.87890 2.18917 -110.13906 666.13929
3775.0000 -113.50547 -108.91632 4.58915 2.23743 -109.51057 708.51968
3780.0000 -114.16527 -109.06875 5.09652 2.30861 -108.58347 718.08301
3785.0000 -114.25187 -109.53083 4.72104 2.25637 -109.26390 714.20629
3790.0000 -112.80000 -108.03910 4.76090 2.26563 -109.14324 722.87902
3795.0000 -112.92346 -107.97190 4.95156 2.32441 -108.37773 773.84051
3800.0000 -112.89371 -109.08004 3.81367 2.30397 -108.64399 734.93875
3805.0000 -113.55968 -108.34413 5.21555 2.31670 -108.47815 755.85083
3810.0000 -113.00269 -108.97718 4.02551 2.30582 -108.61981 762.97466
3815.0000 -114.24655 -109.90892 4.33763 2.23148 -109.58806 720.47911
3820.0000 -114.75584 -110.88101 3.87483 2.13485 -110.84654 628.31686
3825.0000 -113.03389 -109.34769 3.68620 2.15100 -110.63619 639.60197
3830.0000 -113.45798 -108.51285 4.94513 2.25525 -109.27852 733.52088
3835.0000 -113.68702 -109.99227 3.69474 2.25200 -109.32077 718.82471
3840.0000 -113.71036 -109.98957 3.72079 2.21950 -109.74402 691.15674
3845.0000 -113.46106 -108.75214 4.70892 2.26964 -109.09104 747.39239
3850.0000 -113.85746 -109.90836 3.94910 2.23757 -109.50879 673.85756
3855.0000 -112.76394 -108.19857 4.56537 2.24142 -109.45858 679.18779
3860.0000 -112.02631 -108.46424 3.56206 2.33567 -108.23117 723.63127
3865.0000 -113.45902 -109.18604 4.27298 2.31400 -108.51338 761.41212
3870.0000 -113.82748 -109.83161 3.99587 2.23393 -109.55611 715.47251
3875.0000 -114.02541 -110.28882 3.73659 2.21647 -109.78358 702.00366
3880.0000 -114.39105 -109.65147 4.73958 2.14884 -110.66430 653.14799
3885.0000 -112.92513 -108.35647 4.56866 2.31304 -108.52585 790.19574
3890.0000 -113.46180 -108.22287 5.23892 2.37674 -107.69618 819.63207
3895.0000 -112.95101 -107.42684 5.52417 2.37864 -107.67147 823.30673
3900.0000 -113.08214 -108.35504 4.72710 2.36780 -107.81262 776.66205
3905.0000 -113.09448 -108.17467 4.91981 2.31931 -108.44420 781.13109
3910.0000 -114.18145 -110.12409 4.05737 2.27512 -109.01968 735.92320
3915.0000 -114.71535 -110.14678 4.56858 2.15065 -110.64073 653.31304
3920.0000 -114.03956 -109.64715 4.39241 2.20608 -109.91886 669.16652
3925.0000 -114.25402 -110.06805 4.18597 2.23398 -109.55542 687.85915
3930.0000 -112.71586 -107.97455 4.74131 2.29996 -108.69615 729.46599
3935.0000 -113.15282 -108.66864 4.48417 2.31723 -108.47124 750.33591
3940.0000 -114.26699 -110.34125 3.92574 2.23601 -109.52898 692.22558
3945.0000 -114.06356 -109.51291 4.55065 2.15948 -110.52577 644.47323
3950.0000 -114.47681 -110.44849 4.02832 2.15910 -110.53069 663.11435
3955.0000 -114.25992 -109.50015 4.75977 2.19568 -110.05422 692.18843
3960.0000 -114.80785 -110.57743 4.23042 2.18483 -110.19559 657.92162
3965.0000 -114.83621 -111.11555 3.72066 2.14088 -110.76796 638.31401
3970.0000 -113.57777 -109.96974 3.60804 2.20406 -109.94517 678.63117
3975.0000 -114.26509 -109.84028 4.42481 2.16597 -110.44126 682.68406
3980.0000 -114.14518 -110.12520 4.01998 2.23527 -109.53865 732.06208
3985.0000 -113.92446 -109.09678 4.82769 2.21741 -109.77123 722.33430
3990.0000 -113.70532 -108.87704 4.82827 2.26896 -109.09992 735.50020
3995.0000 -114.23351 -109.58688 4.64663 2.23377 -109.55823 726.79061
4000.0000 -114.00355 -110.25170 3.75185 2.23136 -109.58964 716.21515
MELTING PROCESS: loop number 17 T-loop= 745.00000000000000
main_MD> interactions number 17 at Temperature= 745.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.89241 -0.38700 1.20558
force_rgl> df(natom) 3.99563 -1.62916 2.39846
4005.0000 -114.03427 -109.54331 4.49096 2.17448 -110.33035 662.95580
4010.0000 -113.80999 -109.51371 4.29628 2.24750 -109.37946 715.87288
4015.0000 -112.83401 -108.45174 4.38227 2.27705 -108.99455 736.42250
4020.0000 -113.25095 -108.96606 4.28489 2.28096 -108.94361 728.29823
4025.0000 -114.37471 -110.13690 4.23781 2.24354 -109.43097 728.41705
4030.0000 -112.29876 -108.13857 4.16019 2.23635 -109.52457 732.98790
4035.0000 -113.94486 -109.52796 4.41690 2.24565 -109.40345 718.50893
4040.0000 -114.15684 -110.16871 3.98813 2.24865 -109.36441 736.25736
4045.0000 -114.15987 -109.95184 4.20803 2.17050 -110.38224 676.97779
4050.0000 -113.69857 -109.30407 4.39449 2.24134 -109.45962 705.33766
4055.0000 -113.94366 -109.18366 4.76000 2.24339 -109.43295 709.59423
4060.0000 -113.27891 -108.47442 4.80449 2.31809 -108.46012 769.95930
4065.0000 -113.28462 -108.68060 4.60401 2.29757 -108.72729 755.59985
4070.0000 -113.18524 -108.78198 4.40326 2.29098 -108.81317 758.03785
4075.0000 -113.27174 -109.09560 4.17615 2.28762 -108.85694 749.11309
4080.0000 -113.23937 -109.14108 4.09828 2.27251 -109.05368 720.32059
4085.0000 -114.12614 -109.68508 4.44106 2.23363 -109.56000 695.12220
4090.0000 -112.56907 -107.88249 4.68659 2.31378 -108.51622 776.25943
4095.0000 -114.13447 -109.15715 4.97732 2.32056 -108.42788 769.51359
4100.0000 -114.07222 -109.76952 4.30269 2.23941 -109.48481 705.57517
4105.0000 -113.54788 -109.06814 4.47974 2.24712 -109.38437 713.35512
4110.0000 -112.80055 -108.51612 4.28444 2.29496 -108.76136 755.10902
4115.0000 -113.59468 -109.89757 3.69711 2.22016 -109.73545 695.10852
4120.0000 -113.19687 -108.81153 4.38534 2.23358 -109.56064 693.45751
4125.0000 -113.07416 -107.69718 5.37698 2.29429 -108.77005 766.40094
4130.0000 -113.37358 -108.50691 4.86667 2.40873 -107.27959 808.16301
4135.0000 -113.31190 -108.55252 4.75938 2.37794 -107.68064 806.92300
4140.0000 -113.25994 -109.12799 4.13195 2.28563 -108.88286 741.05339
4145.0000 -113.95188 -109.86483 4.08705 2.23253 -109.57434 695.54361
4150.0000 -113.94035 -109.24379 4.69656 2.28718 -108.86256 743.59788
4155.0000 -114.69851 -109.71140 4.98711 2.28360 -108.90926 730.63980
4160.0000 -112.63993 -107.99104 4.64889 2.27697 -108.99555 740.09411
4165.0000 -114.43784 -109.05878 5.37907 2.30042 -108.69015 763.27619
4170.0000 -114.02492 -108.25796 5.76696 2.29383 -108.77602 759.16975
4175.0000 -113.14662 -108.35909 4.78754 2.28900 -108.83892 756.33595
4180.0000 -114.65955 -109.23246 5.42709 2.29878 -108.71151 737.07541
4185.0000 -113.60693 -109.87332 3.73360 2.22065 -109.72905 662.85291
4190.0000 -113.55108 -109.19244 4.35864 2.26381 -109.16694 688.89539
4195.0000 -112.13505 -107.41935 4.71570 2.37171 -107.76180 826.82106
4200.0000 -112.25933 -107.75375 4.50558 2.33499 -108.23991 781.06357
4205.0000 -114.12364 -109.29733 4.82631 2.33508 -108.23877 763.87121
4210.0000 -112.68500 -108.04294 4.64207 2.28960 -108.83104 739.23953
4215.0000 -113.27323 -108.79411 4.47912 2.32504 -108.36959 768.23753
4220.0000 -114.06300 -109.16523 4.89777 2.26285 -109.17947 721.28860
4225.0000 -114.41551 -109.61704 4.79847 2.22813 -109.63163 732.85651
4230.0000 -114.31819 -109.60481 4.71338 2.21245 -109.83592 695.15040
4235.0000 -113.99088 -110.01943 3.97146 2.19337 -110.08438 687.03795
4240.0000 -113.37615 -108.38646 4.98970 2.29380 -108.77636 756.11116
4245.0000 -113.55813 -107.43830 6.11983 2.32638 -108.35206 798.66202
4250.0000 -112.76820 -108.44309 4.32511 2.33357 -108.25846 792.44936
MELTING PROCESS: loop number 18 T-loop= 770.00000000000000
main_MD> interactions number 18 at Temperature= 770.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 3.47850 -1.28368 0.55550
force_rgl> df(natom) 1.27110 1.58772 -0.47398
4255.0000 -114.14377 -108.29052 5.85325 2.31386 -108.51516 724.24540
4260.0000 -114.64969 -110.21298 4.43670 2.27303 -109.04687 752.55909
4265.0000 -113.95140 -109.20383 4.74758 2.15204 -110.62257 656.04373
4270.0000 -113.03026 -108.29035 4.73991 2.28724 -108.86178 753.12790
4275.0000 -112.89323 -108.58231 4.31092 2.38169 -107.63181 781.44702
4280.0000 -113.02260 -107.11788 5.90472 2.38539 -107.58351 822.52850
4285.0000 -112.17721 -108.11754 4.05967 2.46356 -106.56553 862.81788
4290.0000 -113.04585 -107.48077 5.56509 2.37953 -107.65985 816.49581
4295.0000 -114.11225 -110.12967 3.98257 2.28455 -108.89693 733.84749
4300.0000 -114.08209 -110.45419 3.62790 2.18283 -110.22161 630.09626
4305.0000 -114.24089 -109.61288 4.62801 2.23552 -109.53545 704.30062
4310.0000 -114.02684 -109.66554 4.36131 2.24211 -109.44962 706.53683
4315.0000 -112.69120 -108.03071 4.66050 2.26955 -109.09221 721.33462
4320.0000 -113.37092 -108.89140 4.47952 2.32864 -108.32263 759.70508
4325.0000 -112.50230 -108.07351 4.42878 2.30795 -108.59218 759.05957
4330.0000 -112.24330 -107.77926 4.46405 2.39461 -107.46355 866.59034
4335.0000 -113.10966 -109.07533 4.03433 2.39749 -107.42593 858.08092
4340.0000 -112.65738 -107.78971 4.86767 2.35986 -107.91601 794.35590
4345.0000 -112.88001 -108.30832 4.57169 2.34774 -108.07385 792.35920
4350.0000 -112.90225 -107.93357 4.96868 2.31227 -108.53584 748.92579
4355.0000 -113.24922 -109.08056 4.16866 2.31781 -108.46368 756.40214
4360.0000 -112.78515 -108.92574 3.85941 2.26380 -109.16717 728.07792
4365.0000 -113.19780 -108.92706 4.27074 2.29383 -108.77598 750.76679
4370.0000 -113.23320 -108.62598 4.60722 2.29909 -108.70752 727.00869
4375.0000 -113.38607 -109.33551 4.05056 2.26366 -109.16896 721.46219
4380.0000 -113.54692 -108.62932 4.91759 2.26245 -109.18476 679.09190
4385.0000 -112.44342 -107.15854 5.28488 2.34817 -108.06828 743.77576
4390.0000 -112.43937 -108.80448 3.63488 2.35252 -108.01168 778.88060
4395.0000 -113.47415 -108.98933 4.48482 2.34743 -108.07789 792.87188
4400.0000 -112.28747 -107.16674 5.12072 2.33107 -108.29105 754.60429
4405.0000 -112.96204 -108.16930 4.79275 2.38866 -107.54095 813.12145
4410.0000 -113.06175 -108.07194 4.98981 2.36424 -107.85903 799.85953
4415.0000 -111.20104 -106.75762 4.44343 2.41641 -107.17960 832.03676
4420.0000 -112.29470 -108.07648 4.21822 2.40195 -107.36796 833.30914
4425.0000 -112.86760 -108.87537 3.99223 2.31423 -108.51036 746.75438
4430.0000 -113.15383 -108.74504 4.40879 2.30119 -108.68020 730.61080
4435.0000 -112.39389 -107.11564 5.27825 2.33881 -108.19018 779.82350
4440.0000 -114.33491 -110.01145 4.32346 2.32830 -108.32703 767.67809
4445.0000 -112.87643 -109.37296 3.50347 2.25268 -109.31198 724.57826
4450.0000 -114.37188 -109.69451 4.67737 2.26959 -109.09166 701.04505
4455.0000 -113.04524 -108.71795 4.32729 2.25273 -109.31133 712.37445
4460.0000 -112.88282 -108.26075 4.62207 2.29791 -108.72282 728.45603
4465.0000 -112.55539 -107.37053 5.18487 2.38118 -107.63843 829.44832
4470.0000 -112.35542 -108.09415 4.26127 2.38784 -107.55161 816.45949
4475.0000 -112.58461 -108.35913 4.22549 2.35319 -108.00292 777.44022
4480.0000 -114.80125 -109.63244 5.16881 2.26617 -109.13631 719.67258
4485.0000 -114.20435 -109.37617 4.82818 2.25174 -109.32420 708.15309
4490.0000 -113.49909 -108.98129 4.51781 2.23320 -109.56567 694.94300
4495.0000 -114.44295 -110.20716 4.23579 2.22821 -109.63064 696.62667
4500.0000 -114.93496 -110.04621 4.88875 2.19358 -110.08170 683.12954
MELTING PROCESS: loop number 19 T-loop= 795.00000000000000
main_MD> interactions number 19 at Temperature= 795.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.76276 1.51240 -0.36309
force_rgl> df(natom) -2.34997 -0.33402 -0.22176
4505.0000 -113.39681 -108.33482 5.06199 2.32709 -108.34287 803.76347
4510.0000 -113.44034 -108.51063 4.92971 2.31418 -108.51104 774.77357
4515.0000 -112.76726 -108.36915 4.39811 2.33544 -108.23408 784.12605
4520.0000 -112.73757 -108.23720 4.50037 2.35341 -108.00006 791.30521
4525.0000 -113.79342 -108.40920 5.38422 2.39515 -107.45652 832.93777
4530.0000 -112.65299 -108.67376 3.97923 2.27686 -108.99703 734.38051
4535.0000 -112.26187 -107.12189 5.13998 2.40118 -107.37799 835.56023
4540.0000 -113.57500 -107.94634 5.62867 2.37916 -107.66468 810.13582
4545.0000 -113.07438 -108.23875 4.83563 2.36938 -107.79214 785.64391
4550.0000 -113.74382 -108.74934 4.99448 2.31298 -108.52656 762.65295
4555.0000 -113.30559 -107.95348 5.35211 2.30930 -108.57460 738.21569
4560.0000 -114.10651 -109.51299 4.59353 2.28575 -108.88126 758.81687
4565.0000 -113.45078 -109.22340 4.22739 2.27263 -109.05208 751.14574
4570.0000 -113.20572 -108.40236 4.80336 2.29377 -108.77685 755.57923
4575.0000 -111.52607 -107.78082 3.74525 2.31782 -108.46358 761.79163
4580.0000 -112.20203 -108.44742 3.75460 2.35115 -108.02951 784.54535
4585.0000 -113.14378 -107.92892 5.21485 2.33123 -108.28891 745.87924
4590.0000 -113.72547 -108.90078 4.82468 2.34348 -108.12934 772.31894
4595.0000 -112.05337 -107.46083 4.59254 2.30840 -108.58621 759.92845
4600.0000 -111.94889 -107.46839 4.48050 2.42626 -107.05128 835.03943
4605.0000 -114.23031 -108.91088 5.31944 2.33404 -108.25232 771.52844
4610.0000 -112.34591 -107.72887 4.61705 2.32553 -108.36323 752.52780
4615.0000 -111.79739 -106.46776 5.32962 2.38322 -107.61189 777.42920
4620.0000 -112.16024 -106.84280 5.31744 2.46446 -106.55380 897.99287
4625.0000 -113.39461 -108.27141 5.12320 2.38400 -107.60162 810.48522
4630.0000 -113.17517 -107.95893 5.21624 2.38084 -107.64284 796.38665
4635.0000 -113.58295 -107.99293 5.59002 2.36285 -107.87718 802.16510
4640.0000 -112.28747 -107.13993 5.14754 2.37139 -107.76597 811.09212
4645.0000 -113.42528 -108.37648 5.04880 2.38573 -107.57920 808.63430
4650.0000 -111.28546 -107.18001 4.10545 2.36232 -107.88409 822.40417
4655.0000 -112.97508 -108.33891 4.63616 2.35350 -107.99888 763.38829
4660.0000 -113.03883 -108.16044 4.87839 2.31259 -108.53169 759.94804
4665.0000 -112.74964 -108.64126 4.10838 2.28324 -108.91397 756.01257
4670.0000 -112.96207 -108.51336 4.44872 2.33990 -108.17598 790.88869
4675.0000 -113.38552 -109.37334 4.01219 2.32155 -108.41501 754.50083
4680.0000 -112.77359 -107.79537 4.97822 2.31063 -108.55721 748.24305
4685.0000 -112.21541 -107.48894 4.72647 2.36477 -107.85208 778.43778
4690.0000 -112.78354 -107.53452 5.24902 2.38843 -107.54395 811.28866
4695.0000 -113.44073 -108.99131 4.44942 2.29413 -108.77211 749.67345
4700.0000 -113.12022 -108.21160 4.90863 2.33002 -108.30468 741.73260
4705.0000 -112.22690 -107.95312 4.27378 2.33865 -108.19229 785.57792
4710.0000 -113.54806 -108.72191 4.82614 2.34388 -108.12423 779.53831
4715.0000 -112.29997 -106.87350 5.42647 2.30732 -108.60038 754.63467
4720.0000 -112.51924 -107.71915 4.80008 2.43123 -106.98657 859.60491
4725.0000 -112.28983 -107.43570 4.85413 2.38939 -107.53151 796.49906
4730.0000 -114.06182 -107.88725 6.17458 2.33443 -108.24731 821.97532
4735.0000 -113.94165 -107.89718 6.04447 2.40258 -107.35974 853.10898
4740.0000 -113.95557 -109.37051 4.58505 2.32888 -108.31949 774.92545
4745.0000 -112.06792 -107.94069 4.12723 2.29742 -108.72925 732.12839
4750.0000 -112.43167 -107.72303 4.70864 2.40258 -107.35968 809.91634
MELTING PROCESS: loop number 20 T-loop= 820.00000000000000
main_MD> interactions number 20 at Temperature= 820.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.69495 1.45096 1.09088
force_rgl> df(natom) -1.12948 -0.66202 -1.91178
4755.0000 -112.80450 -107.25617 5.54833 2.39689 -107.43376 777.47556
4760.0000 -112.79687 -108.89349 3.90338 2.35793 -107.94115 811.82172
4765.0000 -112.68823 -107.90033 4.78790 2.34066 -108.16617 778.12494
4770.0000 -112.27246 -107.92614 4.34632 2.39281 -107.48692 813.17206
4775.0000 -111.93384 -107.73948 4.19436 2.36138 -107.89625 797.11466
4780.0000 -112.67963 -107.91708 4.76255 2.40622 -107.31225 828.57512
4785.0000 -114.26953 -108.83846 5.43107 2.33713 -108.21210 775.47564
4790.0000 -113.43447 -108.45140 4.98308 2.27607 -109.00737 733.29916
4795.0000 -112.02008 -106.90729 5.11279 2.36212 -107.88660 813.87667
4800.0000 -111.86889 -106.56855 5.30034 2.45289 -106.70448 891.50864
4805.0000 -111.66220 -106.63768 5.02452 2.48796 -106.24776 889.42387
4810.0000 -112.24476 -105.56600 6.67876 2.46214 -106.58405 874.33473
4815.0000 -111.73629 -105.47463 6.26166 2.54637 -105.48708 950.84175
4820.0000 -111.42070 -106.98783 4.43287 2.50876 -105.97688 880.25015
4825.0000 -113.07533 -107.61159 5.46374 2.36724 -107.81989 787.24581
4830.0000 -112.64527 -107.28872 5.35655 2.41453 -107.20401 834.94566
4835.0000 -113.28248 -108.75014 4.53234 2.31204 -108.53888 782.31009
4840.0000 -113.23122 -107.14274 6.08849 2.33098 -108.29215 812.19075
4845.0000 -112.84217 -107.64771 5.19446 2.38483 -107.59083 825.02321
4850.0000 -112.40754 -107.42555 4.98199 2.34833 -108.06629 812.86915
4855.0000 -111.77519 -107.20583 4.56936 2.41495 -107.19863 868.81085
4860.0000 -113.20061 -105.79139 7.40922 2.47600 -106.40355 905.19551
4865.0000 -113.21046 -108.75929 4.45117 2.40868 -107.28019 817.91851
4870.0000 -113.30897 -108.25983 5.04914 2.28504 -108.89043 710.02605
4875.0000 -112.14228 -106.56217 5.58012 2.42177 -107.10980 874.69421
4880.0000 -112.87208 -108.22767 4.64441 2.38940 -107.53130 819.68018
4885.0000 -112.68969 -108.77456 3.91513 2.31610 -108.48593 761.53285
4890.0000 -112.07163 -107.87740 4.19423 2.30517 -108.62836 741.30194
4895.0000 -112.09537 -106.97983 5.11553 2.35581 -107.96879 771.92537
4900.0000 -113.07535 -107.35228 5.72307 2.41736 -107.16720 874.96829
4905.0000 -112.70147 -108.07327 4.62820 2.41857 -107.15151 863.78283
4910.0000 -111.74049 -106.75736 4.98312 2.40808 -107.28801 859.58577
4915.0000 -112.05417 -106.88587 5.16830 2.43788 -106.90002 857.58283
4920.0000 -112.09630 -106.74020 5.35609 2.44581 -106.79668 850.44609
4925.0000 -113.05866 -107.84345 5.21520 2.41602 -107.18462 800.71270
4930.0000 -111.73662 -105.77640 5.96022 2.44351 -106.82662 841.12234
4935.0000 -112.02721 -106.55288 5.47433 2.45491 -106.67815 847.74101
4940.0000 -112.00638 -106.98579 5.02060 2.47896 -106.36493 870.00826
4945.0000 -111.89247 -107.71644 4.17603 2.40343 -107.34857 829.24747
4950.0000 -112.35613 -107.40848 4.94765 2.35554 -107.97227 805.30005
4955.0000 -111.97336 -106.42105 5.55231 2.43498 -106.93770 876.43006
4960.0000 -111.02795 -106.34763 4.68032 2.56795 -105.20599 916.53499
4965.0000 -112.81508 -108.03808 4.77700 2.38251 -107.62103 766.95027
4970.0000 -112.62923 -107.41724 5.21199 2.37272 -107.74862 818.79879
4975.0000 -112.89704 -107.63873 5.25831 2.41645 -107.17900 849.50781
4980.0000 -113.45282 -108.33307 5.11975 2.34328 -108.13198 818.59327
4985.0000 -113.56268 -108.83193 4.73075 2.29915 -108.70671 769.21738
4990.0000 -112.44894 -108.29956 4.14939 2.35501 -107.97917 809.68337
4995.0000 -112.69865 -108.32359 4.37507 2.33719 -108.21126 763.26792
5000.0000 -113.38350 -109.31984 4.06366 2.33077 -108.29498 819.14406
MELTING PROCESS: loop number 21 T-loop= 845.00000000000000
main_MD> interactions number 21 at Temperature= 845.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.95025 1.59710 1.56189
force_rgl> df(natom) 1.44877 -1.37686 -0.89663
5005.0000 -113.24184 -108.11503 5.12681 2.28214 -108.92827 743.55453
5010.0000 -112.56982 -106.94111 5.62871 2.39829 -107.41556 846.76860
5015.0000 -111.39184 -107.19112 4.20073 2.44914 -106.75337 846.24766
5020.0000 -110.73251 -105.96645 4.76606 2.45815 -106.63592 871.12994
5025.0000 -112.25561 -106.01785 6.23776 2.51038 -105.95581 874.61725
5030.0000 -111.74567 -107.14379 4.60187 2.48571 -106.27699 909.55247
5035.0000 -112.39922 -107.76168 4.63754 2.36989 -107.78539 796.36122
5040.0000 -112.30801 -107.48865 4.81937 2.39236 -107.49276 842.93482
5045.0000 -113.00339 -107.66904 5.33435 2.37820 -107.67720 832.93655
5050.0000 -113.82098 -108.42962 5.39136 2.35076 -108.03456 800.51684
5055.0000 -113.27019 -108.15098 5.11922 2.36471 -107.85296 816.52601
5060.0000 -111.33448 -106.02164 5.31284 2.43445 -106.94469 868.42333
5065.0000 -112.78831 -107.19681 5.59151 2.48727 -106.25670 888.93688
5070.0000 -111.06182 -105.58725 5.47456 2.49077 -106.21114 909.99315
5075.0000 -113.14673 -108.23896 4.90777 2.40315 -107.35225 826.82974
5080.0000 -112.07968 -106.65264 5.42703 2.42276 -107.09686 841.51175
5085.0000 -112.07119 -107.48176 4.58942 2.42879 -107.01833 853.12435
5090.0000 -112.74298 -107.00996 5.73302 2.41123 -107.24705 871.48087
5095.0000 -110.85630 -106.26631 4.58999 2.44135 -106.85479 872.71220
5100.0000 -113.77532 -108.16275 5.61257 2.42569 -107.05871 844.70799
5105.0000 -113.27617 -107.80049 5.47568 2.40949 -107.26969 816.71509
5110.0000 -113.25325 -107.96631 5.28694 2.39665 -107.43694 831.06912
5115.0000 -112.78743 -109.14711 3.64031 2.29219 -108.79740 756.89803
5120.0000 -113.24457 -108.52628 4.71829 2.29871 -108.71243 757.94293
5125.0000 -112.92727 -107.63806 5.28922 2.33084 -108.29400 786.11762
5130.0000 -112.07135 -107.73443 4.33692 2.35524 -107.97628 797.05755
5135.0000 -113.12194 -107.65125 5.47069 2.40705 -107.30148 800.18086
5140.0000 -112.69553 -107.51717 5.17836 2.34084 -108.16383 761.26551
5145.0000 -112.41981 -107.39882 5.02100 2.36766 -107.81443 816.21357
5150.0000 -113.36792 -108.64295 4.72498 2.34095 -108.16238 762.55081
5155.0000 -112.34507 -108.61517 3.72989 2.33550 -108.23338 762.76407
5160.0000 -113.03477 -108.53376 4.50101 2.33678 -108.21668 765.12657
5165.0000 -113.04984 -108.73890 4.31094 2.29075 -108.81616 749.81492
5170.0000 -112.94621 -107.46637 5.47984 2.37258 -107.75045 821.41743
5175.0000 -112.22461 -106.97473 5.24987 2.39410 -107.47014 822.81409
5180.0000 -112.47973 -107.25087 5.22886 2.46114 -106.59706 845.56711
5185.0000 -112.97622 -108.62403 4.35219 2.36498 -107.84936 799.77032
5190.0000 -112.26297 -108.30371 3.95926 2.32327 -108.39261 774.38459
5195.0000 -113.24992 -108.72963 4.52029 2.31881 -108.45074 768.33119
5200.0000 -112.06685 -106.99613 5.07072 2.32991 -108.30619 773.16383
5205.0000 -112.76282 -106.57917 6.18365 2.45366 -106.69445 892.76158
5210.0000 -111.74224 -106.15499 5.58726 2.38922 -107.53374 838.44486
5215.0000 -111.40867 -106.45193 4.95675 2.49187 -106.19681 889.46430
5220.0000 -112.75700 -107.71127 5.04573 2.43424 -106.94732 861.23554
5225.0000 -112.92697 -108.07855 4.84842 2.39024 -107.52046 813.21505
5230.0000 -112.85448 -108.36975 4.48473 2.34305 -108.13499 792.98362
5235.0000 -111.42446 -106.44172 4.98274 2.39284 -107.48656 843.21321
5240.0000 -111.68675 -106.05418 5.63257 2.48410 -106.29795 918.12291
5245.0000 -112.78189 -107.17379 5.60809 2.45634 -106.65953 893.37715
5250.0000 -112.12324 -107.42663 4.69661 2.43320 -106.96085 880.70462
MELTING PROCESS: loop number 22 T-loop= 870.00000000000000
main_MD> interactions number 22 at Temperature= 870.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 3.26213 -4.50773 0.74345
force_rgl> df(natom) -1.19360 1.13574 0.08688
5255.0000 -111.68000 -106.82286 4.85714 2.42881 -107.01810 835.22713
5260.0000 -110.94785 -105.65945 5.28840 2.47430 -106.42567 835.57126
5265.0000 -111.72054 -106.55777 5.16277 2.50310 -106.05052 911.12169
5270.0000 -110.37342 -105.69273 4.68069 2.50259 -106.05727 909.10652
5275.0000 -111.83347 -104.99820 6.83527 2.53864 -105.58774 932.12955
5280.0000 -110.13854 -105.36240 4.77613 2.57844 -105.06931 981.06905
5285.0000 -111.19568 -105.03401 6.16167 2.60542 -104.71801 1017.59220
5290.0000 -112.56139 -106.48551 6.07588 2.57837 -105.07025 928.29583
5295.0000 -112.27181 -107.48563 4.78618 2.37578 -107.70870 777.90739
5300.0000 -111.82587 -106.13686 5.68901 2.50073 -106.08146 905.34680
5305.0000 -110.25960 -104.62682 5.63278 2.53630 -105.61815 913.68474
5310.0000 -110.82277 -105.98809 4.83468 2.50962 -105.96559 864.85396
5315.0000 -112.25589 -108.08597 4.16992 2.43947 -106.87924 812.66710
5320.0000 -112.72672 -107.82768 4.89904 2.36810 -107.80873 801.18029
5325.0000 -112.79979 -107.40634 5.39345 2.37064 -107.77562 781.61657
5330.0000 -112.10414 -106.90002 5.20412 2.41414 -107.20917 828.78672
5335.0000 -111.61958 -107.10217 4.51740 2.40198 -107.36746 824.41348
5340.0000 -111.75542 -106.44742 5.30801 2.50921 -105.97101 925.50015
5345.0000 -111.69226 -105.99220 5.70006 2.50093 -106.07884 879.87496
5350.0000 -111.53184 -105.03914 6.49270 2.53305 -105.66046 938.74489
5355.0000 -110.87304 -106.25328 4.61976 2.55012 -105.43813 956.01015
5360.0000 -111.08203 -105.55818 5.52384 2.52558 -105.75773 932.11523
5365.0000 -111.94440 -105.66842 6.27598 2.48538 -106.28134 873.62114
5370.0000 -111.03813 -105.17121 5.86692 2.52188 -105.80603 957.65988
5375.0000 -111.73925 -107.40412 4.33513 2.49609 -106.14186 909.62046
5380.0000 -112.27924 -106.50999 5.76925 2.44580 -106.79686 865.08470
5385.0000 -111.12469 -104.92173 6.20297 2.55836 -105.33092 949.96427
5390.0000 -112.05904 -106.42719 5.63185 2.60856 -104.67706 998.23151
5395.0000 -112.12433 -106.39278 5.73155 2.47841 -106.37211 885.88251
5400.0000 -112.85500 -107.98830 4.86670 2.43419 -106.94804 854.71270
5405.0000 -111.19875 -107.10390 4.09486 2.46818 -106.50541 843.31065
5410.0000 -113.04750 -107.15448 5.89301 2.42035 -107.12829 861.46146
5415.0000 -111.01518 -105.87306 5.14212 2.47270 -106.44649 882.37197
5420.0000 -111.89979 -106.00245 5.89734 2.48889 -106.23563 912.56631
5425.0000 -111.33603 -106.13240 5.20363 2.46423 -106.55673 830.21954
5430.0000 -111.81814 -106.40870 5.40944 2.51619 -105.88009 917.26179
5435.0000 -112.89570 -107.09443 5.80127 2.46164 -106.59053 863.71032
5440.0000 -113.11254 -108.10810 5.00445 2.37477 -107.72188 844.53870
5445.0000 -112.28439 -107.37518 4.90921 2.38469 -107.59274 795.10263
5450.0000 -112.23586 -106.37003 5.86583 2.44538 -106.80230 876.46390
5455.0000 -111.55502 -105.34166 6.21336 2.56749 -105.21201 974.38489
5460.0000 -110.70550 -105.49497 5.21053 2.51400 -105.90861 893.50517
5465.0000 -112.05984 -106.33097 5.72887 2.52436 -105.77363 904.26822
5470.0000 -111.15063 -105.69346 5.45717 2.51148 -105.94141 927.26779
5475.0000 -113.37032 -106.57094 6.79938 2.55060 -105.43193 922.90440
5480.0000 -112.71789 -106.76356 5.95433 2.47254 -106.44851 875.27695
5485.0000 -111.39223 -106.82914 4.56309 2.41710 -107.17058 820.06815
5490.0000 -112.42556 -107.63522 4.79034 2.41727 -107.16844 832.08083
5495.0000 -112.41608 -107.09632 5.31976 2.36780 -107.81271 788.68666
5500.0000 -111.98557 -106.86907 5.11651 2.44359 -106.82558 823.30549
MELTING PROCESS: loop number 23 T-loop= 895.00000000000000
main_MD> interactions number 23 at Temperature= 895.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.21811 -1.04221 -0.39269
force_rgl> df(natom) 1.89703 0.42501 -0.01094
5505.0000 -112.95527 -108.57631 4.37896 2.37602 -107.70558 843.63442
5510.0000 -111.97853 -108.25496 3.72356 2.27495 -109.02187 745.85284
5515.0000 -113.02168 -107.32891 5.69277 2.43955 -106.87825 861.55008
5520.0000 -111.57349 -107.10084 4.47265 2.43122 -106.98674 854.70910
5525.0000 -111.53639 -106.47102 5.06536 2.39650 -107.43893 795.69163
5530.0000 -111.33922 -106.36727 4.97195 2.51482 -105.89787 960.16272
5535.0000 -111.74577 -105.52391 6.22185 2.50845 -105.98090 939.54834
5540.0000 -110.78918 -106.41353 4.37565 2.47266 -106.44697 882.64469
5545.0000 -112.09500 -107.35480 4.74020 2.43462 -106.94237 838.23985
5550.0000 -112.56039 -106.95871 5.60168 2.37153 -107.76411 789.90582
5555.0000 -111.71304 -105.17685 6.53618 2.50207 -106.06400 920.64509
5560.0000 -109.98231 -104.27823 5.70408 2.59689 -104.82908 927.80911
5565.0000 -111.25194 -106.76775 4.48419 2.55659 -105.35396 965.75624
5570.0000 -111.14893 -104.90955 6.23937 2.49126 -106.20470 898.42681
5575.0000 -111.53062 -106.66934 4.86129 2.49019 -106.21872 924.49527
5580.0000 -111.58793 -105.89790 5.69003 2.45475 -106.68022 871.93956
5585.0000 -110.19357 -106.27591 3.91766 2.47166 -106.46002 850.64641
5590.0000 -111.49852 -105.62917 5.86935 2.52853 -105.71934 909.59623
5595.0000 -110.92743 -105.80642 5.12101 2.47964 -106.35603 872.83753
5600.0000 -111.04179 -104.81113 6.23066 2.55861 -105.32766 949.07415
5605.0000 -110.86383 -105.63520 5.22863 2.54592 -105.49286 937.78993
5610.0000 -111.75103 -105.98556 5.76547 2.49445 -106.16325 898.79971
5615.0000 -110.66457 -105.23131 5.43326 2.52877 -105.71619 933.98774
5620.0000 -111.46079 -106.19518 5.26560 2.51132 -105.94350 916.24020
5625.0000 -112.22140 -105.81436 6.40704 2.47586 -106.40538 894.78491
5630.0000 -111.52558 -106.16477 5.36081 2.49008 -106.22019 905.11555
5635.0000 -111.49851 -105.96607 5.53244 2.47502 -106.41629 884.80483
5640.0000 -111.39996 -105.66304 5.73692 2.53053 -105.69336 917.66769
5645.0000 -110.80336 -104.89054 5.91282 2.58867 -104.93616 982.46171
5650.0000 -111.35318 -105.78627 5.56691 2.57802 -105.07487 967.19465
5655.0000 -112.25271 -106.42065 5.83206 2.49275 -106.18534 883.59318
5660.0000 -112.54221 -107.45381 5.08840 2.45910 -106.62360 911.29856
5665.0000 -112.14158 -106.37939 5.76218 2.44072 -106.86293 860.09692
5670.0000 -112.10583 -107.05102 5.05481 2.47228 -106.45195 878.95903
5675.0000 -111.68761 -106.42019 5.26742 2.42686 -107.04353 871.69983
5680.0000 -112.69821 -107.33543 5.36277 2.44620 -106.79160 846.66869
5685.0000 -111.50358 -106.39224 5.11134 2.44617 -106.79202 855.33137
5690.0000 -111.95843 -107.06802 4.89040 2.49407 -106.16821 928.04097
5695.0000 -113.34451 -107.46596 5.87855 2.42806 -107.02789 870.60232
5700.0000 -112.06918 -106.35635 5.71283 2.36896 -107.79751 828.19301
5705.0000 -112.84793 -107.73602 5.11191 2.42139 -107.11477 818.81657
5710.0000 -112.26782 -107.47446 4.79336 2.36901 -107.79695 824.15545
5715.0000 -112.70981 -106.88407 5.82574 2.46603 -106.53330 822.34185
5720.0000 -112.04073 -106.14874 5.89198 2.47013 -106.47999 866.93236
5725.0000 -109.89418 -104.65611 5.23807 2.53312 -105.65954 915.15689
5730.0000 -109.74655 -103.56956 6.17699 2.62933 -104.40658 968.92259
5735.0000 -111.53916 -105.63204 5.90712 2.64489 -104.20395 1016.12068
5740.0000 -111.08666 -105.42121 5.66545 2.54134 -105.55259 935.06888
5745.0000 -111.10318 -104.54178 6.56140 2.60732 -104.69325 993.11058
5750.0000 -110.25365 -104.88750 5.36615 2.63674 -104.31010 1058.45322
MELTING PROCESS: loop number 24 T-loop= 920.00000000000000
main_MD> interactions number 24 at Temperature= 920.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.76603 0.03752 -0.66533
force_rgl> df(natom) 6.51106 -1.98951 -2.74422
5755.0000 -110.95563 -104.85716 6.09847 2.60043 -104.78300 992.73129
5760.0000 -110.86205 -105.29308 5.56896 2.57473 -105.11767 940.10371
5765.0000 -110.78355 -103.73630 7.04726 2.64024 -104.26455 1020.82654
5770.0000 -110.90444 -104.52221 6.38223 2.61999 -104.52818 996.15868
5775.0000 -109.58205 -104.64441 4.93765 2.60034 -104.78414 962.87483
5780.0000 -109.63451 -103.83310 5.80142 2.58612 -104.96930 921.09186
5785.0000 -111.46361 -105.26923 6.19438 2.61519 -104.59076 998.70919
5790.0000 -111.19338 -106.29557 4.89780 2.53361 -105.65323 964.85233
5795.0000 -112.98324 -108.17057 4.81267 2.42343 -107.08811 853.14203
5800.0000 -110.62386 -106.14632 4.47753 2.46420 -106.55712 869.96788
5805.0000 -111.00674 -104.32523 6.68151 2.55944 -105.31679 941.56426
5810.0000 -111.92466 -104.90091 7.02375 2.58095 -105.03667 956.74020
5815.0000 -111.44558 -104.62482 6.82076 2.55682 -105.35094 946.92261
5820.0000 -111.47333 -105.92912 5.54421 2.54087 -105.55863 876.77165
5825.0000 -112.70628 -107.25884 5.44744 2.49317 -106.17985 878.58503
5830.0000 -110.37487 -103.60161 6.77327 2.54511 -105.50349 940.90694
5835.0000 -110.91225 -105.01921 5.89304 2.56983 -105.18151 948.60249
5840.0000 -110.62610 -105.34108 5.28502 2.61275 -104.62246 969.61236
5845.0000 -113.02973 -107.85665 5.17308 2.47522 -106.41362 867.63810
5850.0000 -111.17357 -105.35677 5.81680 2.38629 -107.57179 801.53096
5855.0000 -112.35584 -106.39888 5.95696 2.52728 -105.73571 947.33486
5860.0000 -110.30187 -105.04591 5.25595 2.52904 -105.71274 935.09236
5865.0000 -111.46152 -105.64803 5.81349 2.64104 -104.25414 1015.66330
5870.0000 -111.18686 -105.83353 5.35333 2.51981 -105.83292 890.41720
5875.0000 -111.24099 -105.89446 5.34653 2.55216 -105.41158 938.09259
5880.0000 -111.71170 -105.94439 5.76730 2.50367 -106.04309 901.74468
5885.0000 -109.89726 -105.45681 4.44044 2.55236 -105.40901 937.36104
5890.0000 -111.51096 -106.66979 4.84117 2.44539 -106.80219 850.92198
5895.0000 -111.12816 -105.14393 5.98423 2.43809 -106.89719 873.20184
5900.0000 -111.49034 -104.80546 6.68489 2.57259 -105.14553 955.36839
5905.0000 -109.98318 -103.61488 6.36829 2.62122 -104.51219 978.27493
5910.0000 -109.94887 -103.36755 6.58131 2.68825 -103.63929 1038.11596
5915.0000 -110.10508 -104.29996 5.80512 2.64692 -104.17754 1019.45897
5920.0000 -110.42426 -104.61681 5.80745 2.59798 -104.81489 945.40476
5925.0000 -110.63116 -104.45659 6.17457 2.64023 -104.26464 980.34469
5930.0000 -110.92382 -104.69111 6.23270 2.58770 -104.94871 985.32549
5935.0000 -110.55468 -104.31010 6.24458 2.63130 -104.38095 977.01596
5940.0000 -109.63029 -104.63423 4.99606 2.62798 -104.42411 976.17522
5945.0000 -112.72601 -105.70044 7.02556 2.59994 -104.78929 987.96019
5950.0000 -110.59521 -105.47820 5.11701 2.53549 -105.62868 929.49421
5955.0000 -108.83270 -102.97948 5.85322 2.61273 -104.62285 990.85860
5960.0000 -110.11223 -104.07855 6.03368 2.75035 -102.83053 1083.76355
5965.0000 -110.92124 -104.58312 6.33812 2.61435 -104.60170 972.46190
5970.0000 -111.65556 -105.73433 5.92123 2.55988 -105.31107 927.52719
5975.0000 -111.61524 -105.92647 5.68877 2.49973 -106.09444 888.17501
5980.0000 -112.72199 -107.47937 5.24263 2.45099 -106.72924 844.88352
5985.0000 -112.35082 -105.75154 6.59929 2.45569 -106.66799 843.74766
5990.0000 -110.28011 -104.43197 5.84814 2.58351 -105.00339 949.62733
5995.0000 -110.58510 -103.70170 6.88340 2.68354 -103.70062 1024.88667
6000.0000 -109.08983 -103.75730 5.33253 2.70823 -103.37898 1073.89105
MELTING PROCESS: loop number 25 T-loop= 945.00000000000000
main_MD> interactions number 25 at Temperature= 945.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 9.89036 2.85990 -0.43547
force_rgl> df(natom) -0.05199 1.02715 -0.10914
6005.0000 -109.83385 -104.24273 5.59112 2.73734 -102.99997 1043.96315
6010.0000 -111.73568 -105.26927 6.46641 2.63819 -104.29121 1021.82712
6015.0000 -111.31703 -105.70191 5.61512 2.53836 -105.59130 942.25528
6020.0000 -110.01761 -105.09303 4.92458 2.53378 -105.65106 906.76671
6025.0000 -111.36643 -106.23708 5.12934 2.58405 -104.99633 964.47104
6030.0000 -109.55206 -103.46612 6.08594 2.54256 -105.53663 979.38834
6035.0000 -111.12367 -103.83290 7.29077 2.65831 -104.02920 1005.34481
6040.0000 -110.81150 -105.07640 5.73511 2.58842 -104.93935 971.43857
6045.0000 -111.23232 -106.01701 5.21531 2.52981 -105.70265 919.16647
6050.0000 -109.75798 -104.36486 5.39312 2.52385 -105.78035 943.64542
6055.0000 -112.92172 -106.88906 6.03266 2.52898 -105.71351 922.29465
6060.0000 -111.83510 -106.11596 5.71914 2.42752 -107.03491 897.17491
6065.0000 -111.29836 -105.69195 5.60641 2.55954 -105.31553 941.77388
6070.0000 -110.66288 -104.55978 6.10310 2.49832 -106.11281 918.34351
6075.0000 -110.55046 -104.31599 6.23446 2.62440 -104.47076 1019.23615
6080.0000 -109.80065 -103.99328 5.80736 2.60662 -104.70229 974.11698
6085.0000 -111.48072 -105.56761 5.91311 2.61416 -104.60418 1018.26142
6090.0000 -109.97664 -103.59882 6.37782 2.67457 -103.81742 998.46756
6095.0000 -108.40359 -102.35398 6.04961 2.76847 -102.59450 1093.36121
6100.0000 -110.38795 -104.45815 5.92979 2.67813 -103.77109 1033.09006
6105.0000 -111.76761 -104.81507 6.95254 2.55266 -105.40513 939.41543
6110.0000 -109.84240 -103.96784 5.87456 2.62730 -104.43305 981.68968
6115.0000 -112.59707 -104.90750 7.68957 2.58245 -105.01720 951.92618
6120.0000 -110.31543 -104.20461 6.11082 2.59419 -104.86422 962.38723
6125.0000 -110.01245 -104.23689 5.77556 2.63726 -104.30333 987.63867
6130.0000 -110.29141 -103.99352 6.29789 2.69821 -103.50949 1092.73359
6135.0000 -111.31288 -104.50978 6.80310 2.60586 -104.71221 991.16149
6140.0000 -111.86490 -106.59283 5.27207 2.53454 -105.64113 916.22381
6145.0000 -112.86464 -108.12413 4.74051 2.46567 -106.53809 934.75519
6150.0000 -111.16258 -106.48759 4.67500 2.42484 -107.06980 878.66023
6155.0000 -111.01830 -105.04616 5.97214 2.53728 -105.60539 943.39745
6160.0000 -110.68206 -105.32070 5.36136 2.54492 -105.50591 955.86053
6165.0000 -111.98834 -105.18991 6.79843 2.54445 -105.51207 925.81521
6170.0000 -110.95501 -106.46201 4.49300 2.50364 -106.04357 924.43978
6175.0000 -109.88495 -105.26330 4.62166 2.60543 -104.71780 1000.97884
6180.0000 -110.72396 -105.28919 5.43477 2.57847 -105.06897 999.05657
6185.0000 -111.69882 -106.82690 4.87192 2.44750 -106.77472 872.51828
6190.0000 -111.34085 -105.86702 5.47383 2.48035 -106.34679 926.59421
6195.0000 -110.56492 -104.57739 5.98753 2.56221 -105.28074 949.27978
6200.0000 -111.77328 -104.45581 7.31748 2.58950 -104.92526 1003.28767
6205.0000 -111.49054 -104.26457 7.22597 2.58642 -104.96540 982.54336
6210.0000 -110.60037 -105.66997 4.93039 2.56010 -105.30821 955.26603
6215.0000 -112.67246 -106.67325 5.99921 2.46543 -106.54112 889.86425
6220.0000 -112.43171 -106.98718 5.44453 2.40285 -107.35616 852.12416
6225.0000 -112.98546 -105.50972 7.47575 2.47412 -106.42795 946.22329
6230.0000 -111.40588 -105.10046 6.30542 2.57441 -105.12179 949.50198
6235.0000 -110.77387 -104.68972 6.08415 2.62498 -104.46320 1016.99195
6240.0000 -110.52662 -105.73283 4.79379 2.59906 -104.80077 1001.57283
6245.0000 -109.90656 -103.94500 5.96156 2.55849 -105.32923 984.06017
6250.0000 -110.23365 -105.07818 5.15547 2.57084 -105.16833 971.76364
MELTING PROCESS: loop number 26 T-loop= 970.00000000000000
main_MD> interactions number 26 at Temperature= 970.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.65705 0.79220 2.05870
force_rgl> df(natom) 1.89353 1.13971 1.51928
6255.0000 -111.65485 -106.26055 5.39431 2.58222 -105.02018 953.91065
6260.0000 -108.97502 -102.62968 6.34534 2.64995 -104.13805 1005.79422
6265.0000 -110.27573 -105.09662 5.17911 2.65941 -104.01486 1034.52225
6270.0000 -110.94752 -104.71132 6.23620 2.61642 -104.57478 966.66932
6275.0000 -111.07698 -106.15773 4.91925 2.55476 -105.37775 942.37040
6280.0000 -110.59688 -104.44099 6.15588 2.55048 -105.43354 947.27260
6285.0000 -110.19351 -104.11113 6.08238 2.65047 -104.13125 1035.13812
6290.0000 -109.86043 -104.88692 4.97351 2.59363 -104.87160 990.53823
6295.0000 -110.06477 -103.24867 6.81610 2.68211 -103.71922 1060.69721
6300.0000 -111.35307 -104.74513 6.60794 2.64996 -104.13794 1010.81082
6305.0000 -112.02000 -105.44527 6.57474 2.50674 -106.00318 940.24956
6310.0000 -109.16627 -103.69697 5.46931 2.58487 -104.98564 943.44700
6315.0000 -109.33453 -103.15413 6.18040 2.66056 -103.99989 1013.75532
6320.0000 -108.87656 -102.11234 6.76422 2.74638 -102.88224 1076.18937
6325.0000 -110.91925 -104.18138 6.73787 2.61768 -104.55834 1003.36866
6330.0000 -110.11881 -104.68423 5.43459 2.62928 -104.40718 1038.58248
6335.0000 -110.77526 -105.17519 5.60007 2.61892 -104.54216 981.84654
6340.0000 -110.18075 -103.97483 6.20593 2.61595 -104.58086 997.58470
6345.0000 -110.37183 -104.07735 6.29448 2.65673 -104.04975 1046.39908
6350.0000 -111.09358 -105.60481 5.48877 2.56890 -105.19364 962.13632
6355.0000 -110.47574 -104.93800 5.53775 2.56937 -105.18748 962.10423
6360.0000 -108.97599 -102.03078 6.94521 2.70993 -103.35682 1068.90269
6365.0000 -110.72152 -103.33094 7.39058 2.72894 -103.10930 1091.45836
6370.0000 -110.23682 -103.20496 7.03186 2.69540 -103.54615 1040.97126
6375.0000 -111.89328 -104.79916 7.09412 2.61555 -104.58611 1014.44832
6380.0000 -110.63188 -104.79163 5.84025 2.59166 -104.89724 948.07150
6385.0000 -110.06476 -105.10215 4.96260 2.59462 -104.85862 972.92214
6390.0000 -111.96172 -104.98418 6.97754 2.59184 -104.89484 970.62582
6395.0000 -111.54835 -104.97572 6.57263 2.60800 -104.68432 986.07664
6400.0000 -110.24720 -104.52267 5.72453 2.64634 -104.18509 1045.29887
6405.0000 -110.51634 -104.74348 5.77286 2.65848 -104.02698 1029.61083
6410.0000 -109.51412 -105.19109 4.32303 2.58884 -104.93396 982.76401
6415.0000 -110.74045 -105.12392 5.61653 2.58007 -105.04815 926.26832
6420.0000 -109.54288 -104.46142 5.08146 2.62989 -104.39936 1013.11818
6425.0000 -111.18389 -105.87588 5.30801 2.58094 -105.03684 942.04508
6430.0000 -110.71508 -103.72345 6.99163 2.56462 -105.24935 962.96872
6435.0000 -109.59862 -103.99040 5.60822 2.72714 -103.13276 1078.12726
6440.0000 -113.00967 -106.85654 6.15314 2.58685 -104.95981 987.19058
6445.0000 -112.11383 -106.17195 5.94187 2.47361 -106.43457 869.42185
6450.0000 -110.90686 -104.76090 6.14596 2.50560 -106.01802 908.15921
6455.0000 -111.66321 -104.87752 6.78570 2.55912 -105.32097 951.51445
6460.0000 -112.04461 -106.34249 5.70212 2.54201 -105.54388 953.05321
6465.0000 -111.96399 -106.64173 5.32226 2.45763 -106.64275 887.74461
6470.0000 -110.84838 -104.78260 6.06578 2.56396 -105.25791 966.31786
6475.0000 -112.05770 -104.23957 7.81814 2.64999 -104.13753 1018.51533
6480.0000 -111.20633 -104.68016 6.52617 2.64018 -104.26524 1016.15482
6485.0000 -111.06795 -104.84552 6.22243 2.63479 -104.33552 1016.54859
6490.0000 -111.01444 -105.59285 5.42159 2.56230 -105.27956 959.29235
6495.0000 -111.12868 -105.36370 5.76498 2.57961 -105.05417 987.15316
6500.0000 -111.82506 -106.04670 5.77836 2.61819 -104.55169 996.51796
MELTING PROCESS: loop number 27 T-loop= 995.00000000000000
main_MD> interactions number 27 at Temperature= 995.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -2.01845 4.34043 -4.10492
force_rgl> df(natom) -4.18771 2.24875 -0.04292
6505.0000 -110.61881 -104.46433 6.15448 2.58810 -104.94356 965.91887
6510.0000 -112.10921 -104.92531 7.18390 2.60604 -104.70986 999.40627
6515.0000 -112.52884 -106.84338 5.68546 2.49709 -106.12881 967.63870
6520.0000 -111.53053 -106.16224 5.36829 2.45509 -106.67585 885.49016
6525.0000 -110.23276 -104.91919 5.31357 2.55864 -105.32722 931.40665
6530.0000 -111.11894 -105.95892 5.16002 2.57316 -105.13807 937.03236
6535.0000 -111.22012 -104.72516 6.49495 2.54683 -105.48104 927.47463
6540.0000 -109.47245 -104.45042 5.02204 2.60729 -104.69364 979.01994
6545.0000 -111.49554 -105.90606 5.58948 2.56585 -105.23334 952.58085
6550.0000 -111.13000 -105.16598 5.96402 2.54836 -105.46111 971.95959
6555.0000 -112.42022 -106.80405 5.61617 2.52569 -105.75630 921.22050
6560.0000 -110.81147 -105.08144 5.73002 2.50257 -106.05747 886.89985
6565.0000 -111.32839 -106.05185 5.27653 2.51349 -105.91525 859.89740
6570.0000 -111.10057 -106.10677 4.99379 2.48179 -106.32812 867.36606
6575.0000 -111.14888 -105.80099 5.34789 2.46822 -106.50486 879.50737
6580.0000 -110.13489 -104.48991 5.64498 2.57373 -105.13069 981.62563
6585.0000 -109.81443 -103.83437 5.98006 2.65102 -104.12412 1007.89688
6590.0000 -109.17037 -102.68251 6.48786 2.68927 -103.62593 1049.85885
6595.0000 -110.12315 -103.66916 6.45400 2.71801 -103.25169 1047.61003
6600.0000 -109.35828 -103.38904 5.96924 2.67154 -103.85693 1042.86801
6605.0000 -110.07631 -103.82740 6.24890 2.68901 -103.62931 1012.97052
6610.0000 -111.16062 -105.87419 5.28643 2.57943 -105.05642 941.05049
6615.0000 -111.13738 -105.75456 5.38282 2.51201 -105.93451 913.42779
6620.0000 -111.45075 -105.92549 5.52526 2.54571 -105.49568 914.02464
6625.0000 -110.97698 -105.58941 5.38757 2.47440 -106.42432 861.74996
6630.0000 -111.28137 -106.58325 4.69812 2.50773 -105.99022 905.75201
6635.0000 -112.08267 -106.42644 5.65623 2.57811 -105.07372 991.40172
6640.0000 -110.76222 -104.66476 6.09747 2.47886 -106.36632 866.49316
6645.0000 -109.63678 -104.60506 5.03172 2.56098 -105.29679 944.27042
6650.0000 -110.58391 -105.12775 5.45616 2.60416 -104.73445 961.55844
6655.0000 -110.30140 -104.33344 5.96795 2.56995 -105.17997 953.45030
6660.0000 -109.63730 -103.98106 5.65623 2.61196 -104.63278 1008.64885
6665.0000 -110.85085 -103.56796 7.28289 2.70849 -103.37570 1047.55168
6670.0000 -109.96183 -103.06222 6.89961 2.69270 -103.58133 1068.80476
6675.0000 -110.59258 -103.67483 6.91775 2.65060 -104.12961 1045.74361
6680.0000 -111.52665 -105.77414 5.75251 2.61512 -104.59163 1030.82529
6685.0000 -111.19847 -105.13115 6.06732 2.53893 -105.58395 920.78884
6690.0000 -109.83420 -103.70927 6.12493 2.65252 -104.10454 1024.29721
6695.0000 -112.05403 -104.98337 7.07066 2.62302 -104.48873 995.60171
6700.0000 -110.64754 -104.65425 5.99328 2.54414 -105.51613 923.56917
6705.0000 -110.71973 -105.57805 5.14169 2.58667 -104.96217 949.27898
6710.0000 -110.41775 -104.80332 5.61443 2.54604 -105.49134 938.77196
6715.0000 -112.09370 -107.41092 4.68279 2.46157 -106.59137 897.84178
6720.0000 -111.05143 -106.03637 5.01507 2.48931 -106.23011 897.69862
6725.0000 -111.22608 -104.32084 6.90524 2.50601 -106.01260 931.19565
6730.0000 -110.33641 -102.77568 7.56072 2.76332 -102.66158 1115.36116
6735.0000 -111.06624 -104.38551 6.68073 2.63915 -104.27875 1044.59564
6740.0000 -110.34748 -103.93736 6.41012 2.64324 -104.22547 993.20063
6745.0000 -109.65339 -104.21115 5.44224 2.64315 -104.22661 1026.14891
6750.0000 -109.46572 -103.24305 6.22268 2.69148 -103.59713 1011.99464
MELTING PROCESS: loop number 28 T-loop= 1020.0000000000000
main_MD> interactions number 28 at Temperature= 1020.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.40822 -0.47440 -0.15677
force_rgl> df(natom) -3.00160 0.43148 -0.49294
6755.0000 -109.87870 -104.65095 5.22775 2.66316 -103.96603 999.20374
6760.0000 -110.02397 -104.72197 5.30200 2.60614 -104.70863 953.65627
6765.0000 -111.54127 -103.55067 7.99060 2.60883 -104.67351 1003.94181
6770.0000 -110.98785 -105.29703 5.69081 2.66056 -103.99988 1038.35569
6775.0000 -111.44032 -104.10213 7.33819 2.61955 -104.53402 1003.77077
6780.0000 -110.97123 -105.45079 5.52044 2.62426 -104.47256 1014.54292
6785.0000 -109.86097 -103.66892 6.19205 2.55873 -105.32606 939.77048
6790.0000 -109.79787 -102.99365 6.80422 2.75396 -102.78348 1102.19656
6795.0000 -109.96499 -104.19541 5.76958 2.66777 -103.90591 1011.10236
6800.0000 -110.55325 -103.41132 7.14193 2.65725 -104.04295 1029.98974
6805.0000 -110.35989 -103.94902 6.41087 2.73286 -103.05829 1058.74596
6810.0000 -110.40994 -104.83013 5.57982 2.64973 -104.14095 1013.25133
6815.0000 -110.07564 -104.16744 5.90819 2.66762 -103.90793 1039.02623
6820.0000 -110.01399 -103.14086 6.87313 2.70879 -103.37179 1038.43404
6825.0000 -111.18857 -104.75189 6.43668 2.59528 -104.85009 917.07789
6830.0000 -112.07008 -105.54367 6.52641 2.58129 -105.03219 924.90893
6835.0000 -109.23552 -103.20701 6.02851 2.62790 -104.42519 1008.95168
6840.0000 -110.78230 -103.62085 7.16145 2.72822 -103.11866 1069.99754
6845.0000 -110.88451 -104.34941 6.53511 2.66260 -103.97325 1049.18186
6850.0000 -111.75923 -106.47793 5.28130 2.55060 -105.43195 935.99866
6855.0000 -110.65074 -105.56380 5.08694 2.52464 -105.76999 913.67808
6860.0000 -110.87615 -105.58558 5.29057 2.55243 -105.40809 926.22502
6865.0000 -111.01745 -105.70346 5.31399 2.51145 -105.94183 911.90930
6870.0000 -111.41802 -105.70950 5.70852 2.55509 -105.37342 926.93210
6875.0000 -110.62028 -104.30015 6.32013 2.58439 -104.99191 991.24952
6880.0000 -110.91112 -105.43533 5.47579 2.56539 -105.23936 981.87549
6885.0000 -111.34317 -106.05265 5.29053 2.51393 -105.90953 931.85222
6890.0000 -111.76583 -106.31311 5.45271 2.48652 -106.26652 869.45701
6895.0000 -111.28565 -106.15511 5.13054 2.45904 -106.62443 868.26806
6900.0000 -111.92648 -106.46716 5.45932 2.47467 -106.42082 875.32058
6905.0000 -110.94660 -105.75954 5.18706 2.48477 -106.28934 896.54338
6910.0000 -111.63127 -105.41066 6.22061 2.58222 -105.02017 920.68318
6915.0000 -111.29363 -105.15119 6.14243 2.61192 -104.63335 1006.47130
6920.0000 -109.54693 -102.58669 6.96024 2.66641 -103.92369 1028.04756
6925.0000 -109.34537 -104.24664 5.09873 2.65229 -104.10757 1020.14269
6930.0000 -110.64012 -102.53203 8.10810 2.72328 -103.18298 1084.41904
6935.0000 -109.18898 -103.38206 5.80691 2.66052 -104.00035 1036.72275
6940.0000 -109.43711 -104.05152 5.38559 2.67125 -103.86064 1046.70320
6945.0000 -109.70943 -104.52824 5.18119 2.66530 -103.93812 1031.01912
6950.0000 -111.59417 -104.52140 7.07278 2.63232 -104.36764 1015.47455
6955.0000 -112.10084 -104.85548 7.24535 2.63308 -104.35780 1055.29422
6960.0000 -111.64633 -105.09662 6.54971 2.59935 -104.79700 988.69395
6965.0000 -109.75666 -104.74240 5.01426 2.55270 -105.40457 947.62227
6970.0000 -111.33771 -104.41808 6.91963 2.60292 -104.75058 986.09227
6975.0000 -110.32188 -105.55390 4.76798 2.57038 -105.17427 938.49520
6980.0000 -111.38630 -104.36606 7.02024 2.55677 -105.35159 964.60800
6985.0000 -110.66229 -105.39619 5.26610 2.60525 -104.72015 992.55385
6990.0000 -111.39459 -104.27364 7.12095 2.65714 -104.04442 1052.86056
6995.0000 -110.14009 -104.73484 5.40525 2.60316 -104.74745 956.41457
7000.0000 -110.27977 -103.84563 6.43414 2.67376 -103.82792 1022.16662
MELTING PROCESS: loop number 29 T-loop= 1045.0000000000000
main_MD> interactions number 29 at Temperature= 1045.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.98695 -0.32470 1.51959
force_rgl> df(natom) 1.71196 -1.12089 -5.41863
7005.0000 -108.95816 -101.47471 7.48345 2.75398 -102.78315 1092.33237
7010.0000 -109.86173 -103.87833 5.98339 2.72053 -103.21884 1057.45780
7015.0000 -110.41089 -104.16773 6.24316 2.59162 -104.89772 989.43704
7020.0000 -109.88795 -104.00128 5.88667 2.67070 -103.86779 1054.18679
7025.0000 -110.18719 -103.16118 7.02600 2.72295 -103.18732 1100.05052
7030.0000 -111.24075 -103.92277 7.31798 2.69321 -103.57461 1065.03923
7035.0000 -111.27108 -105.52675 5.74432 2.64044 -104.26185 1050.38871
7040.0000 -109.43852 -102.20529 7.23323 2.65387 -104.08698 1036.96067
7045.0000 -109.66850 -102.38799 7.28051 2.74231 -102.93517 1053.66835
7050.0000 -110.17790 -104.53506 5.64284 2.67253 -103.84395 1025.43885
7055.0000 -108.96179 -103.24393 5.71786 2.69397 -103.56470 1015.37471
7060.0000 -109.91003 -104.12483 5.78520 2.61207 -104.63136 939.09545
7065.0000 -111.63929 -105.59504 6.04425 2.62975 -104.40111 999.33253
7070.0000 -110.10230 -104.95328 5.14902 2.57316 -105.13811 972.69515
7075.0000 -111.06622 -105.50700 5.55922 2.62023 -104.52517 967.36725
7080.0000 -108.72810 -102.74916 5.97893 2.60018 -104.78626 965.50109
7085.0000 -109.74379 -103.96153 5.78226 2.71316 -103.31479 1078.37219
7090.0000 -110.32431 -104.16555 6.15876 2.61763 -104.55899 1024.91851
7095.0000 -111.84096 -105.04298 6.79798 2.59481 -104.85616 998.80541
7100.0000 -112.58854 -106.15540 6.43314 2.57535 -105.10961 1009.20991
7105.0000 -111.77861 -106.03485 5.74376 2.54932 -105.44865 978.23757
7110.0000 -110.59136 -105.61545 4.97590 2.51205 -105.93397 886.89983
7115.0000 -110.01402 -104.49938 5.51463 2.54855 -105.45869 938.19593
7120.0000 -109.66360 -104.14341 5.52019 2.64409 -104.21442 985.37846
7125.0000 -111.19815 -104.45618 6.74197 2.69097 -103.60381 1060.17897
7130.0000 -110.39681 -102.38280 8.01401 2.72835 -103.11694 1083.95668
7135.0000 -109.78225 -102.89749 6.88475 2.73255 -103.06231 1161.03313
7140.0000 -111.38104 -104.94767 6.43337 2.61809 -104.55299 1015.60186
7145.0000 -110.15930 -103.70551 6.45379 2.63114 -104.38307 1001.67015
7150.0000 -110.25484 -104.01585 6.23899 2.66033 -104.00290 1038.48554
7155.0000 -111.14188 -105.24959 5.89230 2.61673 -104.57067 1014.99750
7160.0000 -111.74289 -105.71452 6.02837 2.55517 -105.37240 950.82709
7165.0000 -110.85551 -105.66096 5.19455 2.52887 -105.71491 918.45102
7170.0000 -111.41175 -105.60857 5.80318 2.51634 -105.87808 924.81801
7175.0000 -109.66959 -102.86898 6.80061 2.71349 -103.31049 1088.91212
7180.0000 -109.93380 -103.50609 6.42771 2.68378 -103.69745 1078.74817
7185.0000 -109.63922 -103.20051 6.43871 2.70171 -103.46397 1043.67467
7190.0000 -110.90647 -103.77871 7.12776 2.67105 -103.86319 1043.13033
7195.0000 -110.35293 -104.28807 6.06486 2.70697 -103.39549 1080.85158
7200.0000 -108.34637 -102.07961 6.26675 2.68371 -103.69836 1044.57887
7205.0000 -109.32206 -101.61163 7.71044 2.82543 -101.85266 1172.93457
7210.0000 -108.72742 -101.39653 7.33089 2.85185 -101.50857 1119.66883
7215.0000 -108.53972 -102.22880 6.31091 2.81454 -101.99448 1143.28827
7220.0000 -110.39080 -103.53286 6.85794 2.74772 -102.86471 1096.50779
7225.0000 -110.31300 -104.61996 5.69304 2.69405 -103.56366 1079.97039
7230.0000 -110.89959 -105.02624 5.87335 2.56501 -105.24421 977.23453
7235.0000 -111.98446 -105.66778 6.31668 2.56884 -105.19436 977.47498
7240.0000 -111.70593 -105.85682 5.84910 2.49977 -106.09388 902.18890
7245.0000 -110.75682 -104.75042 6.00640 2.59946 -104.79554 993.35735
7250.0000 -110.26052 -104.83029 5.43023 2.63456 -104.33850 1009.59821
MELTING PROCESS: loop number 30 T-loop= 1070.0000000000000
main_MD> interactions number 30 at Temperature= 1070.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.94279 -0.22439 0.15569
force_rgl> df(natom) 2.19389 1.11374 -1.52739
7255.0000 -109.56513 -102.55805 7.00708 2.72986 -103.09731 1050.65328
7260.0000 -109.03983 -103.51499 5.52484 2.68331 -103.70363 1017.62008
7265.0000 -108.86136 -102.89655 5.96482 2.71278 -103.31980 1080.83597
7270.0000 -110.47960 -103.57689 6.90270 2.71147 -103.33679 1079.84952
7275.0000 -110.15611 -105.14993 5.00618 2.67596 -103.79934 995.66107
7280.0000 -109.54596 -102.36528 7.18068 2.68587 -103.67025 1066.76560
7285.0000 -108.65026 -101.11164 7.53863 2.83395 -101.74172 1165.67535
7290.0000 -110.71389 -103.09437 7.61952 2.79120 -102.29841 1099.52159
7295.0000 -108.43360 -101.43751 6.99609 2.76282 -102.66803 1092.30164
7300.0000 -109.74156 -102.48574 7.25582 2.79838 -102.20491 1115.79095
7305.0000 -109.93184 -104.88921 5.04263 2.65168 -104.11548 1030.80898
7310.0000 -109.81372 -104.57361 5.24010 2.57728 -105.08451 981.13921
7315.0000 -110.05048 -103.49166 6.55883 2.65465 -104.07680 1016.91676
7320.0000 -110.11763 -103.51124 6.60639 2.65866 -104.02460 1047.45173
7325.0000 -108.93683 -102.24374 6.69309 2.74508 -102.89911 1080.99325
7330.0000 -110.22134 -103.19100 7.03034 2.73644 -103.01166 1069.84742
7335.0000 -110.07367 -103.16110 6.91257 2.68469 -103.68556 1024.47496
7340.0000 -109.74044 -101.93507 7.80537 2.75979 -102.70758 1102.55443
7345.0000 -110.10703 -103.58345 6.52358 2.77293 -102.53642 1115.84050
7350.0000 -111.17724 -104.17411 7.00313 2.61673 -104.57073 996.87889
7355.0000 -107.45141 -100.57760 6.87380 2.85045 -101.52684 1210.12894
7360.0000 -109.78912 -101.65130 8.13782 2.85708 -101.44045 1169.67410
7365.0000 -108.50500 -103.22744 5.27756 2.75803 -102.73042 1085.76333
7370.0000 -109.42003 -102.04395 7.37609 2.74471 -102.90388 1076.30528
7375.0000 -109.58909 -102.81275 6.77634 2.78200 -102.41833 1135.04313
7380.0000 -109.40186 -102.66330 6.73856 2.76716 -102.61150 1124.88951
7385.0000 -109.52827 -101.72076 7.80751 2.77731 -102.47942 1112.47257
7390.0000 -109.22368 -102.28056 6.94311 2.73346 -103.05039 1140.94453
7395.0000 -109.11869 -102.02855 7.09014 2.77420 -102.51983 1082.45309
7400.0000 -109.57785 -103.27438 6.30347 2.79064 -102.30577 1118.39913
7405.0000 -109.30413 -101.52357 7.78056 2.84800 -101.55876 1189.97246
7410.0000 -108.16308 -101.05284 7.11024 2.86974 -101.27555 1177.22427
7415.0000 -109.55248 -102.57485 6.97763 2.88850 -101.03132 1230.33265
7420.0000 -110.05676 -103.00738 7.04938 2.80656 -102.09846 1137.26885
7425.0000 -110.20998 -102.03038 8.17959 2.74761 -102.86612 1081.25686
7430.0000 -108.12028 -100.05444 8.06584 2.84294 -101.62463 1175.50449
7435.0000 -108.99009 -101.09989 7.89020 2.89116 -100.99660 1196.21118
7440.0000 -110.90144 -104.83194 6.06950 2.74472 -102.90385 1071.88477
7445.0000 -111.57552 -105.53058 6.04494 2.64283 -104.23075 1042.01035
7450.0000 -111.07837 -105.48343 5.59494 2.52009 -105.82930 938.81454
7455.0000 -110.69644 -103.41896 7.27748 2.57134 -105.16177 1016.91106
7460.0000 -108.85972 -101.73582 7.12390 2.79440 -102.25680 1182.89054
7465.0000 -109.23986 -103.20692 6.03295 2.77148 -102.55531 1132.42276
7470.0000 -110.02543 -104.10545 5.91998 2.75052 -102.82825 1092.96773
7475.0000 -108.46854 -103.01619 5.45235 2.70346 -103.44110 1046.50167
7480.0000 -109.76948 -104.52019 5.24929 2.70746 -103.38903 1065.60200
7485.0000 -110.23664 -104.98240 5.25424 2.66300 -103.96808 999.88558
7490.0000 -109.13771 -102.97741 6.16030 2.64659 -104.18185 1003.46234
7495.0000 -109.36872 -102.61112 6.75761 2.73268 -103.06056 1058.03910
7500.0000 -111.87186 -105.97593 5.89594 2.55838 -105.33063 957.83198
MELTING PROCESS: loop number 31 T-loop= 1095.0000000000000
main_MD> interactions number 31 at Temperature= 1095.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.13415 0.37094 0.52678
force_rgl> df(natom) 1.28729 -2.25972 3.04797
7505.0000 -110.45597 -103.86519 6.59078 2.54829 -105.46207 919.80483
7510.0000 -109.60376 -103.05158 6.55218 2.69187 -103.59205 1001.96550
7515.0000 -109.10628 -103.14722 5.95906 2.79994 -102.18466 1109.97075
7520.0000 -110.48242 -104.65718 5.82523 2.69297 -103.57782 1049.43613
7525.0000 -109.13148 -102.76891 6.36256 2.66936 -103.88527 1015.23951
7530.0000 -109.84163 -103.27867 6.56296 2.74316 -102.92411 1085.85109
7535.0000 -109.13421 -103.48093 5.65328 2.70295 -103.44782 1051.14918
7540.0000 -109.55236 -103.89941 5.65295 2.68252 -103.71393 1065.76692
7545.0000 -110.41303 -103.35827 7.05476 2.61131 -104.64131 994.06109
7550.0000 -109.60585 -102.61185 6.99400 2.73026 -103.09211 1107.70569
7555.0000 -108.93011 -102.75490 6.17521 2.68725 -103.65231 1053.02346
7560.0000 -108.76207 -103.23815 5.52392 2.69355 -103.57025 1046.55075
7565.0000 -109.61930 -101.87046 7.74883 2.81191 -102.02875 1124.19037
7570.0000 -109.69167 -103.12090 6.57077 2.79322 -102.27212 1128.98664
7575.0000 -109.86294 -103.06931 6.79363 2.79372 -102.26564 1096.44206
7580.0000 -110.25092 -104.83879 5.41213 2.59649 -104.83427 990.55853
7585.0000 -111.14260 -103.87260 7.27001 2.59674 -104.83109 949.52343
7590.0000 -110.09545 -102.91508 7.18037 2.71668 -103.26900 1062.26950
7595.0000 -111.15717 -104.63005 6.52712 2.67203 -103.85051 1063.17137
7600.0000 -110.60510 -104.14217 6.46292 2.62438 -104.47103 965.20512
7605.0000 -110.91207 -104.51635 6.39572 2.68595 -103.66925 1014.51004
7610.0000 -110.42938 -102.80908 7.62030 2.72249 -103.19326 1074.74558
7615.0000 -109.41041 -103.15147 6.25894 2.69080 -103.60599 1079.29779
7620.0000 -109.24769 -101.52492 7.72278 2.75824 -102.72768 1110.99208
7625.0000 -108.80522 -102.70861 6.09662 2.81546 -101.98252 1184.53751
7630.0000 -109.71068 -103.10216 6.60852 2.78967 -102.31838 1142.84727
7635.0000 -109.69137 -101.26930 8.42207 2.84568 -101.58887 1165.87884
7640.0000 -108.43388 -100.48142 7.95247 2.84189 -101.63826 1179.41036
7645.0000 -108.69970 -102.15468 6.54502 2.90683 -100.79247 1192.87945
7650.0000 -110.22700 -104.94537 5.28162 2.70042 -103.48071 1049.35269
7655.0000 -110.65389 -104.50193 6.15196 2.61426 -104.60291 1003.81236
7660.0000 -110.51404 -102.38547 8.12858 2.67580 -103.80134 1011.28365
7665.0000 -109.17058 -103.46683 5.70374 2.64494 -104.20324 1034.93114
7670.0000 -110.53853 -104.17838 6.36015 2.66440 -103.94990 1029.20162
7675.0000 -109.72101 -102.35342 7.36759 2.65584 -104.06138 1055.76497
7680.0000 -110.52619 -102.83615 7.69004 2.78093 -102.43223 1138.97764
7685.0000 -110.00288 -103.37863 6.62425 2.76293 -102.66664 1118.15421
7690.0000 -109.81126 -103.83835 5.97291 2.71786 -103.25360 1087.20914
7695.0000 -109.40839 -103.22901 6.17938 2.68550 -103.67505 1040.96889
7700.0000 -109.37268 -102.66923 6.70345 2.76827 -102.59710 1128.56055
7705.0000 -110.47912 -104.42441 6.05471 2.68406 -103.69377 1045.37718
7710.0000 -109.13048 -103.34964 5.78084 2.67273 -103.84134 1006.76401
7715.0000 -110.56192 -104.76810 5.79382 2.61184 -104.63435 989.85898
7720.0000 -109.07805 -102.73634 6.34172 2.67196 -103.85144 1051.66209
7725.0000 -110.33551 -103.55574 6.77977 2.73590 -103.01861 1077.00771
7730.0000 -110.50427 -103.40394 7.10033 2.65343 -104.09275 991.83872
7735.0000 -110.22902 -103.62345 6.60557 2.64621 -104.18674 1019.97002
7740.0000 -108.33705 -101.97962 6.35742 2.75934 -102.71340 1059.74907
7745.0000 -110.88843 -103.14992 7.73850 2.78979 -102.31686 1122.44738
7750.0000 -108.55926 -102.94183 5.61743 2.77006 -102.57372 1093.51428
MELTING PROCESS: loop number 32 T-loop= 1120.0000000000000
main_MD> interactions number 32 at Temperature= 1120.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -2.17596 -0.57125 -2.00788
force_rgl> df(natom) 0.86003 -1.26630 2.81581
7755.0000 -111.00254 -102.85977 8.14277 2.74966 -102.83949 1104.86023
7760.0000 -109.34426 -102.67767 6.66659 2.76339 -102.66068 1116.08340
7765.0000 -108.08436 -99.61233 8.47203 2.89360 -100.96488 1199.54222
7770.0000 -108.46821 -100.92033 7.54788 2.90647 -100.79719 1227.52966
7775.0000 -110.44747 -102.83151 7.61596 2.84398 -101.61103 1182.09034
7780.0000 -111.30034 -102.56306 8.73727 2.77327 -102.53193 1152.83659
7785.0000 -109.68621 -103.11067 6.57554 2.70951 -103.36230 1091.82672
7790.0000 -109.43397 -102.38683 7.04714 2.79432 -102.25777 1118.44938
7795.0000 -108.81644 -101.86733 6.94911 2.84278 -101.62674 1169.40399
7800.0000 -109.17184 -101.40765 7.76419 2.79775 -102.21322 1137.09162
7805.0000 -110.76478 -103.47464 7.29014 2.76288 -102.66725 1096.43323
7810.0000 -108.31465 -101.45057 6.86408 2.77965 -102.44888 1128.35717
7815.0000 -107.82076 -100.00988 7.81089 2.95106 -100.21648 1228.79340
7820.0000 -108.17121 -101.14221 7.02900 2.84988 -101.53427 1121.39374
7825.0000 -109.20547 -102.53033 6.67514 2.80635 -102.10114 1098.87086
7830.0000 -107.74403 -101.95869 5.78534 2.73805 -102.99071 1134.66360
7835.0000 -110.30904 -102.27418 8.03486 2.83491 -101.72925 1144.15116
7840.0000 -110.06807 -103.30334 6.76473 2.72159 -103.20498 1092.97115
7845.0000 -108.67814 -101.36717 7.31097 2.78196 -102.41877 1122.50976
7850.0000 -109.27874 -102.90144 6.37729 2.86874 -101.28863 1194.88774
7855.0000 -109.21903 -101.41856 7.80047 2.76800 -102.60060 1149.86749
7860.0000 -109.55259 -103.82224 5.73035 2.77885 -102.45928 1123.57725
7865.0000 -108.39980 -101.09802 7.30179 2.83776 -101.69206 1121.19975
7870.0000 -107.27985 -101.55099 5.72886 2.86030 -101.39846 1156.68946
7875.0000 -108.95503 -102.19191 6.76312 2.78662 -102.35808 1136.56376
7880.0000 -110.62918 -102.83325 7.79593 2.79885 -102.19888 1203.61269
7885.0000 -108.78144 -100.61891 8.16253 2.86535 -101.33280 1245.33591
7890.0000 -107.84754 -101.11148 6.73606 2.87179 -101.24888 1201.67673
7895.0000 -108.60804 -101.55273 7.05530 2.91162 -100.73018 1170.50406
7900.0000 -110.13107 -102.46931 7.66176 2.76625 -102.62343 1109.21342
7905.0000 -110.24801 -102.98382 7.26419 2.73317 -103.05416 1094.95679
7910.0000 -111.59377 -103.70484 7.88893 2.74568 -102.89131 1134.30447
7915.0000 -109.21919 -102.90611 6.31308 2.71681 -103.26725 1105.97622
7920.0000 -108.63240 -102.35532 6.27708 2.75906 -102.71708 1106.69165
7925.0000 -109.91664 -103.45076 6.46587 2.79478 -102.25185 1101.16544
7930.0000 -109.77703 -103.18421 6.59282 2.72409 -103.17245 1071.11433
7935.0000 -110.41195 -104.10824 6.30371 2.69755 -103.51811 1027.78458
7940.0000 -109.65035 -103.44868 6.20167 2.66697 -103.91640 1001.08348
7945.0000 -107.83426 -101.13598 6.69829 2.74675 -102.87734 1065.41361
7950.0000 -109.18632 -101.92407 7.26225 2.85027 -101.52909 1186.49762
7955.0000 -109.21185 -102.11521 7.09664 2.85390 -101.48183 1169.66706
7960.0000 -109.74046 -103.13128 6.60918 2.73421 -103.04069 1069.39732
7965.0000 -108.66260 -101.27287 7.38973 2.80518 -102.11637 1135.26241
7970.0000 -109.63071 -101.86443 7.76627 2.82897 -101.80650 1152.14510
7975.0000 -109.05701 -102.82979 6.22722 2.89950 -100.88798 1216.59348
7980.0000 -111.32743 -103.38129 7.94614 2.72724 -103.13145 1120.53476
7985.0000 -109.49364 -103.17300 6.32064 2.64435 -104.21103 1037.43324
7990.0000 -109.05819 -102.70354 6.35464 2.69154 -103.59646 1024.57756
7995.0000 -110.36594 -102.92468 7.44127 2.79447 -102.25585 1129.65136
8000.0000 -108.61116 -102.00676 6.60441 2.73439 -103.03830 1095.75423
MELTING PROCESS: loop number 33 T-loop= 1145.0000000000000
main_MD> interactions number 33 at Temperature= 1145.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -2.88575 1.25783 -3.27408
force_rgl> df(natom) 0.77883 0.47433 -1.14166
8005.0000 -108.95872 -103.09715 5.86157 2.82730 -101.82825 1118.54173
8010.0000 -108.43996 -102.47699 5.96296 2.73343 -103.05080 1057.49732
8015.0000 -110.26219 -103.70579 6.55640 2.71161 -103.33494 1070.80965
8020.0000 -108.91226 -102.86091 6.05135 2.72803 -103.12116 1089.59420
8025.0000 -108.83292 -102.11927 6.71364 2.83893 -101.67680 1190.86382
8030.0000 -110.00657 -101.51246 8.49411 2.86800 -101.29826 1141.13122
8035.0000 -107.59572 -99.65772 7.93800 2.92461 -100.56100 1233.10436
8040.0000 -108.95436 -102.05653 6.89783 2.95923 -100.11009 1275.82031
8045.0000 -109.47723 -103.34908 6.12815 2.72101 -103.21258 1076.80312
8050.0000 -108.13002 -99.50523 8.62479 2.88897 -101.02519 1197.89275
8055.0000 -107.70090 -100.22481 7.47609 2.99547 -99.63809 1323.88500
8060.0000 -110.77222 -105.12446 5.64776 2.66223 -103.97805 1038.29930
8065.0000 -109.56087 -103.74764 5.81323 2.63836 -104.28896 1014.96056
8070.0000 -111.46861 -104.59609 6.87252 2.74990 -102.83636 1078.36339
8075.0000 -110.33683 -104.02480 6.31204 2.67748 -103.77944 1039.04368
8080.0000 -109.61384 -103.58101 6.03284 2.68798 -103.64275 1052.04134
8085.0000 -107.85415 -101.80510 6.04905 2.81235 -102.02299 1155.95303
8090.0000 -108.45131 -102.11213 6.33918 2.80609 -102.10452 1091.63484
8095.0000 -109.25683 -102.91427 6.34256 2.70051 -103.47960 1032.09156
8100.0000 -109.59030 -102.66992 6.92038 2.68856 -103.63517 1051.67121
8105.0000 -109.54010 -103.19119 6.34891 2.73375 -103.04661 1058.64769
8110.0000 -109.26189 -103.46058 5.80131 2.71210 -103.32867 1070.07748
8115.0000 -109.12887 -103.58269 5.54619 2.74654 -102.88013 1067.74333
8120.0000 -109.85594 -103.53812 6.31782 2.68391 -103.69582 1061.56445
8125.0000 -108.66913 -100.70015 7.96898 2.85437 -101.47579 1117.54390
8130.0000 -109.02243 -103.50836 5.51407 2.78466 -102.38361 1121.45823
8135.0000 -111.08354 -102.85257 8.23097 2.74682 -102.87642 1111.65436
8140.0000 -110.15560 -102.95802 7.19758 2.81277 -102.01753 1159.39016
8145.0000 -110.04184 -103.03079 7.01105 2.78541 -102.37390 1108.12254
8150.0000 -109.86997 -102.73545 7.13452 2.71472 -103.29448 1085.90269
8155.0000 -108.21653 -102.00847 6.20806 2.83407 -101.74018 1132.14740
8160.0000 -107.73194 -101.52357 6.20836 2.79008 -102.31307 1096.80077
8165.0000 -108.86773 -102.12740 6.74033 2.80577 -102.10865 1145.45104
8170.0000 -109.49111 -103.13103 6.36008 2.76849 -102.59428 1095.47747
8175.0000 -108.55264 -102.02185 6.53079 2.77963 -102.44919 1056.22390
8180.0000 -108.29102 -102.32440 5.96661 2.81281 -102.01700 1141.38433
8185.0000 -109.26220 -102.41589 6.84631 2.81174 -102.03094 1131.44369
8190.0000 -107.85864 -101.12975 6.72889 2.85393 -101.48155 1184.31374
8195.0000 -109.12725 -103.54485 5.58239 2.77191 -102.54968 1073.18408
8200.0000 -108.45127 -101.79992 6.65135 2.77662 -102.48837 1109.53100
8205.0000 -108.51516 -103.75077 4.76439 2.76257 -102.67128 1102.22954
8210.0000 -110.12152 -103.08114 7.04039 2.70675 -103.39830 1073.04464
8215.0000 -109.39938 -103.83271 5.56667 2.75317 -102.79376 1139.00358
8220.0000 -110.58404 -102.19792 8.38613 2.76619 -102.62417 1114.78665
8225.0000 -108.43154 -102.37990 6.05164 2.76361 -102.65783 1107.88280
8230.0000 -109.40487 -102.69431 6.71056 2.74322 -102.92338 1085.71983
8235.0000 -108.87314 -102.18240 6.69074 2.72709 -103.13344 1098.45388
8240.0000 -109.54030 -103.46360 6.07671 2.87016 -101.27014 1201.43718
8245.0000 -109.11302 -100.83681 8.27621 2.83878 -101.67875 1158.77599
8250.0000 -107.70475 -99.48704 8.21771 2.93682 -100.40199 1258.25858
MELTING PROCESS: loop number 34 T-loop= 1170.0000000000000
main_MD> interactions number 34 at Temperature= 1170.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 3.76289 -0.03802 0.68750
force_rgl> df(natom) 1.62061 0.50305 1.39827
8255.0000 -107.15990 -99.44681 7.71309 3.02178 -99.29546 1283.13134
8260.0000 -108.01923 -101.44273 6.57650 2.93328 -100.44803 1189.64289
8265.0000 -108.41415 -100.25106 8.16310 2.94741 -100.26399 1236.92266
8270.0000 -107.34466 -99.91960 7.42505 2.97305 -99.93009 1247.67252
8275.0000 -109.22609 -102.13707 7.08902 2.93370 -100.44258 1178.06170
8280.0000 -108.93813 -102.39357 6.54456 2.80730 -102.08872 1167.76518
8285.0000 -109.01003 -103.79307 5.21696 2.72768 -103.12572 1075.20632
8290.0000 -106.37618 -100.39486 5.98133 2.83736 -101.69728 1158.68003
8295.0000 -108.66067 -102.67499 5.98568 2.86951 -101.27854 1233.24272
8300.0000 -109.19498 -100.94337 8.25161 2.83340 -101.74884 1145.06457
8305.0000 -107.16645 -100.26628 6.90017 2.90294 -100.84315 1223.48317
8310.0000 -108.07585 -100.63449 7.44136 2.95788 -100.12769 1217.21187
8315.0000 -108.51193 -102.43350 6.07843 2.81809 -101.94822 1170.01835
8320.0000 -108.01861 -101.34136 6.67725 2.86801 -101.29815 1193.43018
8325.0000 -108.24607 -101.84361 6.40246 2.89724 -100.91740 1185.22635
8330.0000 -107.30268 -100.59796 6.70472 2.85104 -101.51913 1169.69819
8335.0000 -108.23782 -100.99874 7.23908 2.91831 -100.64301 1205.15922
8340.0000 -108.31827 -100.35316 7.96511 2.88096 -101.12947 1189.71320
8345.0000 -108.17783 -101.72644 6.45139 2.89799 -100.90766 1224.92796
8350.0000 -109.51287 -102.75699 6.75588 2.75958 -102.71032 1089.23869
8355.0000 -107.62840 -101.09248 6.53592 2.80203 -102.15743 1121.73288
8360.0000 -108.68386 -101.69248 6.99138 2.81098 -102.04084 1176.85885
8365.0000 -109.80079 -102.00345 7.79734 2.86549 -101.33097 1205.49474
8370.0000 -109.37369 -103.14526 6.22843 2.77530 -102.50557 1096.37483
8375.0000 -108.46358 -100.96162 7.50196 2.83343 -101.74853 1142.30244
8380.0000 -107.64868 -100.61795 7.03072 2.87378 -101.22294 1164.58292
8385.0000 -109.62356 -103.53743 6.08613 2.79319 -102.27256 1126.07904
8390.0000 -108.39504 -100.36785 8.02719 2.86276 -101.36648 1199.08703
8395.0000 -109.05994 -101.98091 7.07903 2.85770 -101.43239 1211.29927
8400.0000 -109.64386 -101.32030 8.32356 2.94334 -100.31701 1245.19441
8405.0000 -109.03841 -101.10389 7.93453 2.84184 -101.63900 1187.18037
8410.0000 -106.59831 -99.70490 6.89341 2.97837 -99.86076 1263.55487
8415.0000 -108.35903 -99.43665 8.92237 2.97464 -99.90934 1262.73926
8420.0000 -107.89279 -99.67684 8.21595 3.06922 -98.67758 1305.07413
8425.0000 -108.66231 -99.91165 8.75066 2.99361 -99.66234 1233.73194
8430.0000 -109.82769 -101.26695 8.56074 2.92100 -100.60803 1238.79468
8435.0000 -109.39421 -102.83945 6.55476 2.80976 -102.05672 1157.32652
8440.0000 -106.53584 -100.01914 6.51670 2.92109 -100.60681 1226.30107
8445.0000 -107.46993 -100.64909 6.82084 2.96590 -100.02326 1272.40886
8450.0000 -109.60039 -102.30371 7.29668 2.85102 -101.51938 1148.84747
8455.0000 -110.04419 -100.83199 9.21220 2.84513 -101.59612 1162.63893
8460.0000 -109.76578 -103.29182 6.47396 2.83491 -101.72913 1140.03308
8465.0000 -109.29194 -102.56981 6.72214 2.68479 -103.68426 1035.08702
8470.0000 -108.97773 -100.71478 8.26295 2.83771 -101.69271 1170.17898
8475.0000 -107.24773 -101.76684 5.48089 2.92454 -100.56191 1227.12951
8480.0000 -109.81126 -102.73467 7.07660 2.79726 -102.21953 1134.80477
8485.0000 -108.98541 -102.21226 6.77315 2.72709 -103.13336 1093.34199
8490.0000 -107.69350 -98.75765 8.93585 2.97417 -99.91554 1242.36709
8495.0000 -108.31664 -99.43158 8.88506 3.01355 -99.40265 1298.76609
8500.0000 -108.30311 -101.42929 6.87382 2.91774 -100.65043 1169.13437
MELTING PROCESS: loop number 35 T-loop= 1195.0000000000000
main_MD> interactions number 35 at Temperature= 1195.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 8.46114 -2.77024 -4.46007
force_rgl> df(natom) 0.89412 -0.82899 3.55980
8505.0000 -107.81574 -100.49586 7.31988 2.98396 -99.78799 1289.54499
8510.0000 -108.06319 -101.66630 6.39689 2.88313 -101.10125 1203.81455
8515.0000 -107.50224 -99.53619 7.96604 2.91527 -100.68256 1142.51582
8520.0000 -108.18053 -101.33173 6.84880 2.89778 -100.91035 1251.54740
8525.0000 -106.82675 -100.24089 6.58586 2.82214 -101.89554 1155.70243
8530.0000 -109.53924 -101.99034 7.54890 2.95716 -100.13706 1201.85526
8535.0000 -107.10340 -99.17822 7.92518 2.92338 -100.57704 1262.76472
8540.0000 -106.79823 -98.42832 8.36992 2.97332 -99.92663 1266.94250
8545.0000 -108.86319 -100.83758 8.02561 2.98457 -99.78005 1291.42592
8550.0000 -108.34982 -101.63439 6.71543 2.93899 -100.37370 1242.95155
8555.0000 -107.25677 -99.88170 7.37507 2.90048 -100.87527 1192.94485
8560.0000 -107.43903 -101.08718 6.35186 2.89107 -100.99784 1210.47947
8565.0000 -108.37219 -101.94064 6.43155 2.86801 -101.29816 1176.08837
8570.0000 -109.25337 -102.11949 7.13388 2.82346 -101.87832 1154.92491
8575.0000 -109.10025 -101.89960 7.20065 2.82258 -101.88975 1168.65545
8580.0000 -108.66012 -101.89387 6.76625 2.90781 -100.77982 1217.06083
8585.0000 -109.46687 -102.63849 6.82837 2.78501 -102.37908 1109.58701
8590.0000 -110.44960 -104.42277 6.02683 2.69789 -103.51364 1010.71567
8595.0000 -106.58294 -99.91534 6.66760 2.79287 -102.27670 1088.87136
8600.0000 -108.12600 -101.48078 6.64522 2.96609 -100.02071 1231.01889
8605.0000 -109.27632 -101.56325 7.71307 2.87072 -101.26278 1207.85891
8610.0000 -107.05303 -101.06981 5.98323 2.86185 -101.37834 1153.86853
8615.0000 -106.09074 -100.52675 5.56399 2.92569 -100.54693 1201.65434
8620.0000 -108.27787 -102.20709 6.07078 2.87425 -101.21688 1174.80607
8625.0000 -110.43365 -102.96335 7.47030 2.80781 -102.08209 1151.55866
8630.0000 -108.57252 -100.73641 7.83611 2.83096 -101.78063 1162.52109
8635.0000 -105.03250 -97.83032 7.20218 3.06038 -98.79269 1292.18374
8640.0000 -106.41327 -99.70817 6.70510 3.09799 -98.30288 1383.38417
8645.0000 -109.10886 -101.52079 7.58807 2.92510 -100.55458 1229.26895
8650.0000 -109.25744 -102.86421 6.39323 2.83439 -101.73594 1155.78272
8655.0000 -107.52680 -101.05983 6.46697 2.78951 -102.32050 1109.20725
8660.0000 -110.47704 -102.98549 7.49155 2.81319 -102.01211 1161.66078
8665.0000 -110.81511 -103.74697 7.06815 2.69587 -103.53996 1071.65124
8670.0000 -109.57552 -102.27899 7.29653 2.71987 -103.22742 1080.15042
8675.0000 -108.72927 -101.87890 6.85037 2.79651 -102.22924 1152.73194
8680.0000 -108.68109 -101.35750 7.32359 2.88243 -101.11029 1199.94512
8685.0000 -109.06523 -101.31328 7.75195 2.88380 -101.09242 1236.06857
8690.0000 -108.80737 -102.04334 6.76404 2.85013 -101.53097 1172.97563
8695.0000 -109.38491 -102.19339 7.19152 2.78217 -102.41612 1092.45340
8700.0000 -110.60114 -103.06404 7.53710 2.78412 -102.39061 1112.13681
8705.0000 -109.11804 -102.24507 6.87297 2.79153 -102.29422 1116.22067
8710.0000 -106.56688 -99.26817 7.29871 2.86162 -101.38136 1131.27941
8715.0000 -107.96822 -99.72231 8.24590 2.99760 -99.61040 1261.82289
8720.0000 -109.67168 -101.69212 7.97956 2.95436 -100.17348 1279.23038
8725.0000 -107.82413 -100.78196 7.04218 2.88059 -101.13423 1205.42447
8730.0000 -107.92684 -100.95546 6.97138 2.89007 -101.01085 1207.74293
8735.0000 -109.77874 -102.79423 6.98452 2.87476 -101.21023 1209.55081
8740.0000 -109.01327 -101.50588 7.50739 2.79287 -102.27666 1134.78453
8745.0000 -108.49421 -101.94484 6.54936 2.90177 -100.85844 1245.59392
8750.0000 -107.07722 -99.58387 7.49336 2.90404 -100.82888 1190.07357
main_MD> EXECUTION TIME: 0 [day], 0 [hour], 8 [min], 54.6252214 [s].
main_MD> Deallocating global variables
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