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nanoparticlesims/growth_Melting_Silver_ICO_2451/meltingSims/run_40/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_40.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 = 40 ntipo2 = 0
read_input> Finish reading input
main_MD> Allocating global variables
main_MD> Number of outputs that will be created: 1800
main_MD> Size of nv and nvoiz: 40 4000
main_MD> Size of nv and nvoiz: 40 4000
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 = 40
main_MD> Consider changing parameter nsiz in module_parameters.f90 for performance
main_MD> collvar_wanted = F
main_MD> INPUT AND POTENTIAL FILE READING IS DONE
main_MD> THERMALIZATION IS STARTING
init> -2.9943034427968484E-002 -0.14269241598946536 -0.15391241733219516 initial drift of cluster / NP1 for coalescence
init> 0.35592944645063207 0.35373587814954005 0.31475104937666465 scaling for velocity /for coalescence NP1
init.f90 > facguy = 1.8283595824469916E-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) 0.56398 -1.42478 -2.12276
force_rgl> df(natom) -1.71522 0.55427 -0.10856
preparo> THERMALIZATION PROCESS AT 290.26251970936136
preparo> TOTAL ENERGY, KINETIC EN., POT. ENERGY, DELTA
5000 -97.220038117561529 2.2655142952368665 -99.485552412798398 3.8687907712121639E-004
preparo> END THERMALISATION ON NPAST DEFINE IN PARACLUSTER MODULE
main_MD> Time-loop is starting for melting
main_MD> Now the computation of EXECUTION TIME starts
main_MD> Running from loop 1 to 36
MELTING PROCESS: loop number 1 T-loop= 315.00000000000000
main_MD> interactions number 1 at Temperature= 315.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.35337 0.48404 0.92103
force_rgl> df(natom) 1.49944 0.45807 0.69377
5.0000 -99.49950 -97.95366 1.54584 1.75698 -97.45020 373.20867
10.0000 -99.64067 -97.78497 1.85571 1.72769 -97.79281 333.54868
15.0000 -99.79979 -98.29530 1.50449 1.71860 -97.89916 332.36209
20.0000 -100.21193 -98.72334 1.48858 1.67337 -98.42810 282.11703
25.0000 -99.97753 -98.49346 1.48407 1.65779 -98.61035 265.80177
30.0000 -99.73877 -98.18569 1.55308 1.66341 -98.54460 271.23757
35.0000 -99.81812 -98.22509 1.59303 1.68321 -98.31300 296.84044
40.0000 -99.90299 -98.54065 1.36234 1.70819 -98.02090 323.11544
45.0000 -99.98446 -98.66161 1.32286 1.64609 -98.74721 255.14112
50.0000 -100.13419 -98.57145 1.56274 1.66730 -98.49913 277.21374
55.0000 -99.87244 -98.10711 1.76533 1.68353 -98.30926 294.96786
60.0000 -99.91727 -97.85796 2.05931 1.70523 -98.05551 322.62414
65.0000 -99.88151 -98.33134 1.55017 1.70045 -98.11144 310.36811
70.0000 -99.78171 -98.34548 1.43623 1.68892 -98.24630 298.83739
75.0000 -99.69773 -98.39082 1.30691 1.68119 -98.33663 289.00965
80.0000 -99.75312 -98.49611 1.25700 1.66112 -98.57146 267.41058
85.0000 -99.61063 -98.37424 1.23639 1.66963 -98.47188 279.59864
90.0000 -99.78711 -98.38035 1.40675 1.69186 -98.21188 306.17078
95.0000 -99.43123 -98.06474 1.36648 1.70110 -98.10382 314.90803
100.0000 -99.48308 -97.85243 1.63065 1.71118 -97.98589 321.24857
105.0000 -99.71843 -97.62115 2.09728 1.74290 -97.61493 358.72398
110.0000 -99.71744 -98.36045 1.35699 1.69743 -98.14679 311.09802
115.0000 -99.94884 -98.44963 1.49921 1.66503 -98.52570 278.70716
120.0000 -99.73004 -97.96994 1.76010 1.68555 -98.28569 296.83198
125.0000 -99.77375 -98.25893 1.51482 1.70891 -98.01245 322.97331
130.0000 -99.98252 -98.49271 1.48982 1.69257 -98.20360 303.89799
135.0000 -99.87779 -98.69548 1.18230 1.66698 -98.50293 276.11383
140.0000 -99.92416 -98.55305 1.37110 1.66385 -98.53954 271.40358
145.0000 -100.03152 -98.39451 1.63702 1.67337 -98.42815 282.10200
150.0000 -99.77066 -98.14669 1.62396 1.68068 -98.34264 290.39381
155.0000 -99.90807 -98.02581 1.88226 1.68758 -98.26197 296.79423
160.0000 -99.82709 -98.53805 1.28904 1.69613 -98.16192 303.82155
165.0000 -99.70526 -98.13454 1.57073 1.66534 -98.52212 272.17853
170.0000 -99.80921 -98.37400 1.43522 1.67866 -98.36631 292.96830
175.0000 -99.60820 -97.95959 1.64861 1.68082 -98.34096 288.54360
180.0000 -99.58568 -98.01638 1.56930 1.71370 -97.95641 325.53027
185.0000 -99.83303 -98.15956 1.67348 1.69840 -98.13542 313.74220
190.0000 -99.61532 -98.27495 1.34037 1.69964 -98.12087 309.85659
195.0000 -99.63560 -97.82635 1.80925 1.70562 -98.05096 318.03071
200.0000 -99.64096 -97.49895 2.14201 1.72936 -97.77328 345.19456
205.0000 -99.72013 -98.23807 1.48206 1.70557 -98.05149 315.09102
210.0000 -99.79879 -98.42438 1.37441 1.69492 -98.17614 303.52276
215.0000 -99.99668 -98.49676 1.49992 1.69189 -98.21158 302.08718
220.0000 -99.52871 -97.81750 1.71122 1.70982 -98.00183 321.91700
225.0000 -99.57215 -97.15437 2.41778 1.74038 -97.64443 354.80309
230.0000 -99.72262 -98.10914 1.61348 1.74311 -97.61244 353.41455
235.0000 -99.77887 -98.08528 1.69359 1.69797 -98.14045 309.99259
240.0000 -99.34298 -97.65763 1.68534 1.69918 -98.12629 309.23168
245.0000 -99.61896 -97.72665 1.89231 1.73268 -97.73450 350.00384
250.0000 -99.21529 -97.76208 1.45321 1.72975 -97.76868 341.69818
MELTING PROCESS: loop number 2 T-loop= 340.00000000000000
main_MD> interactions number 2 at Temperature= 340.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.00018 -2.39144 0.04057
force_rgl> df(natom) -2.68307 -0.53787 2.36986
255.0000 -99.38049 -97.40081 1.97968 1.77037 -97.29364 380.76674
260.0000 -99.55576 -97.84856 1.70719 1.74364 -97.60628 357.78142
265.0000 -99.03548 -97.28619 1.74929 1.72766 -97.79313 342.61559
270.0000 -99.13524 -97.54196 1.59328 1.77086 -97.28787 385.06539
275.0000 -99.65351 -97.72502 1.92850 1.71508 -97.94030 326.25244
280.0000 -99.68949 -98.06658 1.62291 1.72024 -97.87992 340.11097
285.0000 -99.51503 -97.91212 1.60291 1.70872 -98.01471 324.52640
290.0000 -99.61206 -97.61942 1.99264 1.71249 -97.97057 327.23721
295.0000 -99.72691 -97.55535 2.17156 1.74545 -97.58513 361.17535
300.0000 -100.10392 -98.06018 2.04374 1.72944 -97.77236 340.69499
305.0000 -99.59483 -97.80792 1.78691 1.71310 -97.96351 332.44943
310.0000 -99.43027 -97.82487 1.60540 1.73332 -97.72694 352.72955
315.0000 -99.58021 -97.77227 1.80795 1.73903 -97.66016 352.33142
320.0000 -99.67043 -97.39150 2.27893 1.74737 -97.56259 342.83812
325.0000 -99.70854 -97.47057 2.23798 1.77067 -97.29011 382.42518
330.0000 -99.33229 -97.57829 1.75400 1.75396 -97.48555 371.80232
335.0000 -99.11742 -97.47352 1.64391 1.73926 -97.65743 359.35503
340.0000 -99.91813 -98.04402 1.87411 1.72262 -97.85216 335.02873
345.0000 -99.68813 -97.97655 1.71158 1.71608 -97.92860 326.32703
350.0000 -99.73122 -98.04666 1.68456 1.71506 -97.94058 324.45546
355.0000 -99.64206 -98.03816 1.60390 1.73455 -97.71258 355.95775
360.0000 -99.76395 -98.22285 1.54110 1.70352 -98.07554 317.76457
365.0000 -99.80316 -98.29252 1.51065 1.70667 -98.03869 318.92826
370.0000 -99.60363 -98.28547 1.31816 1.71039 -97.99516 319.69333
375.0000 -99.39718 -97.92503 1.47215 1.72013 -97.88120 334.26097
380.0000 -99.50274 -97.90298 1.59975 1.71561 -97.93411 324.27205
385.0000 -99.67879 -98.19766 1.48113 1.71751 -97.91188 329.26892
390.0000 -99.24974 -97.36375 1.88599 1.70351 -98.07562 313.53405
395.0000 -99.59449 -97.73080 1.86369 1.74847 -97.54979 362.34411
400.0000 -99.20440 -97.72461 1.47978 1.72924 -97.77468 344.81557
405.0000 -99.91193 -98.29250 1.61942 1.71748 -97.91228 329.89460
410.0000 -99.34589 -97.85842 1.48747 1.71737 -97.91353 328.09981
415.0000 -99.28308 -97.82272 1.46036 1.70875 -98.01430 323.98540
420.0000 -99.55556 -97.90134 1.65423 1.72926 -97.77446 342.53862
425.0000 -99.28915 -97.58878 1.70037 1.75521 -97.47098 367.46921
430.0000 -99.74856 -98.33910 1.40946 1.71082 -97.99018 321.88789
435.0000 -99.69732 -97.81169 1.88563 1.72322 -97.84506 333.99167
440.0000 -99.71139 -97.79185 1.91954 1.69725 -98.14885 309.47972
445.0000 -99.75978 -98.15608 1.60370 1.69165 -98.21439 303.35935
450.0000 -99.56022 -97.60610 1.95412 1.74391 -97.60313 357.99220
455.0000 -99.78039 -98.03178 1.74861 1.72469 -97.82792 338.13338
460.0000 -99.70812 -97.94302 1.76511 1.70954 -98.00509 324.05323
465.0000 -99.24007 -97.78321 1.45685 1.70245 -98.08797 313.06295
470.0000 -100.04180 -98.28963 1.75217 1.72483 -97.82629 342.19413
475.0000 -99.56498 -97.75459 1.81039 1.70126 -98.10192 318.18787
480.0000 -99.55798 -97.91899 1.63900 1.70558 -98.05139 316.57210
485.0000 -99.83061 -98.15566 1.67496 1.70946 -98.00606 318.02178
490.0000 -99.10649 -97.58842 1.51807 1.72561 -97.81714 349.94644
495.0000 -99.98537 -98.69946 1.28591 1.70268 -98.08532 317.87632
500.0000 -99.53042 -97.82567 1.70475 1.67081 -98.45813 279.47103
MELTING PROCESS: loop number 3 T-loop= 365.00000000000000
main_MD> interactions number 3 at Temperature= 365.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.37602 0.01512 -0.53376
force_rgl> df(natom) 0.57259 1.22337 0.40819
505.0000 -99.44330 -97.55049 1.89280 1.75156 -97.51369 363.14883
510.0000 -99.39581 -97.55434 1.84147 1.73161 -97.74701 346.51519
515.0000 -99.01832 -97.25946 1.75887 1.76368 -97.37188 375.67412
520.0000 -99.24835 -97.54620 1.70215 1.76663 -97.33739 385.66305
525.0000 -99.77459 -97.31617 2.45842 1.74228 -97.62215 359.76033
530.0000 -98.91109 -97.16666 1.74443 1.76874 -97.31268 398.22433
535.0000 -99.53203 -97.81306 1.71898 1.74099 -97.63728 356.14497
540.0000 -99.61353 -97.86235 1.75119 1.73873 -97.66374 359.37629
545.0000 -99.36662 -97.28834 2.07828 1.73905 -97.65992 355.43971
550.0000 -99.34471 -97.37866 1.96605 1.76994 -97.29865 388.57708
555.0000 -99.31593 -97.16255 2.15338 1.74851 -97.54929 361.25105
560.0000 -99.64705 -97.78567 1.86138 1.76295 -97.38036 374.99198
565.0000 -99.36301 -97.49978 1.86324 1.74007 -97.64803 355.42974
570.0000 -99.84995 -97.91603 1.93392 1.76807 -97.32054 375.04439
575.0000 -99.81316 -97.86455 1.94862 1.71563 -97.93392 334.88015
580.0000 -99.67300 -97.96252 1.71048 1.71350 -97.95883 330.73456
585.0000 -99.61286 -97.87960 1.73326 1.73175 -97.74533 346.35044
590.0000 -99.42973 -97.24724 2.18249 1.73636 -97.69146 344.85728
595.0000 -99.17565 -96.98854 2.18711 1.76347 -97.37439 385.14644
600.0000 -99.02953 -97.27009 1.75944 1.80265 -96.91609 415.06408
605.0000 -99.52258 -97.58979 1.93278 1.77525 -97.23657 387.48838
610.0000 -99.17079 -97.04097 2.12982 1.75822 -97.43574 377.04081
615.0000 -99.37260 -97.68453 1.68806 1.75410 -97.48387 370.43551
620.0000 -99.67832 -97.77549 1.90283 1.73758 -97.67712 348.49136
625.0000 -99.47730 -97.83718 1.64011 1.72571 -97.81596 339.43699
630.0000 -99.58577 -97.07255 2.51322 1.75295 -97.49736 366.31209
635.0000 -98.97249 -97.29143 1.68105 1.79385 -97.01900 409.11511
640.0000 -99.82491 -97.63838 2.18653 1.75772 -97.44157 371.85285
645.0000 -99.72918 -98.03167 1.69752 1.73520 -97.70503 352.21498
650.0000 -99.42886 -97.39354 2.03533 1.74551 -97.58434 355.55026
655.0000 -99.42061 -97.88521 1.53540 1.77263 -97.26721 389.87235
660.0000 -98.75699 -97.09645 1.66054 1.75131 -97.51659 362.47084
665.0000 -98.53299 -96.85041 1.68258 1.81268 -96.79873 434.14589
670.0000 -99.70564 -97.45033 2.25531 1.77596 -97.22820 394.12311
675.0000 -99.27051 -97.55389 1.71662 1.77771 -97.20781 399.04769
680.0000 -98.95170 -97.07417 1.87753 1.76458 -97.36133 379.03277
685.0000 -99.55894 -96.99022 2.56872 1.78173 -97.16074 399.94611
690.0000 -99.24016 -97.37442 1.86574 1.75030 -97.52838 364.60041
695.0000 -99.47921 -97.11797 2.36124 1.78962 -97.06846 413.32109
700.0000 -98.98699 -96.52568 2.46132 1.80510 -96.88742 405.34257
705.0000 -99.69838 -97.91456 1.78381 1.78900 -97.07570 410.74328
710.0000 -99.94540 -98.23090 1.71450 1.69994 -98.11743 309.56900
715.0000 -99.69035 -97.99240 1.69795 1.70778 -98.02570 322.74437
720.0000 -99.70323 -97.75356 1.94966 1.73078 -97.75668 349.26092
725.0000 -99.62939 -97.50204 2.12735 1.72572 -97.81583 338.51908
730.0000 -99.39069 -97.58570 1.80499 1.72245 -97.85406 336.96576
735.0000 -99.58908 -97.67898 1.91009 1.75581 -97.46394 371.31930
740.0000 -99.60850 -97.23954 2.36896 1.76259 -97.38460 381.24818
745.0000 -99.21727 -97.22890 1.98837 1.76528 -97.35312 380.97951
750.0000 -100.03962 -98.57769 1.46193 1.72422 -97.83338 337.45036
MELTING PROCESS: loop number 4 T-loop= 390.00000000000000
main_MD> interactions number 4 at Temperature= 390.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.78671 -1.02192 -0.49373
force_rgl> df(natom) -0.64907 0.36624 -0.37096
755.0000 -98.64816 -96.81403 1.83413 1.72577 -97.81533 336.39459
760.0000 -98.90345 -96.71847 2.18499 1.81932 -96.72109 431.90217
765.0000 -99.57006 -97.24215 2.32791 1.79958 -96.95201 414.85444
770.0000 -99.17851 -97.31625 1.86227 1.74830 -97.55172 365.67632
775.0000 -99.53966 -97.50638 2.03329 1.75203 -97.50817 367.31822
780.0000 -99.10095 -97.00113 2.09982 1.77175 -97.27743 394.63530
785.0000 -99.08921 -96.66814 2.42107 1.79165 -97.04474 402.51740
790.0000 -98.71702 -96.49828 2.21874 1.83316 -96.55925 446.48618
795.0000 -99.92049 -97.85185 2.06864 1.77988 -97.18237 392.77949
800.0000 -99.68265 -97.48650 2.19615 1.75506 -97.47266 370.89209
805.0000 -99.32473 -97.39776 1.92697 1.76909 -97.30857 380.28411
810.0000 -99.20110 -97.37014 1.83095 1.75279 -97.49923 365.87495
815.0000 -98.94085 -96.77406 2.16679 1.78094 -97.16996 390.27232
820.0000 -99.12455 -97.33868 1.78587 1.79434 -97.01325 409.44520
825.0000 -99.64563 -97.61329 2.03234 1.74464 -97.59453 362.64764
830.0000 -99.30336 -97.24153 2.06183 1.77330 -97.25934 395.88605
835.0000 -98.87332 -96.60669 2.26663 1.81535 -96.76751 436.59184
840.0000 -99.31710 -97.19711 2.12000 1.81492 -96.77260 433.99433
845.0000 -98.72728 -96.92702 1.80026 1.79332 -97.02523 405.05767
850.0000 -99.10226 -97.04853 2.05373 1.81091 -96.81945 431.65520
855.0000 -99.53517 -97.64591 1.88926 1.76365 -97.37222 372.39345
860.0000 -99.27601 -97.36390 1.91211 1.74739 -97.56237 356.50687
865.0000 -99.30886 -97.31595 1.99291 1.76821 -97.31885 387.49782
870.0000 -98.77997 -96.34229 2.43767 1.80776 -96.85630 422.09789
875.0000 -98.91182 -96.65877 2.25305 1.83093 -96.58537 454.20582
880.0000 -99.04918 -96.88688 2.16230 1.81346 -96.78969 421.55712
885.0000 -99.41717 -97.42106 1.99611 1.78877 -97.07837 402.91108
890.0000 -99.44620 -97.44631 1.99989 1.74203 -97.62506 358.87342
895.0000 -99.64421 -97.77179 1.87242 1.74339 -97.60924 360.56417
900.0000 -99.58583 -97.35381 2.23202 1.77553 -97.23323 389.37662
905.0000 -99.67249 -97.26836 2.40413 1.76589 -97.34603 380.15063
910.0000 -99.55672 -97.80410 1.75262 1.76019 -97.41264 379.77760
915.0000 -99.56355 -97.53396 2.02960 1.76755 -97.32658 383.75148
920.0000 -99.38744 -97.36586 2.02158 1.75901 -97.42645 371.84727
925.0000 -98.59049 -96.49126 2.09923 1.79871 -96.96220 405.30267
930.0000 -98.51102 -96.79137 1.71965 1.82191 -96.69085 433.79839
935.0000 -99.40563 -97.45318 1.95244 1.79786 -96.97205 414.31432
940.0000 -99.30139 -97.25419 2.04719 1.78676 -97.10190 398.62271
945.0000 -99.03736 -96.46146 2.57590 1.78579 -97.11325 411.35358
950.0000 -99.23947 -97.65593 1.58353 1.78929 -97.07232 406.42507
955.0000 -99.82984 -97.95075 1.87909 1.72120 -97.86868 335.91217
960.0000 -99.62405 -97.77167 1.85238 1.72904 -97.77698 346.78165
965.0000 -99.56842 -97.88151 1.68691 1.74380 -97.60437 357.73566
970.0000 -99.17702 -97.50871 1.66831 1.72985 -97.76758 344.76329
975.0000 -99.21856 -97.07935 2.13921 1.76285 -97.38156 374.14654
980.0000 -98.87304 -96.76531 2.10773 1.78894 -97.07638 397.39507
985.0000 -99.67477 -97.16986 2.50492 1.76631 -97.34108 378.06395
990.0000 -99.58881 -97.53834 2.05047 1.75908 -97.42565 378.02891
995.0000 -99.67430 -97.55105 2.12325 1.74374 -97.60514 357.66688
1000.0000 -99.55269 -97.63391 1.91878 1.77103 -97.28591 390.43149
MELTING PROCESS: loop number 5 T-loop= 415.00000000000000
main_MD> interactions number 5 at Temperature= 415.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.27742 -2.12536 1.20354
force_rgl> df(natom) 0.69041 0.33313 -1.00919
1005.0000 -98.70242 -96.91461 1.78781 1.77079 -97.28868 384.04702
1010.0000 -98.77826 -96.82336 1.95491 1.82829 -96.61623 442.68596
1015.0000 -99.50463 -97.28961 2.21503 1.78335 -97.14177 402.56769
1020.0000 -99.27733 -96.70985 2.56747 1.77456 -97.24460 398.36884
1025.0000 -99.37724 -97.21374 2.16351 1.82612 -96.64161 447.06956
1030.0000 -99.09908 -97.11192 1.98717 1.79359 -97.02209 417.84356
1035.0000 -98.99756 -96.77536 2.22219 1.80910 -96.84068 428.95744
1040.0000 -99.00231 -97.66525 1.33705 1.77857 -97.19778 397.38829
1045.0000 -98.94237 -96.97163 1.97074 1.79086 -97.05398 402.40116
1050.0000 -99.25061 -97.17744 2.07318 1.74930 -97.54004 368.21092
1055.0000 -99.46721 -97.33761 2.12960 1.78156 -97.16271 408.81380
1060.0000 -99.29514 -96.97568 2.31946 1.78736 -97.09495 403.56841
1065.0000 -99.06097 -96.63219 2.42878 1.80595 -96.87746 420.48597
1070.0000 -99.73182 -97.38638 2.34544 1.79716 -96.98033 415.92166
1075.0000 -98.97711 -97.08344 1.89366 1.76030 -97.41144 373.71678
1080.0000 -99.14956 -96.70368 2.44588 1.79549 -96.99978 406.98186
1085.0000 -98.96341 -96.40245 2.56096 1.83621 -96.52360 452.68468
1090.0000 -99.10689 -96.47862 2.62827 1.83386 -96.55102 456.22751
1095.0000 -99.20353 -97.54898 1.65455 1.79846 -96.96506 415.60200
1100.0000 -98.85177 -97.34051 1.51126 1.75258 -97.50171 366.42724
1105.0000 -99.27971 -97.40083 1.87888 1.77260 -97.26757 391.88800
1110.0000 -99.27561 -97.36335 1.91226 1.77105 -97.28568 384.35630
1115.0000 -99.27864 -97.35312 1.92552 1.76423 -97.36547 381.38152
1120.0000 -98.66854 -96.37991 2.28863 1.80200 -96.92368 421.81207
1125.0000 -99.46611 -97.55862 1.90749 1.79692 -96.98308 420.31805
1130.0000 -99.15202 -97.07625 2.07577 1.79120 -97.05005 399.59144
1135.0000 -99.16348 -97.53424 1.62924 1.77410 -97.25004 384.29240
1140.0000 -98.82038 -97.03251 1.78787 1.78367 -97.13804 403.93792
1145.0000 -98.35028 -96.48774 1.86254 1.80691 -96.86631 415.49719
1150.0000 -99.09348 -96.37982 2.71366 1.86434 -96.19449 483.72731
1155.0000 -99.23023 -96.47628 2.75395 1.82517 -96.65264 438.76401
1160.0000 -99.25644 -97.11792 2.13851 1.82914 -96.60624 450.78067
1165.0000 -99.45139 -97.31556 2.13583 1.78212 -97.15624 400.60964
1170.0000 -98.81473 -96.66169 2.15304 1.78864 -97.07997 406.86962
1175.0000 -99.26527 -97.23105 2.03423 1.80893 -96.84268 430.72418
1180.0000 -98.90336 -96.42252 2.48084 1.80548 -96.88294 423.36615
1185.0000 -98.71898 -96.20242 2.51657 1.84437 -96.42808 474.84908
1190.0000 -98.61864 -96.54148 2.07716 1.84319 -96.44194 462.89155
1195.0000 -98.81688 -96.53655 2.28033 1.83846 -96.49722 438.42034
1200.0000 -99.34049 -97.07939 2.26110 1.81587 -96.76140 421.22589
1205.0000 -99.40968 -97.21844 2.19124 1.77179 -97.27696 387.49443
1210.0000 -99.72355 -97.71532 2.00823 1.76362 -97.37253 379.12269
1215.0000 -99.61814 -97.37723 2.24091 1.73846 -97.66685 354.93251
1220.0000 -99.65959 -97.30170 2.35789 1.76096 -97.40369 379.42611
1225.0000 -99.50021 -97.34833 2.15189 1.76537 -97.35215 382.79023
1230.0000 -98.84364 -96.56100 2.28265 1.79426 -97.01424 411.93898
1235.0000 -98.50637 -96.42843 2.07794 1.82927 -96.60469 394.12655
1240.0000 -99.19962 -96.93835 2.26127 1.83589 -96.52728 437.93732
1245.0000 -98.44768 -96.95420 1.49348 1.83542 -96.53276 453.69514
1250.0000 -99.24542 -97.20064 2.04478 1.77517 -97.23754 387.69217
MELTING PROCESS: loop number 6 T-loop= 440.00000000000000
main_MD> interactions number 6 at Temperature= 440.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.97769 3.43327 -0.45763
force_rgl> df(natom) -0.62108 -2.09696 -1.76883
1255.0000 -98.53175 -96.44906 2.08269 1.81472 -96.77485 430.18625
1260.0000 -99.18565 -97.04054 2.14511 1.81853 -96.73036 443.74096
1265.0000 -98.72482 -96.67894 2.04588 1.81639 -96.75537 440.40443
1270.0000 -98.31154 -95.77003 2.54151 1.86457 -96.19189 475.96904
1275.0000 -98.33875 -95.61639 2.72236 1.89824 -95.79809 501.62078
1280.0000 -98.43547 -95.62261 2.81286 1.93933 -95.31749 548.81776
1285.0000 -98.74245 -96.45384 2.28861 1.88717 -95.92748 482.75020
1290.0000 -99.29031 -97.14627 2.14404 1.82919 -96.60561 445.10939
1295.0000 -98.95820 -96.42660 2.53160 1.82080 -96.70382 435.35875
1300.0000 -99.19616 -96.70131 2.49485 1.83057 -96.58951 429.11238
1305.0000 -99.12860 -97.05994 2.06867 1.78212 -97.15616 401.08051
1310.0000 -99.32274 -97.35688 1.96586 1.78527 -97.11933 394.71147
1315.0000 -98.94607 -97.08038 1.86569 1.77852 -97.19833 391.33962
1320.0000 -99.21435 -97.00691 2.20744 1.77669 -97.21967 391.60133
1325.0000 -99.03631 -97.20637 1.82994 1.78594 -97.11147 402.38638
1330.0000 -99.36158 -96.89939 2.46218 1.79038 -97.05960 407.75490
1335.0000 -99.26241 -97.21265 2.04977 1.79657 -96.98715 408.17670
1340.0000 -99.48712 -97.25647 2.23066 1.78051 -97.17499 398.97153
1345.0000 -99.06076 -96.76567 2.29509 1.83207 -96.57194 442.87429
1350.0000 -98.69350 -96.05626 2.63725 1.84427 -96.42924 456.00256
1355.0000 -99.08011 -96.81314 2.26697 1.83737 -96.50995 458.71188
1360.0000 -99.08617 -96.37832 2.70785 1.82047 -96.70767 427.53569
1365.0000 -98.85690 -95.99162 2.86529 1.87489 -96.07114 476.22353
1370.0000 -99.22625 -96.56444 2.66180 1.87278 -96.09578 483.18179
1375.0000 -98.89974 -96.43061 2.46913 1.86938 -96.13555 471.75557
1380.0000 -98.72031 -96.56788 2.15244 1.83826 -96.49953 450.25806
1385.0000 -98.86675 -96.80957 2.05718 1.80427 -96.89708 412.31039
1390.0000 -98.95095 -97.21020 1.74075 1.80134 -96.93139 411.36527
1395.0000 -98.12537 -95.49358 2.63179 1.85765 -96.27281 471.24003
1400.0000 -99.14037 -97.07611 2.06426 1.83648 -96.52034 449.48559
1405.0000 -99.58806 -96.98302 2.60505 1.80962 -96.83451 436.38613
1410.0000 -99.02443 -96.73993 2.28450 1.83221 -96.57038 435.74269
1415.0000 -98.84028 -96.73361 2.10667 1.78189 -97.15890 401.88473
1420.0000 -98.80608 -96.22910 2.57698 1.84584 -96.41098 449.38937
1425.0000 -98.66136 -96.59537 2.06600 1.85994 -96.24605 474.79737
1430.0000 -98.41439 -96.57123 1.84316 1.84989 -96.36359 471.31569
1435.0000 -98.51531 -96.17503 2.34028 1.84578 -96.41168 464.93664
1440.0000 -98.84453 -96.46839 2.37613 1.84662 -96.40177 451.36856
1445.0000 -98.98877 -96.24635 2.74241 1.81543 -96.76663 426.11520
1450.0000 -98.42381 -95.87799 2.54582 1.87513 -96.06835 480.46910
1455.0000 -98.82004 -95.69936 3.12068 1.87463 -96.07419 481.32705
1460.0000 -98.74740 -96.38094 2.36645 1.86919 -96.13787 480.49334
1465.0000 -98.17404 -96.00522 2.16882 1.85011 -96.36101 471.32744
1470.0000 -98.91976 -96.85158 2.06818 1.83856 -96.49602 454.06359
1475.0000 -99.11093 -97.07076 2.04017 1.82207 -96.68893 435.75372
1480.0000 -99.50472 -96.84311 2.66161 1.81944 -96.71969 431.22524
1485.0000 -99.12401 -97.03070 2.09332 1.80346 -96.90662 421.38453
1490.0000 -99.18601 -97.13972 2.04629 1.78465 -97.12662 394.20381
1495.0000 -99.03641 -96.84832 2.18808 1.79460 -97.01026 415.89116
1500.0000 -99.30815 -97.43036 1.87779 1.78859 -97.08057 399.82651
MELTING PROCESS: loop number 7 T-loop= 465.00000000000000
main_MD> interactions number 7 at Temperature= 465.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.66883 -1.27382 -2.74309
force_rgl> df(natom) 0.88150 -0.17362 1.68886
1505.0000 -98.56817 -96.50497 2.06319 1.80996 -96.83054 421.76789
1510.0000 -98.13070 -95.48489 2.64581 1.85690 -96.28153 466.23213
1515.0000 -98.71100 -96.38872 2.32229 1.89394 -95.84833 480.11926
1520.0000 -98.59583 -96.22097 2.37487 1.85118 -96.34847 468.48627
1525.0000 -98.52952 -96.16250 2.36702 1.85816 -96.26686 462.01097
1530.0000 -98.87600 -96.48510 2.39091 1.84950 -96.36817 450.65065
1535.0000 -98.87523 -96.21136 2.66387 1.85374 -96.31857 468.18093
1540.0000 -98.23097 -95.83665 2.39432 1.88925 -95.90320 471.40832
1545.0000 -97.52456 -94.75443 2.77013 1.94437 -95.25852 538.78130
1550.0000 -98.23962 -95.64507 2.59455 1.94007 -95.30882 508.57917
1555.0000 -98.43667 -96.04682 2.38985 1.89867 -95.79304 451.51338
1560.0000 -97.78868 -95.78852 2.00016 1.90175 -95.75702 474.04689
1565.0000 -98.05072 -95.81062 2.24010 1.89801 -95.80078 448.85489
1570.0000 -98.20149 -95.78029 2.42120 1.89663 -95.81693 448.85668
1575.0000 -97.87979 -95.74631 2.13348 1.91071 -95.65215 452.71356
1580.0000 -97.98930 -95.63433 2.35497 1.92068 -95.53554 452.43548
1585.0000 -98.08753 -95.78407 2.30347 1.90247 -95.74858 435.61190
1590.0000 -97.85034 -95.85280 1.99754 1.90235 -95.74994 449.46249
1595.0000 -97.87786 -96.12062 1.75725 1.88446 -95.95917 448.43242
1600.0000 -98.19144 -96.20163 1.98981 1.86905 -96.13950 434.36032
1605.0000 -98.72811 -96.18161 2.54650 1.87823 -96.03206 465.82230
1610.0000 -97.91389 -95.72090 2.19299 1.90306 -95.74165 464.31023
1615.0000 -98.18512 -95.92313 2.26200 1.88859 -95.91096 446.34339
1620.0000 -98.73722 -96.23007 2.50716 1.88422 -95.96198 456.11726
1625.0000 -98.81171 -96.06884 2.74288 1.86663 -96.16781 450.54483
1630.0000 -98.46972 -96.25063 2.21908 1.88219 -95.98580 455.57007
1635.0000 -98.44934 -96.47525 1.97409 1.83121 -96.58200 401.99641
1640.0000 -97.96931 -95.23685 2.73246 1.88058 -96.00461 451.24718
1645.0000 -97.84389 -95.37866 2.46524 1.93409 -95.37878 491.13370
1650.0000 -97.89698 -95.51512 2.38185 1.94230 -95.28276 492.75259
1655.0000 -98.17969 -95.21842 2.96126 1.94970 -95.19615 489.97815
1660.0000 -97.82532 -94.91036 2.91495 1.97382 -94.91404 522.14443
1665.0000 -97.22715 -95.06335 2.16380 1.94019 -95.30736 479.12932
1670.0000 -96.87218 -94.12024 2.75194 2.02349 -94.33307 533.56747
1675.0000 -97.89872 -95.02296 2.87576 2.02481 -94.31765 567.23769
1680.0000 -97.80119 -95.18878 2.61241 1.97236 -94.93116 522.56449
1685.0000 -97.67940 -95.74284 1.93657 1.94899 -95.20444 509.56095
1690.0000 -97.96926 -95.80110 2.16816 1.92497 -95.48539 475.88494
1695.0000 -98.25606 -95.43564 2.82042 1.91685 -95.58044 472.35846
1700.0000 -98.28473 -95.97949 2.30524 1.90275 -95.74534 467.09466
1705.0000 -97.47000 -95.38234 2.08766 1.88857 -95.91118 447.92908
1710.0000 -97.86719 -95.76373 2.10345 1.96038 -95.07122 532.05645
1715.0000 -98.69906 -95.95783 2.74123 1.90085 -95.76756 468.31755
1720.0000 -98.22010 -95.47223 2.74787 1.88749 -95.92381 455.58697
1725.0000 -98.26244 -95.89611 2.36633 1.91682 -95.58069 488.35925
1730.0000 -97.93293 -95.48750 2.44543 1.88725 -95.92661 449.25532
1735.0000 -98.36332 -95.57294 2.79038 1.91301 -95.62528 483.91911
1740.0000 -97.89887 -95.12099 2.77788 1.94363 -95.26717 511.95061
1745.0000 -98.35664 -95.45818 2.89846 1.93708 -95.34380 516.55430
1750.0000 -98.00304 -95.85386 2.14917 1.88787 -95.91933 460.08580
MELTING PROCESS: loop number 8 T-loop= 490.00000000000000
main_MD> interactions number 8 at Temperature= 490.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.51864 -4.28318 3.89664
force_rgl> df(natom) -2.76532 0.08677 -0.08927
1755.0000 -98.39460 -95.88590 2.50870 1.89659 -95.81736 488.40440
1760.0000 -98.57216 -96.20493 2.36723 1.88306 -95.97558 477.97067
1765.0000 -98.91756 -96.72510 2.19246 1.80017 -96.94507 402.02128
1770.0000 -99.04884 -96.65507 2.39377 1.83294 -96.56184 439.81500
1775.0000 -98.70045 -96.59997 2.10048 1.81968 -96.71690 414.83215
1780.0000 -98.40468 -95.54788 2.85680 1.86330 -96.20668 462.83329
1785.0000 -98.81187 -95.97627 2.83560 1.91455 -95.60725 502.96891
1790.0000 -98.27909 -95.66303 2.61606 1.89242 -95.86609 488.20551
1795.0000 -97.87774 -95.06500 2.81274 1.93963 -95.31390 522.61655
1800.0000 -98.32693 -95.38884 2.93809 1.92617 -95.47136 503.45461
1805.0000 -98.76017 -95.66015 3.10002 1.92017 -95.54156 495.92409
1810.0000 -97.96321 -95.31001 2.65320 1.92030 -95.54008 516.49206
1815.0000 -98.35914 -95.61962 2.73952 1.91889 -95.55650 507.10920
1820.0000 -97.88524 -95.45422 2.43102 1.93358 -95.38466 499.52199
1825.0000 -98.10960 -96.10628 2.00332 1.89958 -95.78237 485.30868
1830.0000 -98.40441 -95.97066 2.43375 1.89559 -95.82907 470.56757
1835.0000 -97.99065 -95.24254 2.74811 1.87700 -96.04647 477.56051
1840.0000 -98.71951 -95.72253 2.99698 1.92378 -95.49929 524.74552
1845.0000 -98.05468 -95.49845 2.55623 1.91846 -95.56161 479.21592
1850.0000 -97.37693 -95.51539 1.86155 1.90451 -95.72477 476.13802
1855.0000 -97.80612 -95.51617 2.28995 1.92491 -95.48607 491.25998
1860.0000 -97.69256 -95.16744 2.52512 1.92632 -95.46958 479.49240
1865.0000 -98.16234 -95.84297 2.31936 1.91875 -95.55813 495.39854
1870.0000 -98.32425 -95.47542 2.84884 1.91725 -95.57568 483.92980
1875.0000 -98.90770 -96.22123 2.68647 1.88846 -95.91247 478.11566
1880.0000 -98.91544 -96.45610 2.45935 1.84611 -96.40780 464.93405
1885.0000 -99.44505 -97.52480 1.92025 1.82671 -96.63470 431.19255
1890.0000 -99.29575 -96.56103 2.73472 1.80218 -96.92161 416.86710
1895.0000 -98.79617 -96.78081 2.01535 1.79986 -96.94872 409.71201
1900.0000 -98.65950 -96.12029 2.53921 1.84013 -96.47767 456.13038
1905.0000 -99.35505 -97.19732 2.15773 1.83398 -96.54961 450.96418
1910.0000 -98.69253 -96.29984 2.39268 1.82521 -96.65225 438.31107
1915.0000 -98.94839 -96.76101 2.18738 1.84125 -96.46462 453.82421
1920.0000 -98.90849 -96.93874 1.96975 1.79791 -96.97149 414.63872
1925.0000 -98.59947 -96.65682 1.94265 1.82822 -96.61705 454.16613
1930.0000 -98.79952 -96.21922 2.58029 1.81185 -96.80849 427.93347
1935.0000 -98.41499 -95.69575 2.71925 1.88822 -95.91525 517.86529
1940.0000 -98.21033 -95.50873 2.70160 1.90379 -95.73314 473.80572
1945.0000 -98.60866 -96.44091 2.16775 1.85037 -96.35795 463.33332
1950.0000 -98.94318 -96.79601 2.14717 1.86454 -96.19219 483.90627
1955.0000 -99.30086 -96.83897 2.46188 1.84589 -96.41029 470.38383
1960.0000 -99.20355 -96.72973 2.47382 1.78095 -97.16992 396.64151
1965.0000 -98.71367 -96.59016 2.12351 1.83106 -96.58380 441.76741
1970.0000 -99.08010 -96.42308 2.65702 1.86452 -96.19246 481.67455
1975.0000 -98.45779 -95.55688 2.90090 1.87188 -96.10632 496.02830
1980.0000 -98.29545 -95.85244 2.44301 1.88496 -95.95336 497.75765
1985.0000 -98.02982 -95.79563 2.23419 1.88435 -95.96046 475.73326
1990.0000 -98.64910 -95.86777 2.78133 1.90988 -95.66192 504.33685
1995.0000 -98.03315 -95.45319 2.57996 1.96476 -95.01999 549.37920
2000.0000 -98.50087 -95.94086 2.56001 1.90059 -95.77060 512.47698
MELTING PROCESS: loop number 9 T-loop= 515.00000000000000
main_MD> interactions number 9 at Temperature= 515.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 3.06416 2.75062 0.68743
force_rgl> df(natom) 1.55819 0.43930 0.78204
2005.0000 -97.67895 -95.24721 2.43174 1.89702 -95.81229 514.03101
2010.0000 -98.54531 -96.09947 2.44584 1.90362 -95.73512 505.16938
2015.0000 -98.15023 -95.16249 2.98774 1.89750 -95.80667 512.77953
2020.0000 -98.48126 -96.16732 2.31394 1.91968 -95.54726 504.68696
2025.0000 -97.69748 -94.96824 2.72924 1.94140 -95.29330 500.24108
2030.0000 -97.52841 -94.59071 2.93771 1.96391 -95.02998 520.41395
2035.0000 -97.63177 -94.88213 2.74964 1.96915 -94.96868 517.72141
2040.0000 -97.36020 -94.98047 2.37972 1.95521 -95.13174 485.81001
2045.0000 -97.90372 -95.25752 2.64621 1.92446 -95.49139 483.71114
2050.0000 -97.29653 -94.99623 2.30030 1.96937 -94.96610 514.37101
2055.0000 -98.34086 -95.13949 3.20137 1.95538 -95.12969 509.10386
2060.0000 -98.16203 -95.67362 2.48840 1.93529 -95.36475 491.04404
2065.0000 -97.87105 -94.69298 3.17807 1.95588 -95.12393 510.32899
2070.0000 -97.36017 -94.67960 2.68056 1.99869 -94.62320 547.97339
2075.0000 -97.45722 -94.43817 3.01905 2.00143 -94.59114 547.21978
2080.0000 -97.67331 -95.12243 2.55088 1.96613 -95.00396 522.79719
2085.0000 -98.16795 -95.64169 2.52626 1.94492 -95.25207 493.38452
2090.0000 -98.01023 -95.27739 2.73285 1.93503 -95.36772 510.90727
2095.0000 -98.49036 -96.12499 2.36537 1.90615 -95.70548 481.39075
2100.0000 -98.27965 -95.00108 3.27857 1.93047 -95.42109 516.67811
2105.0000 -97.36659 -94.11141 3.25518 1.99294 -94.69045 561.12033
2110.0000 -97.54986 -94.45489 3.09498 2.03885 -94.15342 604.01303
2115.0000 -97.43694 -94.92305 2.51389 2.00871 -94.50600 559.47931
2120.0000 -98.19682 -95.55901 2.63781 1.94569 -95.24309 482.96855
2125.0000 -97.60154 -95.04032 2.56122 1.96374 -95.03199 513.40270
2130.0000 -97.53963 -94.92444 2.61519 1.96442 -95.02402 516.13272
2135.0000 -97.69857 -94.49021 3.20836 2.00666 -94.52998 529.63946
2140.0000 -97.35023 -94.69791 2.65232 1.99878 -94.62213 558.13952
2145.0000 -98.05027 -95.04356 3.00671 1.97821 -94.86277 537.41970
2150.0000 -98.10093 -95.65781 2.44312 1.91247 -95.63160 460.88253
2155.0000 -98.00525 -95.41586 2.58939 1.92308 -95.50749 453.70279
2160.0000 -97.91078 -95.20723 2.70356 1.91631 -95.58674 470.64561
2165.0000 -98.61614 -96.33429 2.28185 1.87766 -96.03878 463.19993
2170.0000 -98.26180 -95.73810 2.52370 1.89040 -95.88975 452.02158
2175.0000 -98.19889 -95.39708 2.80182 1.93463 -95.37238 506.43912
2180.0000 -98.47975 -96.29696 2.18279 1.92442 -95.49183 504.36293
2185.0000 -98.14874 -95.42290 2.72585 1.90738 -95.69113 479.06095
2190.0000 -97.76153 -94.80859 2.95294 1.94710 -95.22660 526.52363
2195.0000 -97.33708 -94.69142 2.64565 1.97482 -94.90242 542.06987
2200.0000 -97.98752 -95.41100 2.57652 1.95292 -95.15851 504.56826
2205.0000 -97.05614 -94.15765 2.89849 1.97677 -94.87952 560.25635
2210.0000 -97.56271 -94.08941 3.47331 1.99196 -94.70189 532.98062
2215.0000 -97.06271 -94.24695 2.81577 2.08028 -93.66893 634.64376
2220.0000 -97.61042 -94.65777 2.95265 2.02286 -94.34054 595.09789
2225.0000 -97.42355 -94.02981 3.39373 2.01014 -94.48922 581.42085
2230.0000 -97.99670 -95.25570 2.74099 1.95296 -95.15806 520.98358
2235.0000 -98.13134 -95.56373 2.56761 1.93880 -95.32367 519.18224
2240.0000 -97.00938 -94.90417 2.10521 1.92175 -95.52308 488.82296
2245.0000 -97.81631 -95.57079 2.24552 1.96354 -95.03431 524.26686
2250.0000 -98.51387 -95.27440 3.23947 1.92607 -95.47255 512.89765
MELTING PROCESS: loop number 10 T-loop= 540.00000000000000
main_MD> interactions number 10 at Temperature= 540.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 3.76894 4.20894 -0.63592
force_rgl> df(natom) -3.75236 -1.03120 -1.81553
2255.0000 -98.13665 -95.61878 2.51788 1.88821 -95.91537 475.88619
2260.0000 -98.01744 -95.26933 2.74811 1.91810 -95.56581 493.65790
2265.0000 -98.42242 -95.69232 2.73009 1.94231 -95.28260 534.49362
2270.0000 -97.68449 -94.23875 3.44574 1.96092 -95.06498 555.64113
2275.0000 -96.94440 -93.28857 3.65582 2.11803 -93.22736 697.13109
2280.0000 -96.91193 -92.79859 4.11334 2.13044 -93.08226 663.91589
2285.0000 -96.90527 -93.91256 2.99272 2.09044 -93.55009 612.81983
2290.0000 -96.99196 -93.73997 3.25199 2.06381 -93.86156 589.47572
2295.0000 -97.38320 -94.47920 2.90400 2.00136 -94.59198 578.33636
2300.0000 -97.54184 -94.18695 3.35489 2.03567 -94.19066 592.62572
2305.0000 -97.52368 -94.28111 3.24257 2.05038 -94.01859 591.79327
2310.0000 -97.58537 -94.56727 3.01810 2.00186 -94.58607 554.50372
2315.0000 -96.81427 -93.90418 2.91008 2.04181 -94.11887 592.93658
2320.0000 -97.63436 -94.84922 2.78514 2.00055 -94.60145 583.64201
2325.0000 -98.99136 -95.45306 3.53830 1.96849 -94.97635 566.44645
2330.0000 -98.71185 -95.52639 3.18546 1.94532 -95.24743 569.05024
2335.0000 -98.54808 -96.06205 2.48603 1.84603 -96.40868 461.16554
2340.0000 -97.35011 -94.53898 2.81113 1.97297 -94.92404 575.71263
2345.0000 -97.99176 -94.93629 3.05547 2.00122 -94.59363 572.69376
2350.0000 -97.25610 -94.84673 2.40937 1.98328 -94.80344 566.06153
2355.0000 -98.04064 -95.30823 2.73240 1.94443 -95.25783 538.65758
2360.0000 -97.63044 -94.78381 2.84663 1.95771 -95.10245 527.53242
2365.0000 -98.08789 -95.54740 2.54049 1.96911 -94.96910 570.18335
2370.0000 -98.15974 -95.27727 2.88248 1.93343 -95.38642 511.25674
2375.0000 -97.97523 -95.51954 2.45568 1.93166 -95.40714 508.98282
2380.0000 -98.13893 -95.04808 3.09085 1.91892 -95.55617 509.38696
2385.0000 -97.98322 -95.12875 2.85447 1.94188 -95.28758 522.47011
2390.0000 -97.03536 -93.44611 3.58924 2.04904 -94.03428 601.94657
2395.0000 -96.83064 -93.89456 2.93609 2.04262 -94.10933 539.09455
2400.0000 -96.93321 -93.87381 3.05940 2.03699 -94.17526 545.02082
2405.0000 -97.03833 -94.63757 2.40076 2.04902 -94.03447 562.42958
2410.0000 -97.48581 -95.48180 2.00401 1.96126 -95.06093 514.67965
2415.0000 -97.27313 -94.36622 2.90691 1.96847 -94.97658 525.00227
2420.0000 -98.18564 -95.44775 2.73789 1.96735 -94.98969 514.42832
2425.0000 -97.56254 -94.50099 3.06155 1.99871 -94.62289 568.36820
2430.0000 -98.00774 -95.23135 2.77638 1.97078 -94.94963 537.67684
2435.0000 -97.57094 -95.31009 2.26086 1.94037 -95.30530 514.90374
2440.0000 -97.65910 -94.72071 2.93839 1.97465 -94.90438 542.51705
2445.0000 -97.67186 -94.53816 3.13370 2.00150 -94.59031 577.49171
2450.0000 -97.49675 -94.78876 2.70798 1.98188 -94.81983 533.13344
2455.0000 -96.62110 -94.14922 2.47188 2.04132 -94.12454 590.27429
2460.0000 -97.24870 -94.39922 2.84948 2.01855 -94.39089 548.74575
2465.0000 -97.43600 -93.63298 3.80302 2.00684 -94.52784 564.44142
2470.0000 -97.22141 -93.92262 3.29879 2.05299 -93.98807 588.91994
2475.0000 -98.14743 -94.81809 3.32934 2.03292 -94.22286 585.69084
2480.0000 -97.82668 -95.21244 2.61424 2.02167 -94.35437 558.98428
2485.0000 -97.20413 -95.16472 2.03941 1.94827 -95.21293 441.91600
2490.0000 -96.93879 -93.92209 3.01669 2.03343 -94.21686 573.29236
2495.0000 -96.83013 -93.56082 3.26931 2.03724 -94.17234 577.50563
2500.0000 -97.59293 -94.01801 3.57492 2.06224 -93.87989 616.14795
MELTING PROCESS: loop number 11 T-loop= 565.00000000000000
main_MD> interactions number 11 at Temperature= 565.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 4.14295 1.13643 -2.29138
force_rgl> df(natom) -0.81066 -2.57528 0.68422
2505.0000 -97.64239 -94.92691 2.71548 2.03442 -94.20528 581.08693
2510.0000 -96.79362 -93.81511 2.97852 2.00051 -94.60188 570.23674
2515.0000 -97.21946 -94.47668 2.74279 2.01493 -94.43323 571.20207
2520.0000 -97.43897 -94.55257 2.88640 1.99409 -94.67698 547.35147
2525.0000 -97.02834 -93.87334 3.15500 2.01600 -94.42075 575.01136
2530.0000 -97.11986 -93.85167 3.26819 2.07557 -93.72398 615.21893
2535.0000 -97.98466 -95.16890 2.81576 2.01084 -94.48108 554.90668
2540.0000 -97.82327 -94.98992 2.83336 1.97093 -94.94784 529.28131
2545.0000 -98.16215 -95.30711 2.85504 1.93034 -95.42257 496.08475
2550.0000 -97.52785 -94.17376 3.35409 1.97265 -94.92779 555.62546
2555.0000 -96.66031 -93.72835 2.93196 2.03627 -94.18362 585.10608
2560.0000 -96.38393 -93.59497 2.78896 2.06516 -93.84576 597.61760
2565.0000 -97.01061 -94.01013 3.00048 2.06788 -93.81394 594.69738
2570.0000 -97.54604 -94.67027 2.87577 2.05459 -93.96939 604.13827
2575.0000 -97.15535 -94.99643 2.15892 1.99761 -94.63579 544.51595
2580.0000 -97.41406 -94.74488 2.66918 1.99503 -94.66595 551.50561
2585.0000 -96.96891 -93.81679 3.15212 2.03195 -94.23412 573.52207
2590.0000 -97.48912 -94.25690 3.23222 2.04643 -94.06476 587.98652
2595.0000 -97.65591 -94.43614 3.21977 1.99975 -94.61077 576.93006
2600.0000 -98.23601 -95.60689 2.62913 1.97563 -94.89295 544.57939
2605.0000 -97.82279 -94.75679 3.06600 1.92543 -95.48009 478.27543
2610.0000 -97.27103 -93.87814 3.39289 2.03050 -94.25115 581.08461
2615.0000 -96.98710 -94.14656 2.84053 2.05282 -93.99011 588.09189
2620.0000 -97.58921 -94.85492 2.73429 2.03355 -94.21549 587.95857
2625.0000 -97.37404 -94.59198 2.78205 1.99312 -94.68827 548.52900
2630.0000 -97.63336 -94.45082 3.18254 1.99223 -94.69868 550.06304
2635.0000 -98.16156 -95.93498 2.22658 1.94856 -95.20946 515.96370
2640.0000 -97.57263 -95.11840 2.45423 1.92917 -95.43627 471.21874
2645.0000 -97.76099 -94.32826 3.43273 1.98515 -94.78157 529.32178
2650.0000 -97.50333 -94.50341 2.99992 2.01654 -94.41439 572.59886
2655.0000 -97.06643 -94.52882 2.53761 1.99068 -94.71689 553.92733
2660.0000 -97.31023 -94.88404 2.42619 2.01491 -94.43344 549.32904
2665.0000 -97.22173 -94.17649 3.04524 2.00746 -94.52064 569.58334
2670.0000 -96.14628 -93.77666 2.36963 2.04490 -94.08269 572.40427
2675.0000 -96.64548 -93.64460 3.00088 2.01755 -94.40261 563.70461
2680.0000 -96.68200 -93.70339 2.97861 2.05671 -93.94463 597.44547
2685.0000 -98.05612 -95.37014 2.68598 2.00022 -94.60529 535.10119
2690.0000 -97.71904 -95.23202 2.48702 1.93908 -95.32041 504.29208
2695.0000 -97.24070 -94.30059 2.94011 1.99027 -94.72171 545.94291
2700.0000 -97.39003 -94.28927 3.10076 2.04650 -94.06396 575.17332
2705.0000 -96.70112 -93.80004 2.90108 2.06740 -93.81951 591.63326
2710.0000 -97.32927 -94.35677 2.97250 2.03706 -94.17437 583.26895
2715.0000 -97.52790 -94.48006 3.04784 1.98920 -94.73417 570.12260
2720.0000 -98.17218 -95.95726 2.21492 1.95591 -95.12352 528.00669
2725.0000 -98.19475 -95.08961 3.10514 1.95288 -95.15902 504.51091
2730.0000 -97.18298 -94.88067 2.30231 2.00267 -94.57662 561.98834
2735.0000 -97.12141 -93.88749 3.23392 1.98209 -94.81732 550.20676
2740.0000 -96.52560 -94.12194 2.40366 2.06556 -93.84111 594.69753
2745.0000 -96.12606 -93.21187 2.91419 2.10286 -93.40478 637.24131
2750.0000 -97.19858 -93.83442 3.36416 2.08957 -93.56021 640.40626
MELTING PROCESS: loop number 12 T-loop= 590.00000000000000
main_MD> interactions number 12 at Temperature= 590.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.03577 -0.99507 0.14765
force_rgl> df(natom) -0.15659 1.61191 0.85548
2755.0000 -97.64979 -94.39568 3.25411 2.01655 -94.41426 579.55645
2760.0000 -97.47271 -93.91157 3.56114 2.02636 -94.29958 582.97693
2765.0000 -97.68398 -94.71599 2.96799 2.02022 -94.37136 586.87168
2770.0000 -97.96122 -95.38105 2.58018 1.96937 -94.96606 523.14907
2775.0000 -98.26424 -95.55282 2.71142 1.94595 -95.24005 528.51762
2780.0000 -97.29989 -94.31906 2.98083 1.98622 -94.76903 542.28609
2785.0000 -96.47382 -92.71594 3.75788 2.08605 -93.60146 623.21156
2790.0000 -96.64525 -93.11961 3.52564 2.15786 -92.76150 690.84339
2795.0000 -96.13954 -93.36243 2.77711 2.12310 -93.16810 642.36743
2800.0000 -96.13602 -92.69144 3.44458 2.10271 -93.40659 609.17736
2805.0000 -95.64839 -92.29608 3.35231 2.15822 -92.75733 701.56099
2810.0000 -96.74168 -94.07568 2.66600 2.14104 -92.95828 660.51563
2815.0000 -96.91911 -94.43032 2.48878 2.03802 -94.16313 580.22322
2820.0000 -97.05065 -93.57234 3.47831 2.09156 -93.53697 625.67266
2825.0000 -97.23862 -94.38214 2.85648 2.04868 -94.03851 596.83576
2830.0000 -97.41494 -94.55108 2.86386 2.03812 -94.16199 594.39125
2835.0000 -97.92717 -94.40296 3.52421 1.98169 -94.82201 529.21641
2840.0000 -97.15562 -93.82692 3.32870 2.02029 -94.37053 557.27533
2845.0000 -96.64792 -93.21831 3.42961 2.11343 -93.28112 659.12603
2850.0000 -95.72228 -92.57197 3.15031 2.12073 -93.19577 660.43659
2855.0000 -96.58142 -93.29880 3.28262 2.12240 -93.17622 668.71006
2860.0000 -96.87235 -93.49651 3.37584 2.10521 -93.37729 636.14843
2865.0000 -97.86534 -94.66737 3.19798 2.03446 -94.20487 574.27805
2870.0000 -97.72018 -94.87349 2.84669 1.98723 -94.75726 570.99157
2875.0000 -97.98851 -94.73824 3.25026 1.95474 -95.13717 537.39925
2880.0000 -97.75571 -94.14235 3.61336 2.02076 -94.36500 591.76326
2885.0000 -97.38259 -94.01439 3.36820 2.08659 -93.59513 655.24183
2890.0000 -96.90982 -93.74303 3.16680 2.09693 -93.47418 624.03133
2895.0000 -97.57098 -94.28981 3.28117 2.07185 -93.76749 656.81711
2900.0000 -96.63066 -93.46895 3.16170 2.04381 -94.09548 621.49507
2905.0000 -97.38248 -94.64862 2.73386 2.04970 -94.02661 601.71856
2910.0000 -97.16361 -94.82706 2.33655 2.01837 -94.39296 593.08963
2915.0000 -97.13710 -93.55795 3.57915 2.04148 -94.12269 589.63448
2920.0000 -96.65393 -94.00186 2.65207 2.05792 -93.93045 600.04380
2925.0000 -95.91658 -93.24182 2.67476 2.09336 -93.51589 614.99062
2930.0000 -96.52561 -93.35480 3.17081 2.11029 -93.31790 653.65400
2935.0000 -97.15338 -94.06927 3.08412 2.07559 -93.72376 603.84792
2940.0000 -96.25908 -93.26109 2.99800 2.12009 -93.20324 642.62767
2945.0000 -97.61129 -94.99416 2.61712 2.03100 -94.24531 547.29153
2950.0000 -97.65583 -94.77252 2.88331 1.99023 -94.72215 564.04039
2955.0000 -97.83646 -95.23973 2.59673 1.98177 -94.82112 558.96414
2960.0000 -97.47132 -95.05367 2.41765 1.96590 -95.00671 531.60069
2965.0000 -97.80169 -95.31172 2.48997 1.97152 -94.94101 525.83845
2970.0000 -96.88106 -93.20275 3.67831 2.00794 -94.51499 581.01984
2975.0000 -96.89592 -93.79616 3.09976 2.03946 -94.14632 593.73204
2980.0000 -96.69836 -93.90850 2.78986 2.03754 -94.16874 573.37479
2985.0000 -97.36368 -94.11783 3.24585 2.07935 -93.67977 622.17037
2990.0000 -96.98221 -94.68784 2.29438 2.03682 -94.17718 555.40554
2995.0000 -97.21124 -94.68365 2.52758 2.03053 -94.25079 598.42347
3000.0000 -97.61546 -94.30007 3.31538 2.01414 -94.44244 552.82090
MELTING PROCESS: loop number 13 T-loop= 615.00000000000000
main_MD> interactions number 13 at Temperature= 615.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.62863 3.45817 3.06458
force_rgl> df(natom) -0.33700 4.15982 0.13817
3005.0000 -97.38544 -94.52030 2.86515 2.02472 -94.31871 581.11545
3010.0000 -97.39070 -93.46378 3.92692 1.99908 -94.61860 554.82179
3015.0000 -97.62955 -93.54070 4.08885 2.09180 -93.53422 665.47959
3020.0000 -97.61046 -94.11963 3.49083 2.05453 -93.97011 612.33306
3025.0000 -96.93950 -92.62772 4.31177 2.10805 -93.34405 677.01054
3030.0000 -96.29835 -92.89568 3.40267 2.11108 -93.30869 636.56908
3035.0000 -95.82485 -92.16873 3.65612 2.16617 -92.66437 695.41815
3040.0000 -95.34752 -91.90977 3.43774 2.24151 -91.78315 734.56312
3045.0000 -96.76449 -93.52970 3.23480 2.20704 -92.18625 714.11587
3050.0000 -97.35124 -94.59466 2.75658 2.05797 -93.92983 589.72087
3055.0000 -97.29571 -93.91428 3.38143 2.03067 -94.24913 593.35626
3060.0000 -97.07809 -93.65429 3.42379 2.07106 -93.77674 625.27894
3065.0000 -96.97909 -94.25975 2.71934 2.03407 -94.20933 587.93583
3070.0000 -96.90474 -93.55761 3.34713 2.06245 -93.87743 623.86801
3075.0000 -97.47845 -94.37925 3.09919 2.05286 -93.98955 622.17551
3080.0000 -96.13215 -93.31062 2.82153 2.10264 -93.40737 618.70259
3085.0000 -96.99699 -94.12961 2.86738 2.05804 -93.92902 605.24825
3090.0000 -96.30478 -93.97794 2.32684 2.05309 -93.98695 576.40478
3095.0000 -97.28910 -94.49698 2.79212 2.04265 -94.10908 581.44453
3100.0000 -97.85064 -95.37406 2.47657 1.95766 -95.10306 514.88232
3105.0000 -97.56995 -93.76699 3.80296 1.99056 -94.71831 561.89951
3110.0000 -97.36145 -93.52773 3.83372 2.11402 -93.27426 659.13379
3115.0000 -97.48095 -94.32146 3.15949 2.11328 -93.28287 675.97218
3120.0000 -96.88354 -93.53906 3.34449 2.07190 -93.76696 624.15919
3125.0000 -96.81692 -93.49718 3.31974 2.09789 -93.46293 659.99752
3130.0000 -97.02322 -93.45961 3.56361 2.10959 -93.32613 660.78683
3135.0000 -97.28390 -94.17553 3.10838 2.02008 -94.37305 585.65277
3140.0000 -97.28327 -94.67718 2.60609 2.00698 -94.52621 554.35406
3145.0000 -96.29355 -93.41912 2.87443 2.04445 -94.08801 607.16803
3150.0000 -96.84936 -93.59245 3.25692 2.10204 -93.41434 609.78305
3155.0000 -96.99578 -94.18542 2.81035 2.11287 -93.28775 666.51241
3160.0000 -96.33100 -93.62066 2.71034 2.03545 -94.19320 575.60335
3165.0000 -96.77574 -93.22825 3.54748 2.07482 -93.73272 616.63383
3170.0000 -96.53732 -93.28863 3.24870 2.11000 -93.32135 659.81579
3175.0000 -96.69972 -94.31729 2.38243 2.08871 -93.57027 582.73973
3180.0000 -97.04585 -93.85729 3.18855 2.03982 -94.14215 555.14774
3185.0000 -97.20148 -94.35806 2.84342 2.03645 -94.18155 547.12030
3190.0000 -96.75526 -93.42989 3.32537 2.07895 -93.68451 571.08705
3195.0000 -97.47368 -94.50010 2.97358 2.07311 -93.75277 591.52170
3200.0000 -97.38693 -94.53306 2.85387 2.02734 -94.28813 582.45348
3205.0000 -98.18394 -95.34844 2.83550 1.99033 -94.72091 554.56556
3210.0000 -97.79096 -94.43119 3.35977 1.97321 -94.92118 546.58813
3215.0000 -96.97388 -93.23147 3.74241 2.03511 -94.19725 604.81690
3220.0000 -96.58465 -93.48686 3.09779 2.11883 -93.21805 646.91552
3225.0000 -98.26243 -94.96450 3.29793 2.04026 -94.13703 573.63294
3230.0000 -97.31754 -94.46514 2.85239 1.98246 -94.81296 519.26800
3235.0000 -96.58533 -93.36883 3.21650 2.02751 -94.28614 561.58493
3240.0000 -96.16641 -93.37621 2.79019 2.10514 -93.37813 605.53793
3245.0000 -96.65369 -94.02591 2.62779 2.04939 -94.03017 597.85394
3250.0000 -96.03370 -93.37496 2.65874 2.06694 -93.82494 594.15668
MELTING PROCESS: loop number 14 T-loop= 640.00000000000000
main_MD> interactions number 14 at Temperature= 640.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.83279 -1.88816 1.44894
force_rgl> df(natom) 1.93338 0.77034 1.39878
3255.0000 -96.52047 -93.58944 2.93103 2.09184 -93.53373 624.93344
3260.0000 -97.74017 -94.55579 3.18438 2.05781 -93.93173 599.08953
3265.0000 -97.27532 -94.26910 3.00622 2.05444 -93.97111 629.52219
3270.0000 -97.41872 -93.30469 4.11404 2.05931 -93.91414 627.51865
3275.0000 -96.33744 -93.08528 3.25215 2.10516 -93.37786 637.39237
3280.0000 -96.64414 -93.11357 3.53056 2.15676 -92.77434 695.64456
3285.0000 -97.15559 -94.52583 2.62976 2.05662 -93.94565 585.60448
3290.0000 -96.71351 -93.04955 3.66396 2.02060 -94.36693 573.27025
3295.0000 -97.30884 -94.51470 2.79414 2.08081 -93.66270 610.64998
3300.0000 -96.39870 -93.51250 2.88619 2.06184 -93.88452 575.48065
3305.0000 -96.75700 -92.69310 4.06390 2.13944 -92.97699 684.29026
3310.0000 -97.10207 -93.97076 3.13131 2.08413 -93.62386 627.05241
3315.0000 -96.90216 -93.96217 2.93999 2.06549 -93.84188 584.21066
3320.0000 -96.98826 -93.61092 3.37734 2.07130 -93.77394 618.36527
3325.0000 -97.16427 -94.37680 2.78746 2.08046 -93.66685 610.31783
3330.0000 -97.43264 -94.18629 3.24635 2.06360 -93.86399 629.01665
3335.0000 -97.02430 -94.09904 2.92526 2.02631 -94.30012 581.69988
3340.0000 -96.66385 -93.73269 2.93116 2.04823 -94.04374 606.17167
3345.0000 -95.52228 -92.35358 3.16870 2.12499 -93.14598 670.07326
3350.0000 -96.79947 -93.67101 3.12846 2.14110 -92.95752 679.95168
3355.0000 -96.68081 -93.56888 3.11193 2.09849 -93.45596 642.51403
3360.0000 -96.04833 -92.07767 3.97066 2.10231 -93.41128 622.94190
3365.0000 -96.13240 -92.39010 3.74230 2.19824 -92.28917 715.51891
3370.0000 -96.47637 -92.97602 3.50034 2.17323 -92.58178 725.69141
3375.0000 -96.30675 -93.25983 3.04692 2.17479 -92.56347 707.01480
3380.0000 -97.17339 -93.74015 3.43324 2.11421 -93.27210 626.15915
3385.0000 -95.98569 -93.51158 2.47410 2.05991 -93.90717 608.88921
3390.0000 -96.08563 -92.43222 3.65342 2.15041 -92.84866 667.47581
3395.0000 -95.72913 -92.22481 3.50433 2.19158 -92.36713 727.84178
3400.0000 -95.90156 -92.37464 3.52692 2.20803 -92.17467 721.51433
3405.0000 -96.70305 -94.15467 2.54838 2.11861 -93.22058 649.28411
3410.0000 -96.54497 -93.40350 3.14147 2.07705 -93.70673 634.22018
3415.0000 -96.66356 -92.86644 3.79712 2.12786 -93.11244 675.35216
3420.0000 -97.39282 -93.65098 3.74184 2.14246 -92.94166 662.80167
3425.0000 -96.61434 -94.23024 2.38410 2.05317 -93.98597 574.27799
3430.0000 -96.49833 -92.87978 3.61855 2.10959 -93.32613 621.94941
3435.0000 -96.42117 -93.00487 3.41630 2.17938 -92.50979 701.79234
3440.0000 -96.53354 -93.43160 3.10193 2.11648 -93.24552 632.67876
3445.0000 -96.67066 -92.87490 3.79576 2.14252 -92.94089 640.54790
3450.0000 -96.90110 -93.66543 3.23567 2.13144 -93.07051 691.89527
3455.0000 -97.45108 -93.83234 3.61875 2.04391 -94.09433 618.98117
3460.0000 -97.79293 -94.04413 3.74880 2.03760 -94.16811 616.59821
3465.0000 -96.94004 -93.90630 3.03374 2.08376 -93.62823 640.63014
3470.0000 -95.76814 -92.68684 3.08130 2.12105 -93.19203 674.64378
3475.0000 -96.32368 -93.28169 3.04199 2.13576 -93.01998 671.08698
3480.0000 -96.16634 -93.27237 2.89396 2.14542 -92.90699 685.15540
3485.0000 -96.33828 -92.73842 3.59986 2.11566 -93.25515 632.43040
3490.0000 -96.00144 -92.51157 3.48987 2.20427 -92.21869 708.58597
3495.0000 -96.19325 -92.45053 3.74272 2.20537 -92.20579 729.10767
3500.0000 -97.04645 -93.10920 3.93725 2.17682 -92.53975 676.33059
MELTING PROCESS: loop number 15 T-loop= 665.00000000000000
main_MD> interactions number 15 at Temperature= 665.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.73245 0.32050 0.76703
force_rgl> df(natom) -3.34199 -0.17092 4.00349
3505.0000 -95.50132 -93.01577 2.48555 2.13213 -93.06240 647.43266
3510.0000 -96.51901 -93.29828 3.22073 2.11770 -93.23119 625.02573
3515.0000 -95.99369 -92.44873 3.54496 2.16604 -92.66590 694.21053
3520.0000 -95.50744 -91.61599 3.89145 2.19368 -92.34260 716.08444
3525.0000 -95.83897 -91.23211 4.60686 2.24712 -91.71757 745.50835
3530.0000 -95.31707 -91.72984 3.58723 2.25927 -91.57547 737.68982
3535.0000 -96.09758 -92.82683 3.27075 2.23683 -91.83784 751.65087
3540.0000 -97.18508 -93.49425 3.69083 2.15272 -92.82161 721.63444
3545.0000 -96.60469 -93.52512 3.07957 2.12228 -93.17768 648.22153
3550.0000 -96.29708 -92.32864 3.96844 2.11086 -93.31126 653.88341
3555.0000 -96.46277 -93.12092 3.34185 2.16033 -92.73263 701.55041
3560.0000 -96.61434 -93.55044 3.06391 2.10884 -93.33487 673.62969
3565.0000 -96.66562 -92.88971 3.77590 2.10538 -93.37533 664.86318
3570.0000 -96.57500 -93.63727 2.93773 2.09477 -93.49937 612.60770
3575.0000 -98.08735 -94.48826 3.59909 2.06043 -93.90103 602.98573
3580.0000 -98.05785 -95.01468 3.04316 2.01526 -94.42939 578.47900
3585.0000 -97.72388 -94.72633 2.99754 1.97798 -94.86535 549.54479
3590.0000 -97.03164 -93.15401 3.87764 2.11889 -93.21736 655.50466
3595.0000 -95.75202 -92.90363 2.84839 2.12573 -93.13727 674.29346
3600.0000 -96.31101 -93.10290 3.20811 2.13167 -93.06783 657.34022
3605.0000 -96.20965 -92.62380 3.58585 2.09357 -93.51340 643.65429
3610.0000 -95.82279 -91.97268 3.85012 2.14560 -92.90486 677.01249
3615.0000 -95.96404 -93.47372 2.49032 2.10782 -93.34681 662.41491
3620.0000 -96.98183 -92.87816 4.10366 2.11881 -93.21827 684.48203
3625.0000 -95.74096 -92.12973 3.61124 2.16805 -92.64235 702.42657
3630.0000 -96.31422 -92.44060 3.87362 2.17804 -92.52547 699.57329
3635.0000 -95.87174 -92.20737 3.66438 2.19648 -92.30987 695.18280
3640.0000 -96.52588 -92.99683 3.52905 2.15678 -92.77416 660.88539
3645.0000 -96.61603 -93.25133 3.36470 2.12029 -93.20096 653.29498
3650.0000 -96.12663 -92.63712 3.48951 2.16658 -92.65948 673.40733
3655.0000 -96.08854 -91.58157 4.50697 2.23022 -91.91524 744.10342
3660.0000 -97.14323 -93.59548 3.54776 2.15250 -92.82416 680.45598
3665.0000 -96.41534 -93.38023 3.03511 2.13561 -93.02180 694.18766
3670.0000 -96.43203 -92.99612 3.43590 2.13170 -93.06746 683.18794
3675.0000 -96.47878 -93.13647 3.34231 2.13006 -93.08670 658.29746
3680.0000 -96.34692 -92.86106 3.48586 2.13155 -93.06929 641.58497
3685.0000 -96.50951 -92.78119 3.72832 2.12778 -93.11338 659.95847
3690.0000 -97.05199 -92.71014 4.34185 2.14734 -92.88452 695.15227
3695.0000 -96.23790 -93.31287 2.92503 2.10860 -93.33768 646.98216
3700.0000 -96.39634 -92.98363 3.41271 2.15658 -92.77645 697.78799
3705.0000 -97.14059 -93.56667 3.57391 2.09774 -93.46465 618.46613
3710.0000 -95.50401 -91.71415 3.78985 2.18050 -92.49675 701.49387
3715.0000 -96.87465 -93.17722 3.69743 2.20220 -92.24289 711.75061
3720.0000 -96.19339 -92.87016 3.32323 2.12067 -93.19655 646.32032
3725.0000 -96.83720 -93.43403 3.40317 2.08867 -93.57076 587.62810
3730.0000 -96.61039 -93.31396 3.29643 2.10806 -93.34398 641.73894
3735.0000 -96.30019 -93.53416 2.76602 2.11030 -93.31776 646.02790
3740.0000 -96.34739 -92.69309 3.65430 2.14745 -92.88330 678.60538
3745.0000 -95.48143 -91.59876 3.88267 2.23062 -91.91046 719.60193
3750.0000 -95.68703 -91.21229 4.47473 2.25460 -91.63008 762.46691
MELTING PROCESS: loop number 16 T-loop= 690.00000000000000
main_MD> interactions number 16 at Temperature= 690.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 4.26016 0.16342 -2.86970
force_rgl> df(natom) -1.10883 0.53682 -2.53919
3755.0000 -96.31983 -92.75380 3.56603 2.24454 -91.74775 756.64720
3760.0000 -94.45637 -91.50698 2.94939 2.20576 -92.20126 721.48053
3765.0000 -96.20725 -92.26403 3.94322 2.31532 -90.91988 789.45324
3770.0000 -95.77324 -92.05474 3.71850 2.20008 -92.26771 711.18074
3775.0000 -96.18963 -93.63401 2.55562 2.10483 -93.38179 631.92733
3780.0000 -96.82336 -93.35099 3.47237 2.09354 -93.51375 606.11930
3785.0000 -95.60152 -92.61017 2.99135 2.12365 -93.16162 619.16746
3790.0000 -96.13520 -92.41993 3.71528 2.17942 -92.50932 680.06283
3795.0000 -95.55978 -91.80066 3.75913 2.17962 -92.50703 663.24573
3800.0000 -96.51867 -92.54856 3.97011 2.19939 -92.27582 683.68676
3805.0000 -95.30775 -91.19530 4.11245 2.23202 -91.89415 746.10002
3810.0000 -95.86571 -91.10545 4.76026 2.31039 -90.97755 806.51931
3815.0000 -96.57638 -93.34535 3.23104 2.18402 -92.45558 728.84456
3820.0000 -96.82594 -93.26260 3.56334 2.14236 -92.94279 660.12893
3825.0000 -96.61602 -92.49223 4.12379 2.15607 -92.78242 701.79764
3830.0000 -95.57613 -92.11080 3.46532 2.18335 -92.46337 714.56609
3835.0000 -96.05321 -92.08716 3.96605 2.20731 -92.18309 698.18455
3840.0000 -96.92297 -93.46631 3.45666 2.12965 -93.09150 676.15977
3845.0000 -96.83763 -93.11129 3.72634 2.10214 -93.41318 616.48909
3850.0000 -96.92891 -93.49415 3.43476 2.11841 -93.22295 633.91863
3855.0000 -96.12882 -92.32930 3.79952 2.12201 -93.18086 642.91930
3860.0000 -95.48914 -91.75702 3.73212 2.25086 -91.67380 766.48587
3865.0000 -94.77377 -91.36689 3.40688 2.27453 -91.39698 765.84901
3870.0000 -95.75920 -92.72813 3.03107 2.22016 -92.03286 687.65712
3875.0000 -96.38235 -93.66643 2.71592 2.14951 -92.85915 646.25732
3880.0000 -97.45380 -94.70777 2.74603 2.08265 -93.64117 640.93485
3885.0000 -97.00003 -94.02100 2.97903 2.05190 -94.00081 628.63512
3890.0000 -96.92056 -93.77053 3.15003 2.06335 -93.86695 661.81263
3895.0000 -95.72320 -92.99547 2.72773 2.15657 -92.77657 660.42062
3900.0000 -96.02526 -91.94780 4.07746 2.16466 -92.68202 657.92417
3905.0000 -95.53310 -91.87370 3.65940 2.24600 -91.73066 745.52600
3910.0000 -95.40221 -91.55020 3.85201 2.29863 -91.11511 777.87634
3915.0000 -95.90305 -92.50583 3.39722 2.21027 -92.14848 750.88775
3920.0000 -95.75448 -92.17050 3.58398 2.17057 -92.61284 684.11828
3925.0000 -97.04792 -94.12397 2.92395 2.10650 -93.36225 621.76977
3930.0000 -95.80075 -92.87201 2.92873 2.09319 -93.51788 602.74627
3935.0000 -96.11572 -92.84228 3.27344 2.13751 -92.99955 662.65222
3940.0000 -96.30259 -92.53568 3.76691 2.15413 -92.80519 661.82940
3945.0000 -95.47000 -92.20154 3.26846 2.19697 -92.30414 746.37867
3950.0000 -96.26461 -92.83485 3.42976 2.16322 -92.69888 662.37525
3955.0000 -95.38793 -92.57497 2.81296 2.16745 -92.64934 712.90842
3960.0000 -96.44231 -92.98196 3.46035 2.15517 -92.79302 630.09594
3965.0000 -96.90925 -93.87776 3.03148 2.11278 -93.28873 653.04408
3970.0000 -95.58690 -91.46099 4.12592 2.17591 -92.55036 714.32332
3975.0000 -96.62586 -92.91902 3.70684 2.22458 -91.98116 726.82238
3980.0000 -97.00706 -94.08794 2.91912 2.10836 -93.34051 644.94176
3985.0000 -96.33528 -93.46368 2.87161 2.07516 -93.72882 601.89190
3990.0000 -96.13395 -92.83666 3.29729 2.15367 -92.81053 676.04158
3995.0000 -95.87407 -92.13054 3.74353 2.19260 -92.35519 687.45501
4000.0000 -96.38006 -93.01205 3.36801 2.15275 -92.82131 617.79195
MELTING PROCESS: loop number 17 T-loop= 715.00000000000000
main_MD> interactions number 17 at Temperature= 715.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.75919 -2.66266 5.19581
force_rgl> df(natom) -0.22638 -1.78952 -1.10211
4005.0000 -94.51567 -91.16915 3.34653 2.21490 -92.09443 677.44053
4010.0000 -95.53848 -92.17163 3.36685 2.24647 -91.72515 711.05929
4015.0000 -96.25020 -92.67553 3.57468 2.16153 -92.71863 699.50202
4020.0000 -96.18811 -92.93784 3.25027 2.16843 -92.63783 688.28451
4025.0000 -96.50621 -93.67475 2.83146 2.14274 -92.93832 656.86699
4030.0000 -97.03439 -93.42964 3.60476 2.12278 -93.17182 653.98670
4035.0000 -95.88978 -91.76046 4.12932 2.17461 -92.56556 727.60234
4040.0000 -95.60319 -90.94862 4.65457 2.26293 -91.53263 784.45947
4045.0000 -96.00409 -91.53767 4.46642 2.26684 -91.48686 776.45548
4050.0000 -96.15445 -92.61797 3.53649 2.21984 -92.03665 738.47059
4055.0000 -96.07886 -92.25620 3.82266 2.14805 -92.87629 678.51920
4060.0000 -96.04447 -91.96535 4.07911 2.20834 -92.17105 744.27968
4065.0000 -94.68646 -90.89726 3.78921 2.29263 -91.18518 788.26153
4070.0000 -95.40741 -91.67698 3.73042 2.22968 -91.92156 733.14234
4075.0000 -94.96186 -91.16357 3.79829 2.27312 -91.41343 772.07579
4080.0000 -95.62642 -92.35420 3.27222 2.22659 -91.95760 733.30591
4085.0000 -96.56822 -92.83748 3.73074 2.16348 -92.69573 662.51826
4090.0000 -95.04966 -92.01449 3.03517 2.19289 -92.35177 683.50828
4095.0000 -95.78422 -91.95152 3.83271 2.22519 -91.97400 728.15566
4100.0000 -95.64935 -92.36955 3.27980 2.19226 -92.35912 723.44943
4105.0000 -96.27304 -92.52600 3.74704 2.20731 -92.18309 733.92134
4110.0000 -95.86269 -91.71775 4.14494 2.18541 -92.43932 726.30049
4115.0000 -96.58350 -92.27793 4.30557 2.23863 -91.81681 744.58781
4120.0000 -96.34497 -92.03196 4.31301 2.21177 -92.13096 750.24953
4125.0000 -96.29377 -92.75212 3.54165 2.18443 -92.45079 700.64442
4130.0000 -96.99887 -93.25840 3.74047 2.15429 -92.80328 696.72201
4135.0000 -95.19993 -91.73956 3.46038 2.15935 -92.74406 697.15713
4140.0000 -96.03481 -93.42841 2.60640 2.12903 -93.09867 645.28535
4145.0000 -96.69672 -93.39560 3.30112 2.08333 -93.63318 621.98761
4150.0000 -96.75605 -93.66098 3.09507 2.09704 -93.47284 597.85575
4155.0000 -96.55093 -92.66698 3.88395 2.08201 -93.64867 594.30664
4160.0000 -96.16503 -92.47394 3.69109 2.20335 -92.22941 714.57397
4165.0000 -95.33127 -91.85396 3.47732 2.15506 -92.79427 651.39985
4170.0000 -96.27113 -93.09064 3.18050 2.18056 -92.49607 684.38077
4175.0000 -96.52025 -92.41735 4.10290 2.11780 -93.23011 662.75397
4180.0000 -96.22117 -92.37161 3.84956 2.20235 -92.24115 698.16935
4185.0000 -95.65046 -92.29957 3.35089 2.13626 -93.01420 700.62773
4190.0000 -96.17620 -93.00189 3.17431 2.17201 -92.59605 725.63064
4195.0000 -96.78047 -93.75208 3.02839 2.14394 -92.92430 707.33248
4200.0000 -96.31844 -93.08223 3.23621 2.10870 -93.33647 649.56079
4205.0000 -95.23692 -91.97149 3.26544 2.16846 -92.63756 680.44309
4210.0000 -96.23525 -91.63504 4.60021 2.24271 -91.76906 731.10076
4215.0000 -96.32073 -92.88578 3.43495 2.20354 -92.22723 730.36596
4220.0000 -95.92005 -92.94418 2.97587 2.15404 -92.80615 680.11723
4225.0000 -95.98918 -92.45241 3.53677 2.14630 -92.89677 668.33248
4230.0000 -95.78778 -92.51785 3.26993 2.18146 -92.48544 718.61778
4235.0000 -95.96223 -92.41808 3.54415 2.17256 -92.58955 716.28704
4240.0000 -96.96070 -93.74574 3.21496 2.11715 -93.23761 665.50410
4245.0000 -97.27388 -94.19651 3.07738 2.03718 -94.17296 611.25776
4250.0000 -96.41948 -93.81308 2.60641 2.05665 -93.94523 617.42373
MELTING PROCESS: loop number 18 T-loop= 740.00000000000000
main_MD> interactions number 18 at Temperature= 740.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 4.45657 0.51949 -2.00193
force_rgl> df(natom) 0.28558 -0.52682 1.45513
4255.0000 -95.64412 -92.34302 3.30110 2.15766 -92.76387 666.15202
4260.0000 -95.90157 -92.45342 3.44815 2.17222 -92.59351 637.07212
4265.0000 -95.22306 -90.99311 4.22995 2.21176 -92.13104 694.33732
4270.0000 -95.00195 -90.50523 4.49671 2.37064 -90.27282 832.84686
4275.0000 -94.75844 -89.57340 5.18504 2.39494 -89.98864 884.95027
4280.0000 -94.46555 -90.17845 4.28710 2.38268 -90.13202 914.97313
4285.0000 -95.30061 -91.01815 4.28246 2.31576 -90.91473 783.99646
4290.0000 -96.01671 -91.96968 4.04702 2.26309 -91.53077 777.44539
4295.0000 -95.09148 -91.65601 3.43547 2.24507 -91.74152 744.68547
4300.0000 -95.16441 -91.47707 3.68734 2.23237 -91.88999 752.78848
4305.0000 -95.64479 -91.42301 4.22178 2.23115 -91.90432 740.50516
4310.0000 -95.71072 -91.78369 3.92703 2.23627 -91.84447 755.17487
4315.0000 -95.62832 -91.43767 4.19066 2.25468 -91.62907 756.37499
4320.0000 -94.85341 -90.36078 4.49263 2.34966 -90.51823 853.32885
4325.0000 -95.64769 -92.07952 3.56816 2.24836 -91.70303 756.21078
4330.0000 -95.33765 -91.87149 3.46616 2.22782 -91.94326 738.75809
4335.0000 -95.13704 -91.11072 4.02633 2.26676 -91.48779 731.30133
4340.0000 -96.13559 -91.39596 4.73963 2.26415 -91.51838 746.45476
4345.0000 -96.31176 -92.23313 4.07863 2.23086 -91.90768 755.38684
4350.0000 -96.96364 -92.67716 4.28648 2.15025 -92.85050 687.53236
4355.0000 -96.15357 -92.96052 3.19306 2.16327 -92.69828 709.22856
4360.0000 -95.75311 -92.22293 3.53018 2.17712 -92.53627 658.26752
4365.0000 -96.03500 -92.36142 3.67358 2.16500 -92.67802 673.41304
4370.0000 -95.82085 -92.46900 3.35186 2.18745 -92.41543 724.15781
4375.0000 -95.61344 -90.92976 4.68367 2.30098 -91.08761 822.68541
4380.0000 -95.25443 -89.84300 5.41143 2.34342 -90.59114 836.56179
4385.0000 -94.58595 -90.60700 3.97894 2.37350 -90.23940 855.51445
4390.0000 -95.36059 -91.33898 4.02161 2.37006 -90.27957 876.46711
4395.0000 -96.16803 -91.91318 4.25486 2.26376 -91.52286 792.30457
4400.0000 -96.97506 -92.84429 4.13077 2.18475 -92.44706 713.98264
4405.0000 -96.71911 -93.26396 3.45515 2.12150 -93.18679 680.44215
4410.0000 -96.37099 -93.10940 3.26159 2.13899 -92.98224 680.77357
4415.0000 -96.28474 -92.19136 4.09337 2.18122 -92.48831 681.77460
4420.0000 -95.85665 -91.72082 4.13582 2.23178 -91.89693 748.71391
4425.0000 -94.60496 -91.19309 3.41187 2.27536 -91.38727 748.24712
4430.0000 -95.67957 -91.27949 4.40008 2.29768 -91.12613 770.62176
4435.0000 -95.28221 -91.29660 3.98561 2.31227 -90.95557 782.39337
4440.0000 -95.16837 -89.67261 5.49576 2.34880 -90.52832 814.96814
4445.0000 -95.36962 -90.56822 4.80140 2.41012 -89.81102 893.41714
4450.0000 -95.13010 -91.96220 3.16790 2.29094 -91.20498 774.64525
4455.0000 -95.77133 -91.45455 4.31677 2.24027 -91.79760 726.93109
4460.0000 -95.28097 -91.93169 3.34927 2.25768 -91.59406 791.12679
4465.0000 -95.71774 -91.84747 3.87027 2.23425 -91.86809 770.30755
4470.0000 -95.89100 -91.35457 4.53643 2.23784 -91.82603 765.68354
4475.0000 -95.95047 -92.31093 3.63954 2.25246 -91.65502 769.16306
4480.0000 -95.21893 -91.54700 3.67193 2.25001 -91.68373 756.23356
4485.0000 -96.67739 -92.81770 3.85969 2.18486 -92.44573 681.71377
4490.0000 -95.20499 -91.59692 3.60808 2.25223 -91.65773 732.22860
4495.0000 -94.10140 -90.94762 3.15378 2.27578 -91.38237 724.44244
4500.0000 -95.97903 -91.86951 4.10952 2.23534 -91.85527 751.32102
MELTING PROCESS: loop number 19 T-loop= 765.00000000000000
main_MD> interactions number 19 at Temperature= 765.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.04119 0.06456 -0.03986
force_rgl> df(natom) -1.19764 3.09497 -0.15610
4505.0000 -94.61598 -90.82634 3.78964 2.23992 -91.80175 718.18972
4510.0000 -94.79580 -90.92693 3.86887 2.35029 -90.51082 823.58651
4515.0000 -95.73994 -90.78658 4.95337 2.35715 -90.43058 809.52006
4520.0000 -95.60992 -91.49430 4.11563 2.26089 -91.55647 787.34149
4525.0000 -94.97495 -91.16053 3.81442 2.26378 -91.52269 777.93627
4530.0000 -94.49814 -90.97000 3.52814 2.25932 -91.57477 772.66476
4535.0000 -95.77559 -92.27234 3.50325 2.27640 -91.37509 742.11338
4540.0000 -94.56096 -90.62904 3.93192 2.26410 -91.51896 753.52288
4545.0000 -93.33055 -89.94944 3.38111 2.38711 -90.08024 839.73405
4550.0000 -95.92752 -92.03234 3.89518 2.30905 -90.99315 823.88406
4555.0000 -96.49427 -93.59190 2.90238 2.17486 -92.56266 675.19288
4560.0000 -96.29099 -91.92549 4.36550 2.15079 -92.84419 684.00534
4565.0000 -95.97020 -91.78356 4.18664 2.21464 -92.09736 749.80059
4570.0000 -95.92635 -92.15505 3.77130 2.23917 -91.81053 751.02530
4575.0000 -96.36698 -91.82425 4.54274 2.17904 -92.51385 680.50588
4580.0000 -95.65998 -91.88675 3.77324 2.25208 -91.65948 757.29761
4585.0000 -95.22118 -89.89199 5.32919 2.27895 -91.34522 781.71685
4590.0000 -94.25350 -89.82960 4.42390 2.42343 -89.65545 895.44824
4595.0000 -96.22502 -92.74764 3.47739 2.28009 -91.33192 810.92073
4600.0000 -95.62299 -91.84873 3.77426 2.17961 -92.50708 719.35529
4605.0000 -94.53488 -90.21542 4.31946 2.30299 -91.06403 812.60004
4610.0000 -95.27777 -91.44749 3.83028 2.29244 -91.18744 810.02012
4615.0000 -96.34296 -92.57612 3.76684 2.23741 -91.83113 731.81488
4620.0000 -96.38396 -91.96904 4.41492 2.17801 -92.52583 696.71222
4625.0000 -94.99268 -91.21720 3.77548 2.23991 -91.80180 755.25495
4630.0000 -95.43962 -90.62702 4.81260 2.32494 -90.80732 786.96596
4635.0000 -94.90912 -90.63430 4.27482 2.33472 -90.69295 809.93554
4640.0000 -94.86814 -90.54553 4.32261 2.33523 -90.68697 837.83707
4645.0000 -95.58371 -91.62103 3.96268 2.30799 -91.00564 805.32493
4650.0000 -95.39571 -91.56728 3.82843 2.28837 -91.23507 799.58663
4655.0000 -95.74445 -91.93239 3.81206 2.26823 -91.47058 754.32997
4660.0000 -96.50657 -92.34705 4.15952 2.21422 -92.10230 727.92237
4665.0000 -96.53983 -93.44948 3.09035 2.15259 -92.82321 658.73831
4670.0000 -96.18672 -92.46482 3.72191 2.12168 -93.18468 657.98852
4675.0000 -96.47144 -92.37879 4.09266 2.21822 -92.05553 738.67535
4680.0000 -95.16272 -91.98572 3.17699 2.24645 -91.72533 790.23727
4685.0000 -95.81416 -92.37343 3.44073 2.22345 -91.99432 720.21081
4690.0000 -96.09584 -92.18370 3.91214 2.17295 -92.58499 671.47949
4695.0000 -95.97534 -92.45440 3.52094 2.13593 -93.01805 648.50124
4700.0000 -96.02485 -91.48780 4.53705 2.19791 -92.29308 689.18901
4705.0000 -95.06674 -90.37160 4.69514 2.31039 -90.97749 790.02129
4710.0000 -94.25751 -89.66591 4.59160 2.40267 -89.89822 875.56577
4715.0000 -96.43271 -93.00574 3.42697 2.25808 -91.58929 795.76096
4720.0000 -94.87869 -90.58117 4.29752 2.19702 -92.30347 723.09421
4725.0000 -95.71950 -91.53041 4.18909 2.30876 -90.99657 771.26826
4730.0000 -95.10260 -90.69615 4.40645 2.30980 -90.98446 809.94908
4735.0000 -94.97246 -91.22983 3.74263 2.29709 -91.13308 803.89879
4740.0000 -95.79394 -91.67679 4.11715 2.26806 -91.47258 777.70830
4745.0000 -95.66921 -91.57934 4.08986 2.24523 -91.73964 761.18931
4750.0000 -96.37543 -91.07402 5.30141 2.25789 -91.59155 807.87752
MELTING PROCESS: loop number 20 T-loop= 790.00000000000000
main_MD> interactions number 20 at Temperature= 790.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.57421 2.37536 -0.77242
force_rgl> df(natom) -4.59490 -3.81501 -3.98458
4755.0000 -94.83897 -91.04190 3.79707 2.28918 -91.22560 797.47749
4760.0000 -96.88029 -92.92323 3.95706 2.23195 -91.89490 732.55337
4765.0000 -94.81764 -90.90136 3.91628 2.26660 -91.48968 763.06423
4770.0000 -95.38071 -91.19734 4.18337 2.27824 -91.35358 782.12564
4775.0000 -95.26418 -91.18664 4.07754 2.24221 -91.77498 737.15465
4780.0000 -94.58966 -91.12444 3.46522 2.26875 -91.46450 787.32239
4785.0000 -95.30241 -91.59451 3.70789 2.24741 -91.71411 764.10994
4790.0000 -95.45127 -91.11630 4.33496 2.27946 -91.33926 800.00382
4795.0000 -95.16007 -90.92178 4.23830 2.31259 -90.95174 831.38454
4800.0000 -95.11758 -91.10383 4.01376 2.28547 -91.26900 809.49406
4805.0000 -95.36658 -91.42776 3.93882 2.27565 -91.38387 783.90120
4810.0000 -96.24896 -92.35964 3.88931 2.22202 -92.01111 782.04390
4815.0000 -94.62679 -91.20479 3.42200 2.23804 -91.82373 755.97180
4820.0000 -95.56727 -91.24966 4.31761 2.24595 -91.73125 770.07647
4825.0000 -95.79023 -90.97236 4.81787 2.28225 -91.30660 772.36012
4830.0000 -95.64411 -91.31363 4.33047 2.32272 -90.83333 857.05448
4835.0000 -95.62200 -91.19301 4.42900 2.25312 -91.64737 754.58523
4840.0000 -96.03725 -91.67539 4.36186 2.26340 -91.52706 716.63369
4845.0000 -95.27408 -90.55313 4.72095 2.31289 -90.94822 785.45689
4850.0000 -95.10761 -90.49141 4.61620 2.33711 -90.66498 862.06032
4855.0000 -95.46804 -90.12881 5.33922 2.35070 -90.50604 842.86664
4860.0000 -94.35502 -89.46789 4.88713 2.39658 -89.96943 861.63605
4865.0000 -95.39544 -91.10782 4.28761 2.37345 -90.23998 820.86928
4870.0000 -95.65369 -90.77233 4.88137 2.31162 -90.96314 789.01720
4875.0000 -95.43426 -91.04185 4.39241 2.30442 -91.04736 792.05815
4880.0000 -96.31043 -91.99577 4.31466 2.26109 -91.55418 790.65656
4885.0000 -95.04915 -90.73505 4.31410 2.25661 -91.60650 754.58050
4890.0000 -93.88586 -89.54931 4.33655 2.37160 -90.26156 848.11918
4895.0000 -95.33437 -90.75230 4.58207 2.34790 -90.53884 834.78757
4900.0000 -94.48043 -89.23470 5.24574 2.38481 -90.10711 867.96841
4905.0000 -93.58539 -88.88358 4.70182 2.49532 -88.81458 948.41588
4910.0000 -94.40569 -89.62114 4.78455 2.36465 -90.34286 824.85211
4915.0000 -94.90304 -89.65301 5.25003 2.44747 -89.37423 919.25711
4920.0000 -94.19074 -89.47838 4.71236 2.40882 -89.82631 892.74197
4925.0000 -94.26093 -89.38475 4.87618 2.41096 -89.80123 843.57710
4930.0000 -94.61885 -90.17290 4.44594 2.32035 -90.86108 803.19284
4935.0000 -95.72869 -91.93941 3.78927 2.34200 -90.60784 806.88917
4940.0000 -95.89978 -91.74742 4.15236 2.27069 -91.44183 771.18632
4945.0000 -95.26288 -91.77851 3.48437 2.27896 -91.34509 760.59790
4950.0000 -95.82943 -92.41075 3.41868 2.21845 -92.05291 712.78449
4955.0000 -94.87255 -91.56547 3.30708 2.24226 -91.77435 750.86019
4960.0000 -94.93144 -90.05789 4.87355 2.30157 -91.08073 794.39539
4965.0000 -95.54602 -91.09156 4.45446 2.34260 -90.60073 809.22110
4970.0000 -94.34070 -90.08503 4.25567 2.33753 -90.66010 793.29198
4975.0000 -95.73683 -91.91406 3.82277 2.25706 -91.60121 768.69199
4980.0000 -95.27883 -91.79381 3.48503 2.28170 -91.31304 807.67826
4985.0000 -95.17471 -90.66174 4.51296 2.31906 -90.87613 821.60881
4990.0000 -95.50404 -91.19640 4.30764 2.31486 -90.92521 822.17745
4995.0000 -95.85104 -92.06801 3.78304 2.24652 -91.72453 726.44084
5000.0000 -96.33986 -92.39740 3.94246 2.23781 -91.82639 765.41404
MELTING PROCESS: loop number 21 T-loop= 815.00000000000000
main_MD> interactions number 21 at Temperature= 815.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -2.66652 -1.42940 4.08241
force_rgl> df(natom) -0.51897 -1.47126 -0.74355
5005.0000 -95.02429 -91.39332 3.63097 2.17063 -92.61219 706.54693
5010.0000 -95.34603 -90.75655 4.58947 2.29964 -91.10324 785.10349
5015.0000 -94.48900 -90.24134 4.24766 2.41944 -89.70206 902.92003
5020.0000 -93.62641 -88.55791 5.06850 2.42540 -89.63233 912.39940
5025.0000 -93.27907 -87.52724 5.75183 2.52549 -88.46170 982.10510
5030.0000 -93.46790 -88.75500 4.71290 2.49028 -88.87349 957.08549
5035.0000 -94.57098 -90.51805 4.05293 2.42773 -89.60515 892.84272
5040.0000 -94.56750 -90.06331 4.50419 2.35450 -90.46163 806.07496
5045.0000 -94.75280 -90.16957 4.58323 2.35881 -90.41119 881.26895
5050.0000 -94.87275 -88.87313 5.99961 2.44417 -89.41278 896.14599
5055.0000 -94.94108 -90.57638 4.36470 2.36946 -90.28668 853.54303
5060.0000 -94.78342 -90.70825 4.07517 2.36872 -90.29523 874.55800
5065.0000 -94.88260 -90.84105 4.04155 2.33100 -90.73641 848.19090
5070.0000 -95.18032 -91.01011 4.17022 2.30219 -91.07343 814.70571
5075.0000 -95.75164 -91.53567 4.21598 2.25632 -91.60996 770.39971
5080.0000 -95.14822 -91.38796 3.76026 2.21705 -92.06925 711.95900
5085.0000 -94.31748 -89.01053 5.30695 2.33441 -90.69661 871.96442
5090.0000 -94.63190 -90.70624 3.92567 2.41065 -89.80491 862.77161
5095.0000 -94.97147 -89.88402 5.08745 2.33753 -90.66006 821.13091
5100.0000 -94.31603 -90.38287 3.93316 2.38533 -90.10097 872.36382
5105.0000 -95.08821 -91.10083 3.98738 2.31406 -90.93463 842.65420
5110.0000 -95.75116 -91.59670 4.15446 2.29589 -91.14713 791.52729
5115.0000 -95.11678 -91.28099 3.83580 2.25283 -91.65072 734.69266
5120.0000 -94.64639 -90.71034 3.93605 2.34724 -90.54646 857.72206
5125.0000 -95.57647 -90.71688 4.85958 2.33911 -90.64155 807.51281
5130.0000 -94.54084 -90.71221 3.82863 2.33149 -90.73075 822.53461
5135.0000 -95.29331 -91.16242 4.13089 2.31335 -90.94291 815.97691
5140.0000 -94.45897 -90.96141 3.49756 2.29454 -91.16290 778.23053
5145.0000 -94.32471 -89.59976 4.72494 2.32790 -90.77277 789.85712
5150.0000 -95.26827 -89.05115 6.21712 2.40031 -89.92577 918.84899
5155.0000 -95.32220 -90.69351 4.62869 2.35830 -90.41714 841.75238
5160.0000 -95.21703 -91.66905 3.54798 2.26840 -91.46862 764.79420
5165.0000 -94.86559 -90.55582 4.30977 2.26135 -91.55105 756.13909
5170.0000 -95.14947 -90.38227 4.76719 2.31759 -90.89331 786.60606
5175.0000 -94.77534 -91.02140 3.75394 2.30556 -91.03403 779.93705
5180.0000 -95.57812 -91.26417 4.31396 2.34094 -90.62016 834.80078
5185.0000 -95.41446 -91.73427 3.68019 2.30369 -91.05590 801.60033
5190.0000 -95.38084 -90.53257 4.84827 2.30073 -91.09053 778.80770
5195.0000 -95.52539 -91.85671 3.66867 2.28637 -91.25850 797.29351
5200.0000 -96.47807 -92.27039 4.20768 2.23860 -91.81715 784.14500
5205.0000 -96.16006 -92.35065 3.80941 2.19340 -92.34589 723.41716
5210.0000 -96.01720 -91.82939 4.18781 2.17414 -92.57107 731.98547
5215.0000 -95.85464 -92.09317 3.76147 2.25683 -91.60398 778.26814
5220.0000 -95.94281 -92.56320 3.37961 2.30836 -91.00125 779.24475
5225.0000 -95.38548 -91.68323 3.70224 2.24702 -91.71865 758.24017
5230.0000 -95.33168 -91.89611 3.43557 2.23629 -91.84421 760.37578
5235.0000 -94.73961 -89.39958 5.34003 2.29517 -91.15553 831.83126
5240.0000 -93.87585 -89.49251 4.38334 2.42743 -89.60866 899.49816
5245.0000 -95.11899 -90.59071 4.52827 2.40736 -89.84336 891.78201
5250.0000 -94.75169 -89.93881 4.81287 2.41162 -89.79348 881.72139
MELTING PROCESS: loop number 22 T-loop= 840.00000000000000
main_MD> interactions number 22 at Temperature= 840.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.87218 1.04099 4.48789
force_rgl> df(natom) 0.17651 0.24759 0.18632
5255.0000 -94.39444 -90.85796 3.53649 2.37740 -90.19373 867.70611
5260.0000 -94.37479 -90.28813 4.08667 2.33748 -90.66070 792.50933
5265.0000 -94.79123 -91.24139 3.54984 2.32291 -90.83109 842.79351
5270.0000 -95.48309 -91.07984 4.40325 2.28292 -91.29885 803.43650
5275.0000 -94.66879 -90.39716 4.27163 2.37294 -90.24595 843.99586
5280.0000 -93.43897 -88.49343 4.94554 2.41084 -89.80262 872.94249
5285.0000 -94.41369 -89.77146 4.64223 2.49120 -88.86270 944.63392
5290.0000 -93.30491 -89.26720 4.03771 2.47583 -89.04250 941.89966
5295.0000 -94.31045 -90.01394 4.29651 2.45429 -89.29444 892.58548
5300.0000 -92.10597 -88.22798 3.87800 2.47289 -89.07693 924.78294
5305.0000 -94.42934 -90.09504 4.33430 2.44581 -89.39359 870.65171
5310.0000 -95.17043 -90.67083 4.49960 2.33713 -90.66478 817.76769
5315.0000 -92.05829 -87.98220 4.07608 2.38645 -90.08789 871.15918
5320.0000 -94.28921 -88.99367 5.29554 2.53792 -88.31637 989.70335
5325.0000 -95.45164 -90.87055 4.58109 2.38999 -90.04651 894.37100
5330.0000 -94.97929 -91.01759 3.96170 2.29142 -91.19933 810.29588
5335.0000 -95.80691 -91.42408 4.38283 2.27522 -91.38889 776.82127
5340.0000 -95.43116 -91.45339 3.97777 2.28890 -91.22882 774.73855
5345.0000 -94.59183 -90.61014 3.98169 2.34866 -90.52985 835.29761
5350.0000 -94.66502 -90.21212 4.45290 2.37585 -90.21194 845.69812
5355.0000 -94.22567 -90.49487 3.73081 2.36981 -90.28250 823.09302
5360.0000 -95.72047 -92.18807 3.53240 2.29336 -91.17665 805.60924
5365.0000 -95.22070 -91.05291 4.16780 2.22644 -91.95935 745.11186
5370.0000 -94.71802 -90.54668 4.17134 2.31521 -90.92119 808.50206
5375.0000 -94.15486 -90.05165 4.10321 2.38086 -90.15325 887.53157
5380.0000 -94.99477 -91.01214 3.98263 2.35509 -90.45470 827.81349
5385.0000 -95.07990 -90.95142 4.12848 2.28839 -91.23482 774.22205
5390.0000 -94.95393 -90.84406 4.10987 2.38211 -90.13872 827.00299
5395.0000 -94.60370 -90.61024 3.99346 2.37543 -90.21675 825.38099
5400.0000 -93.44764 -88.86947 4.57817 2.37905 -90.17447 880.22938
5405.0000 -94.39254 -88.51086 5.88168 2.46546 -89.16386 930.15598
5410.0000 -94.69564 -88.56642 6.12922 2.46931 -89.11880 918.99882
5415.0000 -94.24924 -90.57689 3.67235 2.43165 -89.55921 891.00010
5420.0000 -95.60402 -90.42935 5.17467 2.34364 -90.58868 808.41215
5425.0000 -93.54405 -88.78167 4.76238 2.43846 -89.47958 867.81600
5430.0000 -93.22599 -88.68791 4.53808 2.48665 -88.91596 954.94738
5435.0000 -93.88200 -90.22157 3.66044 2.44693 -89.38052 910.85918
5440.0000 -94.37666 -90.62878 3.74788 2.32381 -90.82051 824.70631
5445.0000 -95.25001 -89.59238 5.65763 2.34393 -90.58522 829.53969
5450.0000 -94.15540 -89.50091 4.65449 2.43612 -89.50698 921.24607
5455.0000 -95.84403 -91.40411 4.43991 2.36262 -90.36658 847.36235
5460.0000 -95.46948 -90.51436 4.95512 2.28126 -91.31826 797.11810
5465.0000 -94.23270 -90.40269 3.83000 2.38750 -90.07564 899.49560
5470.0000 -93.95581 -89.27043 4.68538 2.40679 -89.85005 851.71231
5475.0000 -94.14438 -88.98597 5.15841 2.39690 -89.96565 882.14875
5480.0000 -94.51232 -90.11583 4.39649 2.41089 -89.80210 920.55709
5485.0000 -94.62592 -89.68788 4.93805 2.43363 -89.53615 880.71299
5490.0000 -94.50319 -90.36417 4.13902 2.44130 -89.44636 925.39821
5495.0000 -94.65098 -90.03597 4.61501 2.32431 -90.81470 804.17060
5500.0000 -94.83682 -90.67668 4.16014 2.37848 -90.18115 868.79734
MELTING PROCESS: loop number 23 T-loop= 865.00000000000000
main_MD> interactions number 23 at Temperature= 865.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.17190 0.39450 -2.37088
force_rgl> df(natom) -1.64990 2.40375 5.49869
5505.0000 -95.55567 -90.89801 4.65766 2.33842 -90.64965 813.95166
5510.0000 -96.24104 -91.79962 4.44142 2.24481 -91.74455 762.22546
5515.0000 -95.41264 -91.19950 4.21314 2.28007 -91.33216 784.99158
5520.0000 -95.02495 -90.87168 4.15326 2.34575 -90.56389 832.83113
5525.0000 -94.83410 -89.92414 4.90996 2.32383 -90.82037 814.32611
5530.0000 -94.31120 -88.80706 5.50414 2.48887 -88.89001 949.53914
5535.0000 -94.78201 -89.79131 4.99070 2.47256 -89.08076 963.86273
5540.0000 -94.15994 -89.46927 4.69067 2.40795 -89.83648 868.68713
5545.0000 -94.07603 -89.43253 4.64351 2.39907 -89.94026 849.26105
5550.0000 -94.31366 -90.14491 4.16875 2.40208 -89.90513 879.32113
5555.0000 -95.49586 -91.19441 4.30145 2.37006 -90.27965 838.37607
5560.0000 -95.97111 -91.64810 4.32301 2.27904 -91.34417 776.34274
5565.0000 -94.88367 -91.62520 3.25847 2.30126 -91.08433 782.13986
5570.0000 -94.62829 -89.73000 4.89828 2.31924 -90.87400 818.21690
5575.0000 -93.73356 -88.95679 4.77678 2.41251 -89.78310 906.29169
5580.0000 -94.28430 -89.50439 4.77990 2.40600 -89.85924 893.99111
5585.0000 -94.74828 -90.56796 4.18032 2.36374 -90.35357 834.68899
5590.0000 -94.78212 -90.74400 4.03812 2.33551 -90.68376 828.91340
5595.0000 -94.56457 -90.13449 4.43008 2.36262 -90.36666 841.38106
5600.0000 -94.88030 -90.89529 3.98501 2.40685 -89.84931 867.17649
5605.0000 -94.73037 -90.83567 3.89470 2.34426 -90.58138 849.76179
5610.0000 -94.47618 -90.09425 4.38193 2.33409 -90.70030 827.99495
5615.0000 -94.36191 -90.23091 4.13100 2.36843 -90.29867 839.03299
5620.0000 -95.45637 -91.06511 4.39126 2.34255 -90.60142 841.76042
5625.0000 -95.45180 -91.77384 3.67796 2.30412 -91.05089 796.00525
5630.0000 -94.09943 -90.91457 3.18486 2.29245 -91.18737 782.22573
5635.0000 -94.33598 -89.48676 4.84922 2.36549 -90.33307 848.57458
5640.0000 -94.92367 -90.44822 4.47545 2.34687 -90.55081 861.05767
5645.0000 -94.93080 -91.20912 3.72167 2.32999 -90.74826 815.02494
5650.0000 -93.53913 -89.12725 4.41188 2.37871 -90.17846 847.19164
5655.0000 -94.82345 -89.58681 5.23664 2.44262 -89.43095 890.77102
5660.0000 -94.86000 -90.03692 4.82308 2.42696 -89.61408 837.35687
5665.0000 -95.63533 -90.80285 4.83248 2.39155 -90.02823 891.79778
5670.0000 -93.98487 -89.91226 4.07261 2.37333 -90.24132 829.47896
5675.0000 -93.86917 -89.51793 4.35125 2.40180 -89.90836 897.83199
5680.0000 -94.27807 -90.71577 3.56230 2.35632 -90.44028 859.02319
5685.0000 -95.23581 -91.30404 3.93178 2.28974 -91.21908 767.17386
5690.0000 -95.83540 -91.17817 4.65724 2.25241 -91.65561 742.93277
5695.0000 -95.18629 -91.24253 3.94375 2.26761 -91.47790 772.29227
5700.0000 -94.87699 -90.69885 4.17814 2.33859 -90.64768 869.42175
5705.0000 -95.41174 -89.71934 5.69240 2.38279 -90.13078 866.56862
5710.0000 -94.99929 -90.99575 4.00354 2.34642 -90.55609 851.53762
5715.0000 -95.24955 -90.60346 4.64609 2.28691 -91.25218 780.14770
5720.0000 -95.92607 -90.66587 5.26020 2.33389 -90.70269 854.08016
5725.0000 -93.97488 -88.93310 5.04178 2.40520 -89.86860 885.68472
5730.0000 -94.91927 -90.06698 4.85229 2.41323 -89.77473 891.04846
5735.0000 -93.03776 -87.74478 5.29298 2.45200 -89.32125 896.91381
5740.0000 -94.27102 -89.55334 4.71768 2.54489 -88.23484 954.25101
5745.0000 -94.99327 -90.64959 4.34367 2.42034 -89.69154 865.18910
5750.0000 -93.88249 -89.19119 4.69130 2.43848 -89.47933 892.07830
MELTING PROCESS: loop number 24 T-loop= 890.00000000000000
main_MD> interactions number 24 at Temperature= 890.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.17587 0.31629 1.86549
force_rgl> df(natom) -1.30436 -0.01786 0.31362
5755.0000 -93.88630 -88.89419 4.99211 2.51294 -88.60849 951.27030
5760.0000 -94.06733 -89.56611 4.50122 2.46567 -89.16136 938.12658
5765.0000 -93.54455 -88.12461 5.41993 2.52623 -88.45309 952.20896
5770.0000 -93.74790 -89.67508 4.07282 2.47773 -89.02035 906.33120
5775.0000 -93.93908 -89.68849 4.25059 2.36800 -90.30368 829.11019
5780.0000 -94.33582 -89.15470 5.18112 2.47293 -89.07646 969.58356
5785.0000 -93.51650 -88.75283 4.76368 2.49685 -88.79667 968.57390
5790.0000 -94.30370 -89.80090 4.50280 2.47329 -89.07222 916.30004
5795.0000 -93.60305 -89.04108 4.56197 2.40869 -89.82777 894.75520
5800.0000 -94.25180 -87.79001 6.46179 2.57555 -87.87619 998.31693
5805.0000 -93.93610 -89.49425 4.44186 2.50929 -88.65117 978.96735
5810.0000 -94.16194 -88.88663 5.27531 2.45780 -89.25338 955.44453
5815.0000 -95.00737 -90.41673 4.59064 2.39402 -89.99942 859.09362
5820.0000 -93.52280 -89.28241 4.24039 2.43208 -89.55417 844.17397
5825.0000 -92.33286 -88.42851 3.90435 2.46805 -89.13346 907.41512
5830.0000 -94.16497 -88.99900 5.16597 2.53146 -88.39186 946.89039
5835.0000 -95.54540 -90.81699 4.72841 2.37988 -90.16475 875.14759
5840.0000 -95.10371 -90.46974 4.63397 2.38912 -90.05664 869.70524
5845.0000 -94.35273 -90.11590 4.23684 2.40305 -89.89376 834.49728
5850.0000 -95.51245 -90.30554 5.20691 2.39583 -89.97817 877.24428
5855.0000 -95.63264 -91.23426 4.39838 2.30910 -90.99264 815.47816
5860.0000 -94.84218 -90.97465 3.86753 2.28542 -91.26962 784.39300
5865.0000 -94.37782 -89.39777 4.98004 2.42802 -89.60173 901.59460
5870.0000 -92.79191 -86.76834 6.02357 2.53978 -88.29457 963.56490
5875.0000 -94.37896 -88.25849 6.12046 2.58084 -87.81427 1041.63779
5880.0000 -93.67819 -88.65309 5.02510 2.58115 -87.81070 1033.36549
5885.0000 -95.54250 -90.68374 4.85875 2.39452 -89.99347 870.78755
5890.0000 -94.51302 -90.71257 3.80045 2.36289 -90.36347 822.87905
5895.0000 -93.96891 -89.93053 4.03838 2.38519 -90.10266 835.60504
5900.0000 -94.55151 -90.86599 3.68552 2.36882 -90.29409 812.24370
5905.0000 -94.54826 -90.29535 4.25290 2.35000 -90.51421 858.66432
5910.0000 -94.07585 -89.80752 4.26833 2.42568 -89.62905 888.21830
5915.0000 -94.48013 -89.55433 4.92580 2.41241 -89.78433 834.52576
5920.0000 -93.81226 -89.65787 4.15439 2.42593 -89.62613 910.85984
5925.0000 -93.94050 -89.54966 4.39084 2.48131 -88.97840 901.22849
5930.0000 -94.24628 -89.41633 4.82994 2.47918 -89.00329 897.12701
5935.0000 -93.25380 -89.00228 4.25152 2.42184 -89.67402 891.17509
5940.0000 -95.55490 -89.78129 5.77361 2.45716 -89.26089 914.69616
5945.0000 -94.07958 -88.75580 5.32379 2.44461 -89.40761 936.35123
5950.0000 -94.28134 -88.17538 6.10596 2.50026 -88.75675 991.72073
5955.0000 -94.13197 -88.78391 5.34806 2.51365 -88.60016 970.38571
5960.0000 -95.54032 -91.29954 4.24078 2.40025 -89.92648 905.53670
5965.0000 -95.25401 -91.93580 3.31821 2.28015 -91.33116 775.16365
5970.0000 -95.95046 -91.51527 4.43519 2.26444 -91.51493 768.49236
5975.0000 -93.96072 -89.17592 4.78480 2.36759 -90.30849 889.18975
5980.0000 -93.35987 -88.61862 4.74126 2.42364 -89.65294 892.62782
5985.0000 -92.68682 -88.55771 4.12911 2.48665 -88.91596 929.67135
5990.0000 -93.27522 -88.34005 4.93517 2.51021 -88.64038 930.04027
5995.0000 -94.51809 -89.81389 4.70420 2.47178 -89.08992 932.75456
6000.0000 -93.81306 -89.28838 4.52468 2.49666 -88.79888 921.05907
MELTING PROCESS: loop number 25 T-loop= 915.00000000000000
main_MD> interactions number 25 at Temperature= 915.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 4.31776 -1.86292 -0.53513
force_rgl> df(natom) -0.19907 -1.62964 1.14128
6005.0000 -94.65933 -89.79803 4.86130 2.47938 -89.00105 936.04397
6010.0000 -95.47537 -91.13851 4.33686 2.34138 -90.61504 836.43163
6015.0000 -95.51729 -90.46005 5.05724 2.37931 -90.17139 896.67565
6020.0000 -94.55632 -89.56467 4.99165 2.45247 -89.31573 917.51809
6025.0000 -92.89261 -88.90856 3.98405 2.47349 -89.06990 939.00743
6030.0000 -95.57111 -91.16354 4.40757 2.34543 -90.56767 835.28258
6035.0000 -95.03744 -90.21916 4.81828 2.31541 -90.91882 800.78559
6040.0000 -94.62762 -90.41339 4.21424 2.40797 -89.83621 880.40787
6045.0000 -94.75856 -89.90388 4.85467 2.38420 -90.11423 863.47621
6050.0000 -94.24196 -89.12958 5.11238 2.47133 -89.09515 971.17707
6055.0000 -93.26959 -88.99301 4.27658 2.48623 -88.92091 910.87296
6060.0000 -94.87872 -89.61346 5.26526 2.40775 -89.83881 878.01884
6065.0000 -94.26156 -89.29384 4.96772 2.42643 -89.62035 896.91434
6070.0000 -93.80179 -89.73228 4.06951 2.42468 -89.64083 914.28590
6075.0000 -93.72103 -89.39225 4.32878 2.42884 -89.59214 869.75149
6080.0000 -93.32665 -89.15871 4.16794 2.47016 -89.10878 942.43635
6085.0000 -94.45852 -89.71693 4.74159 2.48041 -88.98898 949.85767
6090.0000 -93.44329 -89.14414 4.29915 2.46863 -89.12673 928.61905
6095.0000 -93.42513 -89.63554 3.78958 2.41178 -89.79165 839.05977
6100.0000 -94.71816 -89.27589 5.44227 2.50849 -88.66055 924.29264
6105.0000 -94.56425 -89.83714 4.72710 2.43060 -89.57149 886.75788
6110.0000 -94.20086 -90.29625 3.90461 2.40029 -89.92607 842.74268
6115.0000 -94.72723 -90.23650 4.49073 2.32021 -90.86266 821.40803
6120.0000 -94.45732 -89.34821 5.10911 2.43928 -89.46998 885.98701
6125.0000 -91.66451 -87.08588 4.57862 2.56997 -87.94146 1023.75490
6130.0000 -93.39954 -88.03512 5.36442 2.58692 -87.74322 1023.54823
6135.0000 -92.52110 -86.74547 5.77563 2.64664 -87.04474 1058.35475
6140.0000 -93.10040 -88.18385 4.91656 2.58703 -87.74190 1005.68996
6145.0000 -93.91486 -90.19528 3.71957 2.41860 -89.71190 927.41786
6150.0000 -93.10883 -88.34688 4.76195 2.50693 -88.67874 990.23280
6155.0000 -92.47911 -88.37697 4.10214 2.57855 -87.84113 1046.90330
6160.0000 -95.07439 -89.77061 5.30378 2.51230 -88.61593 945.32458
6165.0000 -93.77031 -88.89308 4.87723 2.47753 -89.02261 960.13671
6170.0000 -93.97599 -89.76886 4.20713 2.42468 -89.64071 905.28290
6175.0000 -95.28901 -89.77275 5.51626 2.40579 -89.86176 899.31175
6180.0000 -95.43033 -90.51300 4.91732 2.35981 -90.39946 852.46437
6185.0000 -94.19088 -90.22053 3.97036 2.39035 -90.04225 885.06326
6190.0000 -95.07734 -90.31311 4.76423 2.35578 -90.44663 821.70935
6195.0000 -94.55365 -89.82371 4.72994 2.43815 -89.48322 873.22593
6200.0000 -94.33773 -88.35417 5.98357 2.44594 -89.39209 883.14409
6205.0000 -94.55145 -90.22687 4.32458 2.46540 -89.16451 912.17426
6210.0000 -94.99989 -90.72868 4.27120 2.36702 -90.31518 856.13142
6215.0000 -94.49606 -90.37765 4.11841 2.35353 -90.47294 851.04487
6220.0000 -93.33688 -89.36715 3.96973 2.35744 -90.42723 836.82043
6225.0000 -93.70334 -89.61893 4.08441 2.43358 -89.53662 865.70053
6230.0000 -95.17523 -90.51253 4.66270 2.37731 -90.19484 865.19355
6235.0000 -93.90833 -88.63762 5.27071 2.43923 -89.47058 926.32957
6240.0000 -94.45580 -90.58387 3.87193 2.35547 -90.45021 812.74704
6245.0000 -94.59625 -90.19423 4.40202 2.42822 -89.59937 922.13585
6250.0000 -95.06098 -89.27145 5.78954 2.47946 -89.00003 899.61455
MELTING PROCESS: loop number 26 T-loop= 940.00000000000000
main_MD> interactions number 26 at Temperature= 940.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.29171 -2.32919 -0.10258
force_rgl> df(natom) 0.36895 0.97997 0.03218
6255.0000 -93.55884 -89.23991 4.31894 2.40286 -89.89600 829.71751
6260.0000 -93.62878 -88.98697 4.64182 2.50866 -88.65851 965.71612
6265.0000 -93.28858 -88.92820 4.36038 2.49339 -88.83719 947.20159
6270.0000 -94.70495 -89.18925 5.51570 2.49323 -88.83899 961.43527
6275.0000 -93.68388 -89.49722 4.18666 2.47040 -89.10608 932.93599
6280.0000 -93.33525 -88.58077 4.75448 2.50011 -88.75853 964.15303
6285.0000 -94.43803 -89.50942 4.92861 2.51228 -88.61618 1023.87179
6290.0000 -94.68237 -90.50761 4.17475 2.37941 -90.17022 893.06630
6295.0000 -93.09751 -88.06358 5.03394 2.46072 -89.21929 928.68191
6300.0000 -92.55929 -87.72253 4.83676 2.56307 -88.02216 1025.48095
6305.0000 -93.21303 -88.61784 4.59519 2.57753 -87.85300 949.48002
6310.0000 -91.60771 -87.48376 4.12396 2.55282 -88.14199 988.65359
6315.0000 -93.70532 -89.73564 3.96968 2.48343 -88.95363 912.69895
6320.0000 -93.46896 -89.34977 4.11919 2.45628 -89.27115 885.99884
6325.0000 -94.21052 -89.76221 4.44831 2.45334 -89.30558 920.29094
6330.0000 -93.54944 -89.14859 4.40085 2.45144 -89.32779 925.97842
6335.0000 -93.41421 -89.36775 4.04646 2.47538 -89.04778 946.67337
6340.0000 -95.00620 -90.14331 4.86289 2.43508 -89.51908 967.23521
6345.0000 -92.39294 -87.87173 4.52122 2.46644 -89.15232 914.56200
6350.0000 -93.18790 -88.19912 4.98877 2.63747 -87.15196 1095.72146
6355.0000 -94.26120 -89.52062 4.74057 2.44431 -89.41116 915.34464
6360.0000 -93.96205 -89.13629 4.82576 2.46465 -89.17327 917.05376
6365.0000 -95.31060 -91.14518 4.16542 2.45545 -89.28089 893.36978
6370.0000 -93.89367 -90.15731 3.73636 2.32145 -90.84813 797.76946
6375.0000 -95.90820 -91.24023 4.66797 2.31029 -90.97869 773.80334
6380.0000 -94.82271 -89.83903 4.98368 2.36704 -90.31493 867.25839
6385.0000 -93.25529 -89.16986 4.08542 2.42477 -89.63977 915.04602
6390.0000 -94.48905 -89.26939 5.21966 2.47435 -89.05984 963.16769
6395.0000 -93.79710 -88.16449 5.63261 2.54455 -88.23880 946.95114
6400.0000 -92.63974 -87.30141 5.33833 2.53896 -88.30416 998.14768
6405.0000 -93.10278 -86.90796 6.19482 2.64259 -87.09204 1097.66802
6410.0000 -93.87261 -89.17800 4.69462 2.51729 -88.55762 955.89542
6415.0000 -94.67178 -89.50124 5.17054 2.46398 -89.18110 943.54017
6420.0000 -93.78516 -89.57113 4.21403 2.45211 -89.31992 933.36697
6425.0000 -93.64446 -88.69467 4.94979 2.47242 -89.08236 937.54735
6430.0000 -94.06674 -88.61303 5.45371 2.47745 -89.02352 949.04016
6435.0000 -93.69371 -88.52673 5.16698 2.55362 -88.13265 1007.21289
6440.0000 -94.71257 -89.98598 4.72660 2.47245 -89.08202 959.00190
6445.0000 -93.70159 -88.66096 5.04064 2.42493 -89.63789 900.89360
6450.0000 -93.64785 -88.03154 5.61631 2.52068 -88.51799 985.63443
6455.0000 -94.47038 -88.05491 6.41547 2.55863 -88.07412 1033.65353
6460.0000 -94.19556 -90.11504 4.08052 2.45327 -89.30640 963.19617
6465.0000 -93.89872 -89.57189 4.32683 2.42648 -89.61976 888.04782
6470.0000 -93.52395 -87.81089 5.71306 2.44870 -89.35984 924.19303
6475.0000 -94.29712 -89.28925 5.00786 2.53289 -88.37517 980.89348
6480.0000 -93.41777 -88.78414 4.63363 2.48772 -88.90349 906.03494
6485.0000 -91.88462 -87.60640 4.27822 2.55493 -88.11731 989.13713
6490.0000 -94.74055 -88.99274 5.74780 2.54902 -88.18653 1006.33637
6495.0000 -94.90289 -89.98643 4.91647 2.43050 -89.57269 894.47683
6500.0000 -95.08802 -90.61585 4.47217 2.38232 -90.13626 862.50309
MELTING PROCESS: loop number 27 T-loop= 965.00000000000000
main_MD> interactions number 27 at Temperature= 965.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.20170 5.91445 -0.51422
force_rgl> df(natom) -0.66553 2.00635 -4.38016
6505.0000 -95.08860 -89.93237 5.15623 2.38039 -90.15875 864.07065
6510.0000 -94.09281 -89.16343 4.92939 2.48596 -88.92408 946.97424
6515.0000 -93.78530 -88.98207 4.80323 2.50644 -88.68450 970.93070
6520.0000 -93.37419 -88.42571 4.94848 2.53577 -88.34144 966.29168
6525.0000 -92.16408 -87.52492 4.63916 2.57808 -87.84664 946.10029
6530.0000 -91.97696 -86.45169 5.52528 2.63786 -87.14736 1041.60723
6535.0000 -94.99733 -89.67323 5.32411 2.57384 -87.89623 1037.17723
6540.0000 -93.36046 -89.26051 4.09995 2.48706 -88.91121 937.15088
6545.0000 -92.67565 -87.35366 5.32198 2.60089 -87.57981 1038.36358
6550.0000 -92.30477 -88.01829 4.28648 2.59341 -87.66731 1053.30494
6555.0000 -93.43256 -88.36737 5.06518 2.53256 -88.37905 968.03620
6560.0000 -93.77792 -88.98537 4.79256 2.49211 -88.85213 950.68617
6565.0000 -93.94752 -89.18720 4.76032 2.46695 -89.14638 937.10696
6570.0000 -93.75368 -88.98084 4.77284 2.47127 -89.09587 924.11720
6575.0000 -94.30479 -89.55165 4.75314 2.45240 -89.31660 903.47421
6580.0000 -93.38142 -89.51219 3.86923 2.45074 -89.33599 914.94606
6585.0000 -94.69639 -89.38700 5.30939 2.45399 -89.29800 941.66411
6590.0000 -94.83980 -89.79096 5.04884 2.42804 -89.60144 925.39765
6595.0000 -93.09904 -88.79655 4.30250 2.45799 -89.25116 905.17563
6600.0000 -94.21087 -87.76637 6.44450 2.54414 -88.24353 987.81528
6605.0000 -94.44840 -88.41031 6.03809 2.56825 -87.96152 1051.47353
6610.0000 -94.44077 -90.11040 4.33038 2.42969 -89.58217 908.06944
6615.0000 -93.64256 -89.43888 4.20369 2.41252 -89.78300 899.18209
6620.0000 -93.60984 -88.89687 4.71297 2.46105 -89.21537 953.82806
6625.0000 -93.57751 -89.08815 4.48936 2.52161 -88.50707 1001.75997
6630.0000 -94.46809 -89.19887 5.26922 2.50631 -88.68603 957.49297
6635.0000 -93.85800 -89.27072 4.58727 2.49053 -88.87058 947.79477
6640.0000 -93.27252 -88.36563 4.90689 2.51163 -88.62384 979.69201
6645.0000 -92.87932 -87.84504 5.03428 2.53563 -88.34305 963.42408
6650.0000 -94.55711 -89.32628 5.23083 2.53278 -88.37638 1035.60310
6655.0000 -94.73164 -89.05314 5.67850 2.46570 -89.16102 971.33353
6660.0000 -93.97759 -88.87203 5.10555 2.44806 -89.36728 931.20605
6665.0000 -93.77928 -88.45591 5.32337 2.54037 -88.28764 995.24155
6670.0000 -93.82610 -88.55696 5.26914 2.52107 -88.51341 994.56190
6675.0000 -93.31989 -88.91772 4.40217 2.54107 -88.27942 1001.75926
6680.0000 -93.64259 -89.03586 4.60672 2.52414 -88.47751 948.79597
6685.0000 -93.94339 -89.13674 4.80666 2.46600 -89.15749 942.56932
6690.0000 -93.76209 -88.66723 5.09486 2.45145 -89.32765 896.35144
6695.0000 -94.40311 -88.87950 5.52361 2.53655 -88.33231 992.81683
6700.0000 -94.23407 -89.85798 4.37609 2.40453 -89.87640 923.83448
6705.0000 -94.68660 -89.68040 5.00621 2.41924 -89.70438 898.03853
6710.0000 -94.02327 -88.98814 5.03513 2.44377 -89.41755 895.69551
6715.0000 -93.92583 -88.01552 5.91031 2.51408 -88.59516 969.57347
6720.0000 -93.25064 -87.26445 5.98619 2.64147 -87.10515 1064.34854
6725.0000 -92.50804 -87.50384 5.00420 2.56028 -88.05481 965.59710
6730.0000 -93.67025 -89.05268 4.61757 2.49901 -88.77140 948.67429
6735.0000 -95.91057 -90.60784 5.30273 2.35678 -90.43491 841.97412
6740.0000 -93.96289 -90.09021 3.87268 2.35898 -90.40921 824.61676
6745.0000 -94.81328 -90.28798 4.52531 2.33598 -90.67827 814.19697
6750.0000 -93.00374 -87.94874 5.05500 2.45136 -89.32872 870.40819
MELTING PROCESS: loop number 28 T-loop= 990.00000000000000
main_MD> interactions number 28 at Temperature= 990.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.52976 -1.58483 -2.26668
force_rgl> df(natom) -0.03151 -0.03140 2.01252
6755.0000 -93.07986 -88.11826 4.96159 2.58309 -87.78799 1054.30147
6760.0000 -91.77433 -86.66391 5.11042 2.64547 -87.05845 1048.65135
6765.0000 -91.93194 -87.53566 4.39628 2.67766 -86.68193 1053.81673
6770.0000 -92.45178 -86.79279 5.65900 2.62193 -87.33373 1042.11470
6775.0000 -94.03345 -88.41074 5.62271 2.59845 -87.60836 1018.34679
6780.0000 -93.45532 -88.60348 4.85184 2.47797 -89.01749 972.81525
6785.0000 -93.21100 -88.85208 4.35891 2.49297 -88.84203 897.57157
6790.0000 -93.74364 -89.54807 4.19557 2.49418 -88.82795 966.69718
6795.0000 -93.94835 -88.18311 5.76524 2.44894 -89.35703 914.26116
6800.0000 -93.13585 -88.13001 5.00584 2.55972 -88.06133 1000.84272
6805.0000 -92.80119 -87.83755 4.96364 2.57560 -87.87563 1038.12344
6810.0000 -93.16073 -86.88399 6.27674 2.61898 -87.36817 1049.29801
6815.0000 -91.79591 -86.18907 5.60684 2.72777 -86.09586 1111.10595
6820.0000 -91.67310 -87.02089 4.65220 2.66226 -86.86202 1068.58324
6825.0000 -93.71523 -88.85671 4.85852 2.61683 -87.39342 1033.96164
6830.0000 -92.80989 -86.74409 6.06580 2.62478 -87.30042 1098.93921
6835.0000 -92.69173 -87.19162 5.50012 2.65157 -86.98707 1090.96669
6840.0000 -93.41077 -87.85348 5.55729 2.55745 -88.08788 1012.64257
6845.0000 -93.89801 -88.81397 5.08403 2.57704 -87.85872 1028.01739
6850.0000 -92.73166 -87.17792 5.55374 2.53927 -88.30047 970.83820
6855.0000 -92.31682 -87.22766 5.08917 2.63387 -87.19402 1039.39912
6860.0000 -93.85720 -88.82369 5.03351 2.58506 -87.76490 987.38549
6865.0000 -93.77776 -88.37953 5.39823 2.54699 -88.21025 965.09414
6870.0000 -94.45852 -88.57179 5.88673 2.49915 -88.76977 980.19446
6875.0000 -94.34910 -89.78162 4.56748 2.49529 -88.81489 979.99092
6880.0000 -93.13165 -87.09166 6.03999 2.54399 -88.24536 1035.34185
6885.0000 -94.14320 -88.49876 5.64444 2.63709 -87.15640 1067.96235
6890.0000 -92.64872 -88.41272 4.23600 2.49644 -88.80149 918.23646
6895.0000 -92.30832 -87.56675 4.74157 2.54314 -88.25522 1005.61438
6900.0000 -92.72573 -88.85756 3.86817 2.56691 -87.97725 968.20670
6905.0000 -95.54580 -90.67343 4.87237 2.41377 -89.76841 905.29705
6910.0000 -93.84609 -89.53587 4.31022 2.44869 -89.35995 927.85450
6915.0000 -95.13989 -89.94542 5.19447 2.44754 -89.37335 907.50803
6920.0000 -94.09191 -89.50979 4.58212 2.43184 -89.55708 901.17604
6925.0000 -93.15249 -88.06764 5.08485 2.48519 -88.93309 924.39387
6930.0000 -93.46420 -88.17041 5.29379 2.56999 -87.94121 1016.53591
6935.0000 -92.06543 -86.35794 5.70749 2.60684 -87.51016 994.34487
6940.0000 -90.46935 -84.51827 5.95108 2.73797 -85.97646 1122.97359
6945.0000 -92.32306 -86.80895 5.51411 2.69943 -86.42723 1116.06346
6950.0000 -94.04384 -87.75728 6.28656 2.63968 -87.12616 1081.84911
6955.0000 -91.81346 -86.28989 5.52358 2.62032 -87.35254 1050.52205
6960.0000 -93.10058 -88.24690 4.85368 2.62003 -87.35589 1031.32397
6965.0000 -93.46295 -87.73578 5.72717 2.58029 -87.82078 1041.25628
6970.0000 -92.45251 -88.82557 3.62694 2.53825 -88.31244 966.44453
6975.0000 -92.68783 -86.59714 6.09069 2.58653 -87.74779 1046.83750
6980.0000 -91.16739 -86.55929 4.60810 2.65084 -86.99554 1067.04886
6985.0000 -91.80198 -86.69026 5.11173 2.63637 -87.16487 1071.71921
6990.0000 -92.73433 -87.26182 5.47251 2.66376 -86.84451 1122.58002
6995.0000 -93.66173 -87.95814 5.70359 2.55587 -88.10636 1014.44674
7000.0000 -94.11406 -88.49949 5.61457 2.53848 -88.30979 968.11481
MELTING PROCESS: loop number 29 T-loop= 1015.0000000000000
main_MD> interactions number 29 at Temperature= 1015.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.83958 0.83461 -2.20234
force_rgl> df(natom) -0.86163 2.00272 -5.33616
7005.0000 -93.59781 -88.56853 5.02929 2.49423 -88.82736 966.69867
7010.0000 -93.20083 -87.22667 5.97416 2.57396 -87.89483 1011.33469
7015.0000 -94.07105 -88.32634 5.74471 2.50716 -88.67612 981.34960
7020.0000 -94.20366 -90.08806 4.11560 2.47022 -89.10819 964.73987
7025.0000 -93.52769 -88.85360 4.67409 2.41121 -89.79827 899.89451
7030.0000 -94.12777 -88.87452 5.25324 2.46402 -89.18069 944.05134
7035.0000 -92.81652 -88.08429 4.73223 2.53654 -88.33249 1013.24198
7040.0000 -94.45712 -88.19520 6.26192 2.55089 -88.16458 992.47917
7045.0000 -94.68721 -88.57512 6.11209 2.51941 -88.53285 1001.09681
7050.0000 -95.01089 -90.59029 4.42060 2.43769 -89.48856 870.93249
7055.0000 -93.80917 -89.83272 3.97644 2.34850 -90.53174 827.50103
7060.0000 -91.51871 -86.17312 5.34559 2.59898 -87.60213 1046.62823
7065.0000 -93.75525 -87.79075 5.96450 2.61590 -87.40431 1061.71642
7070.0000 -94.15574 -88.74501 5.41073 2.52949 -88.41493 1005.30300
7075.0000 -94.55471 -89.26464 5.29007 2.46732 -89.14206 937.07031
7080.0000 -93.66970 -88.30215 5.36756 2.57570 -87.87443 1008.27027
7085.0000 -92.93344 -87.00971 5.92374 2.61001 -87.47311 1021.55261
7090.0000 -92.53881 -87.77906 4.75975 2.58485 -87.76740 1039.65132
7095.0000 -92.77239 -88.38243 4.38996 2.58514 -87.76405 1009.29730
7100.0000 -93.66930 -87.48032 6.18899 2.58341 -87.78429 1050.31630
7105.0000 -93.94068 -89.54065 4.40003 2.54609 -88.22078 986.10149
7110.0000 -94.63137 -90.19430 4.43707 2.41792 -89.71981 885.67361
7115.0000 -94.13058 -87.97337 6.15721 2.47709 -89.02783 939.95397
7120.0000 -92.84326 -88.10470 4.73856 2.51385 -88.59778 962.74804
7125.0000 -93.34572 -87.85448 5.49125 2.57624 -87.86816 1015.61357
7130.0000 -92.21836 -87.59685 4.62151 2.57685 -87.86103 1054.95877
7135.0000 -93.44473 -88.41155 5.03318 2.54399 -88.24533 992.99478
7140.0000 -93.52547 -87.30270 6.22277 2.55125 -88.16042 1020.71179
7145.0000 -92.50887 -87.16801 5.34086 2.59187 -87.68529 1020.52730
7150.0000 -93.24441 -88.07509 5.16932 2.63689 -87.15873 1095.84930
7155.0000 -94.57768 -89.48484 5.09284 2.51818 -88.54723 947.89055
7160.0000 -93.90262 -89.36060 4.54202 2.39696 -89.96499 850.00669
7165.0000 -93.44603 -88.74575 4.70028 2.47695 -89.02937 928.65799
7170.0000 -92.40644 -87.68952 4.71691 2.54491 -88.23456 1000.84510
7175.0000 -93.72700 -88.90755 4.81945 2.53392 -88.36310 992.50941
7180.0000 -93.09434 -87.90332 5.19102 2.56392 -88.01224 1001.53854
7185.0000 -94.03014 -87.36167 6.66847 2.58104 -87.81200 1022.43027
7190.0000 -91.81823 -86.94518 4.87305 2.57803 -87.84722 985.02672
7195.0000 -92.96161 -87.32910 5.63250 2.62894 -87.25173 1048.28840
7200.0000 -94.62519 -90.22454 4.40065 2.49465 -88.82236 958.57803
7205.0000 -94.89609 -90.77581 4.12028 2.32732 -90.77952 814.10237
7210.0000 -95.06522 -91.34603 3.71919 2.34183 -90.60977 893.14107
7215.0000 -96.13903 -91.66960 4.46943 2.25128 -91.66891 777.87034
7220.0000 -93.28466 -88.92227 4.36239 2.41528 -89.75071 905.81302
7225.0000 -92.84359 -88.69493 4.14866 2.48950 -88.88261 938.88537
7230.0000 -92.48063 -86.93532 5.54532 2.50738 -88.67347 924.87584
7235.0000 -93.27358 -87.35677 5.91682 2.64039 -87.11776 1063.01973
7240.0000 -93.48319 -87.12790 6.35529 2.65154 -86.98741 1041.04925
7245.0000 -93.08181 -88.01309 5.06872 2.62134 -87.34063 1065.30871
7250.0000 -93.57296 -87.45050 6.12246 2.54475 -88.23638 1011.77594
MELTING PROCESS: loop number 30 T-loop= 1040.0000000000000
main_MD> interactions number 30 at Temperature= 1040.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 5.04977 -0.15549 1.67314
force_rgl> df(natom) 1.13285 0.94553 -0.65702
7255.0000 -91.44278 -86.31013 5.13264 2.62638 -87.28173 1028.18791
7260.0000 -93.45853 -87.72942 5.72911 2.61474 -87.41777 997.02251
7265.0000 -93.03612 -86.48568 6.55044 2.64918 -87.01504 1131.33451
7270.0000 -91.63699 -85.87980 5.75718 2.67922 -86.66366 1098.99410
7275.0000 -91.89516 -86.46253 5.43263 2.76094 -85.70791 1144.68155
7280.0000 -92.08584 -87.83275 4.25310 2.63556 -87.17428 1063.13058
7285.0000 -92.79361 -86.76015 6.03346 2.62077 -87.34727 1044.60305
7290.0000 -92.73479 -86.03054 6.70425 2.69579 -86.46986 1100.31471
7295.0000 -94.51432 -89.00658 5.50773 2.64640 -87.04750 1067.34306
7300.0000 -92.87516 -87.15961 5.71555 2.53730 -88.32361 1009.49128
7305.0000 -93.81825 -86.92629 6.89196 2.52013 -88.52443 952.34542
7310.0000 -92.98780 -87.36027 5.62753 2.67767 -86.68176 1087.44252
7315.0000 -93.67486 -89.27318 4.40168 2.58255 -87.79426 978.77867
7320.0000 -93.91176 -88.29067 5.62109 2.54839 -88.19388 1015.18760
7325.0000 -92.74094 -87.91391 4.82703 2.63193 -87.21674 1076.48172
7330.0000 -94.15946 -88.91552 5.24395 2.54224 -88.26577 984.14096
7335.0000 -93.72909 -89.41124 4.31784 2.46288 -89.19394 947.27706
7340.0000 -92.86816 -87.48224 5.38592 2.60558 -87.52499 1039.88288
7345.0000 -92.87719 -88.12483 4.75236 2.60454 -87.53716 1062.49537
7350.0000 -92.36692 -86.47586 5.89106 2.54300 -88.25686 989.85560
7355.0000 -93.42238 -87.25650 6.16587 2.65734 -86.91954 1093.52024
7360.0000 -93.81979 -88.11722 5.70257 2.55428 -88.12491 1029.29801
7365.0000 -90.58656 -85.55441 5.03215 2.69991 -86.42162 1106.46606
7370.0000 -91.52662 -86.95709 4.56953 2.72337 -86.14726 1122.66048
7375.0000 -92.13952 -87.13366 5.00586 2.68046 -86.64917 1139.46582
7380.0000 -91.85493 -87.07128 4.78365 2.62237 -87.32861 1053.67935
7385.0000 -92.07148 -86.62452 5.44696 2.61442 -87.42156 1078.42049
7390.0000 -93.20762 -86.65103 6.55659 2.67766 -86.68194 1129.54543
7395.0000 -92.29284 -86.93699 5.35585 2.69146 -86.52048 1102.27636
7400.0000 -93.34125 -88.20393 5.13733 2.59654 -87.63074 1006.14603
7405.0000 -91.37172 -85.94902 5.42270 2.66226 -86.86201 1063.52685
7410.0000 -93.03173 -87.10222 5.92951 2.62697 -87.27472 1078.40227
7415.0000 -93.62422 -87.79908 5.82514 2.55749 -88.08740 1009.62583
7420.0000 -93.19371 -86.28958 6.90413 2.71617 -86.23152 1135.44198
7425.0000 -91.89402 -85.84764 6.04638 2.70089 -86.41022 1118.62276
7430.0000 -92.97051 -88.28059 4.68992 2.67217 -86.74616 1127.44496
7435.0000 -94.10604 -88.70297 5.40306 2.48064 -88.98628 929.26815
7440.0000 -92.02671 -88.07130 3.95541 2.52982 -88.41104 960.38796
7445.0000 -93.40816 -86.97603 6.43213 2.65355 -86.96388 1103.12270
7450.0000 -91.88802 -86.77710 5.11092 2.64239 -87.09445 1048.33300
7455.0000 -92.21594 -86.73117 5.48476 2.63955 -87.12768 1035.56088
7460.0000 -92.51766 -87.58007 4.93760 2.60296 -87.55557 1038.73645
7465.0000 -93.55236 -88.60687 4.94548 2.54162 -88.27301 998.62601
7470.0000 -93.23866 -88.73765 4.50100 2.53054 -88.40257 1001.24404
7475.0000 -92.83036 -87.94151 4.88886 2.55466 -88.12052 1005.01377
7480.0000 -91.03251 -85.62246 5.41005 2.67349 -86.73067 1082.64778
7485.0000 -92.47075 -85.83504 6.63571 2.76868 -85.61738 1231.67768
7490.0000 -93.82772 -88.51613 5.31158 2.63178 -87.21855 1073.72016
7495.0000 -91.94065 -86.69401 5.24664 2.54318 -88.25477 1015.16917
7500.0000 -92.17582 -86.73382 5.44200 2.68588 -86.58581 1090.77828
MELTING PROCESS: loop number 31 T-loop= 1065.0000000000000
main_MD> interactions number 31 at Temperature= 1065.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.86968 2.10434 -2.44901
force_rgl> df(natom) -3.34948 -2.69034 -2.02009
7505.0000 -91.49149 -86.29848 5.19301 2.72503 -86.12787 1145.09513
7510.0000 -91.70340 -87.08188 4.62152 2.72539 -86.12368 1111.46218
7515.0000 -91.88833 -85.84198 6.04635 2.65896 -86.90066 1120.15600
7520.0000 -94.15690 -89.16206 4.99484 2.60356 -87.54863 1068.85445
7525.0000 -93.21566 -87.14648 6.06918 2.54916 -88.18486 1000.67163
7530.0000 -92.50145 -87.33025 5.17120 2.64183 -87.10099 1047.98873
7535.0000 -92.19744 -86.87331 5.32413 2.67575 -86.70428 1110.98398
7540.0000 -93.19118 -88.06006 5.13112 2.66803 -86.79450 1067.21276
7545.0000 -92.03491 -87.30739 4.72752 2.62113 -87.34312 1038.71673
7550.0000 -92.63071 -86.97897 5.65174 2.65502 -86.94667 1082.60140
7555.0000 -93.97789 -88.47634 5.50155 2.59331 -87.66848 1032.90719
7560.0000 -92.31816 -87.07220 5.24596 2.61616 -87.40123 1056.08664
7565.0000 -93.17924 -86.71458 6.46466 2.61186 -87.45149 1082.65638
7570.0000 -92.34110 -87.57313 4.76797 2.67374 -86.72780 1104.72017
7575.0000 -92.66887 -86.91308 5.75578 2.68745 -86.56736 1105.92095
7580.0000 -92.14043 -86.35554 5.78489 2.74700 -85.87094 1198.16558
7585.0000 -90.88023 -85.12861 5.75162 2.74989 -85.83710 1134.09549
7590.0000 -91.08590 -86.50975 4.57616 2.73727 -85.98473 1155.11161
7595.0000 -92.68497 -85.79281 6.89216 2.64757 -87.03384 1073.32499
7600.0000 -92.30608 -87.28811 5.01797 2.69489 -86.48038 1085.31155
7605.0000 -92.19032 -85.58395 6.60638 2.72195 -86.16383 1133.24011
7610.0000 -91.37878 -85.72016 5.65862 2.73685 -85.98955 1192.09139
7615.0000 -92.13636 -85.70967 6.42669 2.79217 -85.34254 1228.60719
7620.0000 -93.51532 -88.23232 5.28300 2.66593 -86.81912 1087.37182
7625.0000 -92.90489 -88.09560 4.80928 2.53853 -88.30923 1001.60233
7630.0000 -92.38744 -86.95724 5.43019 2.61609 -87.40208 1052.74266
7635.0000 -92.71141 -86.47705 6.23436 2.77389 -85.55633 1169.53789
7640.0000 -90.88244 -84.12879 6.75365 2.72723 -86.10215 1142.86418
7645.0000 -92.68374 -88.64050 4.04324 2.67644 -86.69617 1079.00179
7650.0000 -91.68472 -85.55526 6.12946 2.64622 -87.04957 1064.66861
7655.0000 -91.05356 -85.27263 5.78093 2.75028 -85.83248 1158.43083
7660.0000 -91.78216 -84.69659 7.08556 2.80572 -85.18410 1216.11816
7665.0000 -92.71671 -86.84938 5.86733 2.69732 -86.45192 1101.18519
7670.0000 -92.69772 -86.78777 5.90995 2.66126 -86.87377 1047.99336
7675.0000 -91.98930 -86.74413 5.24517 2.68752 -86.56658 1150.76322
7680.0000 -90.45552 -84.80324 5.65229 2.71836 -86.20588 1123.50515
7685.0000 -92.30550 -87.19881 5.10669 2.73986 -85.95437 1173.59879
7690.0000 -93.69394 -87.43681 6.25713 2.69100 -86.52583 1110.40037
7695.0000 -93.29669 -87.38417 5.91253 2.58537 -87.76137 1063.93004
7700.0000 -94.35514 -88.62584 5.72930 2.57287 -87.90750 1057.67767
7705.0000 -92.58014 -86.80668 5.77346 2.58642 -87.74907 1066.80082
7710.0000 -93.49247 -88.55972 4.93274 2.67470 -86.71647 1119.71188
7715.0000 -94.02001 -88.74021 5.27980 2.50716 -88.67608 959.15359
7720.0000 -93.37460 -88.71221 4.66239 2.49643 -88.80159 956.45407
7725.0000 -93.18507 -88.18155 5.00353 2.53876 -88.30652 990.34033
7730.0000 -93.26929 -87.26434 6.00495 2.57046 -87.93573 1006.78334
7735.0000 -93.14205 -85.71224 7.42981 2.70013 -86.41912 1152.80512
7740.0000 -91.35795 -86.08163 5.27632 2.73371 -86.02636 1134.17978
7745.0000 -93.67224 -88.20748 5.46476 2.63280 -87.20659 1066.90876
7750.0000 -92.44992 -86.21393 6.23599 2.61803 -87.37936 1116.46901
MELTING PROCESS: loop number 32 T-loop= 1090.0000000000000
main_MD> interactions number 32 at Temperature= 1090.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.71080 11.23133 -1.15114
force_rgl> df(natom) 0.85276 1.11811 -1.87958
7755.0000 -93.13975 -87.34045 5.79930 2.67908 -86.66532 1097.85729
7760.0000 -91.99197 -85.17077 6.82120 2.72611 -86.11524 1187.93999
7765.0000 -92.75177 -87.25269 5.49908 2.73737 -85.98348 1096.68762
7770.0000 -92.53398 -87.23345 5.30052 2.64364 -87.07980 1090.21245
7775.0000 -93.51710 -87.47707 6.04003 2.61882 -87.37008 1097.11591
7780.0000 -92.58299 -87.02258 5.56041 2.58868 -87.72267 1047.09496
7785.0000 -92.04437 -85.69376 6.35061 2.77622 -85.52916 1209.92685
7790.0000 -90.99885 -86.57805 4.42080 2.77077 -85.59282 1151.40266
7795.0000 -92.21217 -88.11803 4.09414 2.68064 -86.64706 1116.53608
7800.0000 -93.15143 -87.27924 5.87220 2.60989 -87.47457 1089.80414
7805.0000 -93.20614 -88.02985 5.17630 2.54183 -88.27062 1006.45926
7810.0000 -93.17042 -87.01678 6.15364 2.56458 -88.00450 1024.32895
7815.0000 -94.31844 -89.49370 4.82474 2.54225 -88.26564 1009.05732
7820.0000 -92.30907 -86.84445 5.46463 2.52940 -88.41599 944.76193
7825.0000 -92.23648 -87.45188 4.78460 2.66850 -86.78898 1104.85992
7830.0000 -93.56379 -87.03427 6.52952 2.57521 -87.88012 1035.85776
7835.0000 -93.33922 -87.11390 6.22532 2.66636 -86.81411 1079.82884
7840.0000 -92.20873 -85.88431 6.32442 2.71134 -86.28803 1136.54593
7845.0000 -92.82637 -87.40089 5.42549 2.69477 -86.48178 1137.26967
7850.0000 -92.66449 -87.25647 5.40802 2.58832 -87.72683 1045.03726
7855.0000 -93.15138 -87.64313 5.50825 2.66116 -86.87490 1118.16002
7860.0000 -92.02335 -86.42621 5.59714 2.60162 -87.57127 1051.18637
7865.0000 -93.14375 -88.65455 4.48920 2.59528 -87.64539 1073.85424
7870.0000 -91.08278 -86.30520 4.77757 2.55385 -88.12993 1009.79930
7875.0000 -91.85911 -87.30501 4.55411 2.67376 -86.72746 1100.00194
7880.0000 -92.08266 -86.45158 5.63108 2.70855 -86.32059 1124.92492
7885.0000 -91.66337 -85.98400 5.67937 2.72541 -86.12341 1174.80088
7890.0000 -92.94689 -87.19952 5.74737 2.68967 -86.54145 1101.17938
7895.0000 -92.83702 -85.63246 7.20456 2.74600 -85.88254 1175.41316
7900.0000 -91.93966 -85.83038 6.10928 2.78048 -85.47934 1212.07167
7905.0000 -91.78567 -86.15438 5.63129 2.73242 -86.04144 1124.91355
7910.0000 -93.47855 -88.84716 4.63138 2.62712 -87.27305 1018.21197
7915.0000 -92.53748 -86.66346 5.87402 2.58340 -87.78439 1028.63872
7920.0000 -93.19197 -87.35793 5.83404 2.73007 -86.06887 1182.27708
7925.0000 -92.78682 -87.63437 5.15245 2.58581 -87.75614 1045.21806
7930.0000 -91.62190 -86.24707 5.37483 2.62055 -87.34986 1085.88961
7935.0000 -92.90760 -87.50283 5.40477 2.66190 -86.86622 1074.78154
7940.0000 -93.11462 -87.51084 5.60378 2.66818 -86.79280 1108.79618
7945.0000 -92.73865 -87.44392 5.29473 2.58811 -87.72932 1023.46671
7950.0000 -93.60944 -86.62886 6.98058 2.61940 -87.36329 1044.06503
7955.0000 -92.04204 -86.34454 5.69750 2.72520 -86.12584 1100.47254
7960.0000 -91.88645 -85.30939 6.57707 2.59871 -87.60530 1001.21070
7965.0000 -92.13470 -86.98461 5.15009 2.72094 -86.17570 1156.15752
7970.0000 -91.91009 -86.21145 5.69864 2.67683 -86.69164 1092.38671
7975.0000 -92.36625 -86.12746 6.23879 2.69607 -86.46653 1076.90488
7980.0000 -92.48400 -86.94092 5.54309 2.64537 -87.05958 1088.44675
7985.0000 -92.06407 -85.96398 6.10010 2.67176 -86.75085 1119.26491
7990.0000 -91.07522 -85.51690 5.55832 2.70428 -86.37050 1134.86995
7995.0000 -91.83773 -84.19970 7.63803 2.85429 -84.61601 1262.07303
8000.0000 -90.93439 -84.37646 6.55793 2.92595 -83.77786 1304.72509
MELTING PROCESS: loop number 33 T-loop= 1115.0000000000000
main_MD> interactions number 33 at Temperature= 1115.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.80657 2.39744 1.54021
force_rgl> df(natom) -0.32943 2.06646 0.10918
8005.0000 -91.64293 -86.43067 5.21226 2.74072 -85.94436 1130.91554
8010.0000 -93.09669 -87.35968 5.73701 2.61124 -87.45874 1056.53920
8015.0000 -93.64123 -88.23955 5.40167 2.53278 -88.37644 968.37959
8020.0000 -93.95360 -87.21318 6.74042 2.58000 -87.82414 1051.55681
8025.0000 -91.80070 -85.43967 6.36103 2.67600 -86.70133 1054.26805
8030.0000 -90.96680 -83.68734 7.27945 2.92298 -83.81257 1306.80572
8035.0000 -89.65159 -83.73403 5.91756 2.93080 -83.72117 1328.04170
8040.0000 -90.45043 -84.57706 5.87338 2.84888 -84.67925 1219.31326
8045.0000 -92.05397 -86.10814 5.94583 2.78654 -85.40841 1234.00676
8050.0000 -92.46282 -85.71197 6.75086 2.73334 -86.03064 1115.37345
8055.0000 -93.29557 -87.48864 5.80693 2.71480 -86.24748 1111.88638
8060.0000 -92.20588 -87.18095 5.02493 2.59701 -87.62515 1015.15965
8065.0000 -93.13429 -87.62321 5.51108 2.61698 -87.39158 1058.10800
8070.0000 -92.77465 -86.65812 6.11653 2.72023 -86.18395 1102.46842
8075.0000 -91.91914 -84.94252 6.97662 2.69769 -86.44764 1149.52704
8080.0000 -92.25666 -86.13449 6.12217 2.85293 -84.63195 1280.23233
8085.0000 -93.66090 -88.35095 5.30995 2.57655 -87.86454 1006.67381
8090.0000 -93.69155 -88.73492 4.95663 2.62332 -87.31745 1087.01107
8095.0000 -93.50656 -88.21089 5.29567 2.52789 -88.43361 1014.03313
8100.0000 -92.91850 -87.46751 5.45099 2.61369 -87.43015 1050.82816
8105.0000 -92.29048 -86.85739 5.43310 2.65306 -86.96967 1084.40967
8110.0000 -93.07038 -88.09526 4.97513 2.60218 -87.56476 1003.14320
8115.0000 -92.34389 -85.93576 6.40813 2.65046 -87.00000 1086.26289
8120.0000 -91.23097 -86.52268 4.70829 2.73665 -85.99197 1138.16222
8125.0000 -94.52828 -89.50138 5.02690 2.55177 -88.15436 964.52287
8130.0000 -92.48808 -88.06980 4.41827 2.48833 -88.89636 954.31452
8135.0000 -91.78920 -86.75222 5.03697 2.55928 -88.06652 1032.17957
8140.0000 -91.46312 -86.30026 5.16286 2.72457 -86.13319 1092.35346
8145.0000 -92.88732 -87.67883 5.20849 2.63873 -87.13721 1084.27362
8150.0000 -92.03617 -87.04907 4.98710 2.61767 -87.38359 1036.22731
8155.0000 -92.76350 -85.73865 7.02485 2.70516 -86.36031 1149.21835
8160.0000 -92.52979 -87.21779 5.31201 2.67214 -86.74647 1078.02132
8165.0000 -92.56680 -88.36062 4.20618 2.62569 -87.28978 1085.57080
8170.0000 -93.56005 -88.23756 5.32249 2.59597 -87.63731 997.65747
8175.0000 -93.85372 -88.76059 5.09313 2.52274 -88.49382 952.31481
8180.0000 -92.97985 -86.83742 6.14242 2.58258 -87.79397 1027.21106
8185.0000 -92.30266 -86.50934 5.79332 2.68060 -86.64747 1076.54403
8190.0000 -93.30749 -88.57270 4.73479 2.64792 -87.02977 1084.44768
8195.0000 -92.01715 -86.22238 5.79477 2.65635 -86.93114 1135.77475
8200.0000 -92.02641 -86.38226 5.64415 2.70769 -86.33071 1142.39510
8205.0000 -91.65487 -85.54654 6.10833 2.77216 -85.57658 1179.44959
8210.0000 -92.95155 -86.38637 6.56518 2.76426 -85.66907 1218.16972
8215.0000 -91.90695 -85.55169 6.35526 2.74111 -85.93973 1187.11856
8220.0000 -90.30545 -84.64529 5.66015 2.82790 -84.92470 1194.84951
8225.0000 -90.22291 -83.02906 7.19385 2.91673 -83.88577 1265.98850
8230.0000 -90.61301 -83.97863 6.63438 2.99604 -82.95809 1307.64861
8235.0000 -91.73975 -85.41245 6.32730 2.86751 -84.46142 1244.91099
8240.0000 -91.72392 -86.01791 5.70600 2.69015 -86.53577 1123.24978
8245.0000 -92.78179 -87.11439 5.66739 2.69372 -86.49406 1099.18105
8250.0000 -90.70936 -85.37725 5.33210 2.68769 -86.56456 1048.74623
MELTING PROCESS: loop number 34 T-loop= 1140.0000000000000
main_MD> interactions number 34 at Temperature= 1140.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.32843 -1.09285 1.96021
force_rgl> df(natom) -0.45297 2.47550 0.25383
8255.0000 -92.02020 -84.90013 7.12006 2.77026 -85.59881 1186.35095
8260.0000 -92.46096 -86.48638 5.97459 2.73477 -86.01393 1159.67528
8265.0000 -92.43580 -86.27546 6.16034 2.70289 -86.38677 1166.63574
8270.0000 -91.42788 -85.08384 6.34404 2.82406 -84.96962 1249.14676
8275.0000 -91.95655 -86.26550 5.69105 2.70351 -86.37952 1145.18081
8280.0000 -93.10848 -86.33778 6.77069 2.70565 -86.35456 1091.60270
8285.0000 -92.62444 -87.24000 5.38443 2.67380 -86.72702 1064.53557
8290.0000 -94.03006 -87.72756 6.30250 2.59814 -87.61198 1031.74852
8295.0000 -92.78591 -88.04140 4.74451 2.55750 -88.08735 1011.01402
8300.0000 -92.24093 -86.17909 6.06184 2.61772 -87.38299 1066.00443
8305.0000 -90.86258 -85.79011 5.07246 2.75334 -85.79672 1160.63768
8310.0000 -92.00200 -86.11336 5.88864 2.69409 -86.48969 1132.41492
8315.0000 -91.72599 -86.11074 5.61525 2.70602 -86.35014 1125.30323
8320.0000 -91.11795 -86.58745 4.53049 2.71625 -86.23058 1123.65296
8325.0000 -93.09980 -88.03258 5.06721 2.70089 -86.41015 1115.25000
8330.0000 -93.46649 -87.47812 5.98837 2.59743 -87.62024 1013.86202
8335.0000 -91.72917 -86.40675 5.32242 2.60877 -87.48769 1054.38582
8340.0000 -93.29897 -87.21067 6.08830 2.68874 -86.55232 1090.24992
8345.0000 -92.81002 -87.33024 5.47977 2.64242 -87.09403 1058.34838
8350.0000 -91.83628 -85.85900 5.97728 2.70259 -86.39032 1141.33088
8355.0000 -93.75796 -88.49493 5.26303 2.57661 -87.86378 1047.47097
8360.0000 -92.79338 -88.10946 4.68392 2.55781 -88.08368 1000.94311
8365.0000 -91.34779 -85.76352 5.58428 2.65039 -87.00088 1064.60048
8370.0000 -92.02166 -84.87024 7.15143 2.76928 -85.61027 1135.86859
8375.0000 -90.76485 -85.33157 5.43328 2.83555 -84.83525 1268.49604
8380.0000 -90.39748 -84.54736 5.85012 2.79317 -85.33088 1140.55456
8385.0000 -90.73307 -85.31593 5.41714 2.75039 -85.83124 1117.96581
8390.0000 -94.35586 -87.62526 6.73060 2.70420 -86.37149 1067.06136
8395.0000 -91.44048 -86.26520 5.17528 2.64710 -87.03935 1090.85391
8400.0000 -90.87909 -84.66514 6.21395 2.79659 -85.29085 1193.73317
8405.0000 -90.62022 -85.02858 5.59164 2.84114 -84.76978 1268.28332
8410.0000 -92.32209 -86.62365 5.69844 2.65777 -86.91451 1103.31905
8415.0000 -91.47011 -86.47565 4.99447 2.75565 -85.76970 1138.58259
8420.0000 -92.31522 -87.24330 5.07192 2.64454 -87.06926 1041.07911
8425.0000 -92.94545 -86.78876 6.15670 2.70497 -86.36246 1119.36807
8430.0000 -92.24587 -85.55334 6.69253 2.74141 -85.93631 1145.03075
8435.0000 -91.59510 -85.07242 6.52269 2.79464 -85.31365 1173.39460
8440.0000 -90.52207 -85.71546 4.80661 2.78042 -85.48006 1176.19463
8445.0000 -92.52038 -87.50987 5.01050 2.65721 -86.92103 1116.13717
8450.0000 -94.24224 -87.72757 6.51467 2.60498 -87.53199 1049.84970
8455.0000 -93.37705 -88.69322 4.68383 2.54516 -88.23158 995.17682
8460.0000 -92.40464 -87.09802 5.30662 2.63186 -87.21753 1045.17953
8465.0000 -92.80947 -87.26974 5.53973 2.61655 -87.39670 1074.84746
8470.0000 -92.09180 -85.93085 6.16095 2.65870 -86.90366 1092.79589
8475.0000 -93.16349 -86.72968 6.43381 2.70447 -86.36830 1087.46031
8480.0000 -91.24359 -86.40004 4.84354 2.70201 -86.39709 1120.35561
8485.0000 -92.11760 -86.89219 5.22541 2.60363 -87.54779 1036.86276
8490.0000 -93.46421 -87.49855 5.96567 2.61583 -87.40510 1024.06074
8495.0000 -92.52678 -86.20601 6.32076 2.63807 -87.14489 1058.44102
8500.0000 -93.39111 -87.63583 5.75529 2.66437 -86.83737 1109.39719
MELTING PROCESS: loop number 35 T-loop= 1165.0000000000000
main_MD> interactions number 35 at Temperature= 1165.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.99931 -1.15506 1.11554
force_rgl> df(natom) 1.21617 -0.11595 -1.71839
8505.0000 -91.97724 -86.38395 5.59329 2.66152 -86.87066 1101.80402
8510.0000 -90.27419 -85.13392 5.14027 2.74827 -85.85605 1157.50567
8515.0000 -92.63678 -86.04555 6.59123 2.75244 -85.80730 1205.92164
8520.0000 -91.21994 -84.58125 6.63868 2.77329 -85.56344 1247.47171
8525.0000 -91.25713 -86.36227 4.89486 2.71963 -86.19098 1141.91433
8530.0000 -91.60757 -85.31544 6.29213 2.75646 -85.76020 1129.11047
8535.0000 -92.76049 -87.00492 5.75557 2.73273 -86.03777 1120.14507
8540.0000 -90.76826 -84.26432 6.50394 2.81853 -85.03422 1223.86976
8545.0000 -92.36737 -87.49411 4.87326 2.78101 -85.47314 1185.57444
8550.0000 -91.79553 -86.00303 5.79249 2.68591 -86.58536 1063.99360
8555.0000 -93.36785 -87.25478 6.11306 2.72820 -86.09077 1161.74621
8560.0000 -91.56973 -84.85981 6.70991 2.69918 -86.43023 1118.37775
8565.0000 -90.91937 -84.85396 6.06541 2.78151 -85.46721 1219.53920
8570.0000 -91.09903 -84.32595 6.77308 2.86577 -84.48173 1283.62839
8575.0000 -92.27105 -84.74127 7.52978 2.85040 -84.66157 1215.51474
8580.0000 -92.52790 -84.99557 7.53233 2.83915 -84.79316 1234.53180
8585.0000 -90.18213 -85.01247 5.16966 2.79515 -85.30778 1155.97697
8590.0000 -92.19526 -86.01764 6.17762 2.69836 -86.43980 1099.23590
8595.0000 -91.32480 -86.56481 4.75999 2.68045 -86.64927 1132.67839
8600.0000 -93.80734 -87.71131 6.09603 2.68799 -86.56113 1107.66690
8605.0000 -93.10418 -87.84161 5.26258 2.62935 -87.24699 1079.01540
8610.0000 -92.72351 -87.06381 5.65970 2.63060 -87.23229 1147.00090
8615.0000 -91.42539 -85.52963 5.89576 2.76983 -85.60385 1210.63661
8620.0000 -90.88501 -84.78475 6.10026 2.90191 -84.05901 1294.84463
8625.0000 -90.26175 -84.24184 6.01991 2.81498 -85.07575 1226.20794
8630.0000 -91.05848 -84.38534 6.67314 2.91720 -83.88027 1256.16733
8635.0000 -91.34060 -85.20011 6.14050 2.85063 -84.65886 1263.45479
8640.0000 -91.01628 -86.35071 4.66556 2.70257 -86.39049 1153.62315
8645.0000 -90.79885 -84.00572 6.79313 2.79856 -85.26784 1176.93617
8650.0000 -90.63733 -84.70421 5.93312 2.87730 -84.34685 1285.49764
8655.0000 -92.22135 -86.41778 5.80357 2.73710 -85.98667 1167.74078
8660.0000 -91.46968 -85.78608 5.68360 2.68935 -86.54522 1122.88996
8665.0000 -93.21474 -88.11996 5.09478 2.64320 -87.08499 1069.49298
8670.0000 -91.66763 -86.12401 5.54362 2.67116 -86.75786 1089.29294
8675.0000 -91.32596 -86.40613 4.91983 2.71893 -86.19925 1121.40570
8680.0000 -92.01648 -85.50374 6.51274 2.78147 -85.46774 1180.63562
8685.0000 -90.79577 -84.84328 5.95248 2.76640 -85.64394 1211.95246
8690.0000 -90.54516 -85.29223 5.25293 2.75736 -85.74967 1196.86939
8695.0000 -90.97991 -84.74036 6.23955 2.80520 -85.19015 1200.63741
8700.0000 -92.10669 -85.37416 6.73253 2.80428 -85.20089 1166.18130
8705.0000 -90.82889 -83.83102 6.99788 2.83872 -84.79818 1254.20563
8710.0000 -91.41163 -85.13137 6.28026 2.94225 -83.58719 1287.53772
8715.0000 -91.37400 -86.14901 5.22500 2.74239 -85.92484 1151.75716
8720.0000 -92.70120 -87.42459 5.27661 2.65051 -86.99942 1073.86662
8725.0000 -91.87559 -85.48375 6.39184 2.67366 -86.72873 1131.33452
8730.0000 -90.38153 -84.15224 6.22930 2.84906 -84.67722 1229.06627
8735.0000 -90.66401 -84.40987 6.25414 2.92059 -83.84058 1324.22069
8740.0000 -91.42977 -83.44772 7.98205 2.96315 -83.34278 1346.07832
8745.0000 -91.75544 -86.07568 5.67976 2.89037 -84.19403 1263.04995
8750.0000 -92.87276 -86.95703 5.91573 2.72430 -86.13642 1138.50020
MELTING PROCESS: loop number 36 T-loop= 1190.0000000000000
main_MD> interactions number 36 at Temperature= 1190.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.71835 0.04995 8.47537
force_rgl> df(natom) 0.93668 4.18875 1.99973
8755.0000 -90.13467 -84.74121 5.39346 2.70279 -86.38798 1168.72219
8760.0000 -89.67910 -83.50479 6.17432 2.89620 -84.12583 1290.46898
8765.0000 -89.26606 -82.66896 6.59710 3.04868 -82.34248 1427.04406
8770.0000 -90.51654 -83.72222 6.79432 2.92376 -83.80350 1308.80323
8775.0000 -91.87609 -85.46320 6.41289 2.82521 -84.95610 1207.10003
8780.0000 -92.36684 -85.55215 6.81469 2.73048 -86.06411 1165.36757
8785.0000 -92.39176 -86.48057 5.91119 2.69240 -86.50949 1128.95408
8790.0000 -94.08180 -88.15445 5.92735 2.68412 -86.60636 1129.96479
8795.0000 -93.07143 -86.41990 6.65152 2.73248 -86.04075 1161.34414
8800.0000 -91.32412 -86.46623 4.85788 2.66883 -86.78522 1028.95132
8805.0000 -92.54409 -85.52184 7.02225 2.75463 -85.78162 1179.95396
8810.0000 -90.93311 -85.99545 4.93766 2.72901 -86.08125 1105.63044
8815.0000 -91.74639 -85.56491 6.18148 2.77355 -85.56032 1178.61516
8820.0000 -92.02115 -85.26083 6.76031 2.80242 -85.22267 1229.69734
8825.0000 -91.97844 -84.94925 7.02918 2.80352 -85.20982 1175.58819
8830.0000 -92.56998 -85.50015 7.06983 2.74492 -85.89520 1173.86240
8835.0000 -91.22498 -85.48266 5.74232 2.79034 -85.36403 1198.46671
8840.0000 -91.72548 -85.67701 6.04847 2.76838 -85.62080 1137.91865
8845.0000 -93.79575 -86.41340 7.38235 2.80065 -85.24342 1223.63530
8850.0000 -91.54757 -86.56596 4.98160 2.65745 -86.91829 1111.52721
8855.0000 -92.23119 -86.38427 5.84692 2.75087 -85.82560 1108.91998
8860.0000 -92.30180 -86.76983 5.53198 2.73378 -86.02546 1183.80301
8865.0000 -90.59242 -85.37040 5.22202 2.76556 -85.65376 1183.77202
8870.0000 -90.53097 -84.95605 5.57492 2.76688 -85.63838 1178.94181
8875.0000 -91.11632 -83.56476 7.55156 2.85423 -84.61673 1155.61575
8880.0000 -90.99605 -84.52885 6.46720 2.86567 -84.48296 1272.14692
8885.0000 -92.44924 -84.95486 7.49438 2.88743 -84.22845 1311.33506
8890.0000 -91.94634 -86.33393 5.61241 2.79759 -85.27915 1181.06688
8895.0000 -91.12952 -84.80106 6.32846 2.75644 -85.76050 1120.94851
8900.0000 -90.22616 -83.10240 7.12376 2.85765 -84.57668 1256.63359
8905.0000 -90.85618 -84.45826 6.39792 2.92779 -83.75637 1304.84995
8910.0000 -90.42758 -84.10073 6.32685 2.86478 -84.49331 1242.96950
8915.0000 -90.97900 -86.43506 4.54394 2.82578 -84.94943 1158.12908
8920.0000 -89.75570 -83.90227 5.85344 2.79206 -85.34391 1160.00382
8925.0000 -91.81937 -84.96647 6.85290 3.01635 -82.72054 1322.48987
8930.0000 -91.61208 -85.90972 5.70237 2.83170 -84.88021 1206.15930
8935.0000 -90.54786 -84.67809 5.86978 2.82031 -85.01349 1214.45772
8940.0000 -91.63526 -86.52548 5.10978 2.74030 -85.94926 1155.63368
8945.0000 -92.16675 -83.84226 8.32449 2.76475 -85.66324 1172.62620
8950.0000 -90.52865 -84.31830 6.21035 2.84827 -84.68640 1216.52641
8955.0000 -89.89699 -84.78676 5.11023 2.90790 -83.98900 1293.88529
8960.0000 -90.94715 -84.91909 6.02806 2.94637 -83.53902 1334.43242
8965.0000 -90.82616 -84.66331 6.16286 2.82195 -84.99433 1198.03682
8970.0000 -90.95018 -83.44520 7.50498 2.94226 -83.58713 1276.63031
8975.0000 -92.02984 -85.41249 6.61735 2.86525 -84.48789 1212.75233
8980.0000 -91.94047 -85.72044 6.22003 2.76909 -85.61254 1150.57759
8985.0000 -90.82850 -85.10960 5.71890 2.74225 -85.92640 1139.33036
8990.0000 -91.81082 -85.34084 6.46998 2.81477 -85.07821 1207.29975
8995.0000 -92.41325 -86.22922 6.18403 2.68581 -86.58657 1122.91048
9000.0000 -90.87520 -84.25710 6.61810 2.83272 -84.86832 1235.12859
main_MD> EXECUTION TIME: 0 [day], 0 [hour], 7 [min], 23.6809153 [s].
main_MD> Deallocating global variables
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