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nanoparticlesims/growth_Melting_Silver_ICO_3269/meltingSims/run_43/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_43.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 = 43 ntipo2 = 0
read_input> Finish reading input
main_MD> Allocating global variables
main_MD> Number of outputs that will be created: 1850
main_MD> Size of nv and nvoiz: 43 4300
main_MD> Size of nv and nvoiz: 43 4300
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 = 43
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> -1.9626743549797453E-002 -5.3128872328592536E-002 1.5651417021246228E-002 initial drift of cluster / NP1 for coalescence
init> 0.31140750658655109 0.29925236640290376 0.30609779193657966 scaling for velocity /for coalescence NP1
init.f90 > facguy = 1.7641865038789946E-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) 0.04840 1.22193 1.75850
force_rgl> df(natom) -0.32065 -0.64961 0.84467
preparo> THERMALIZATION PROCESS AT 270.20088036177572
preparo> TOTAL ENERGY, KINETIC EN., POT. ENERGY, DELTA
5000 -106.57885833857073 1.5104569753825163 -108.08931531395324 3.5955658730468755E-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 37
MELTING PROCESS: loop number 1 T-loop= 295.00000000000000
main_MD> interactions number 1 at Temperature= 295.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.09817 -0.55252 -0.36055
force_rgl> df(natom) 0.60349 0.74486 -0.05516
5.0000 -107.58633 -106.03672 1.54960 1.66864 -106.36944 249.88824
10.0000 -107.15707 -105.29948 1.85759 1.74079 -105.48393 322.27481
15.0000 -106.98357 -104.96433 2.01924 1.76538 -105.18212 347.83525
20.0000 -106.93048 -105.31767 1.61281 1.76297 -105.21171 357.04472
25.0000 -107.38694 -105.81182 1.57512 1.72862 -105.63330 303.89307
30.0000 -107.05935 -105.32353 1.73583 1.73288 -105.58098 293.45891
35.0000 -107.32558 -105.54863 1.77696 1.74621 -105.41740 317.28354
40.0000 -107.46802 -105.77849 1.68953 1.73315 -105.57762 312.59473
45.0000 -107.46189 -105.66853 1.79335 1.72196 -105.71503 302.30109
50.0000 -107.27729 -105.68019 1.59710 1.72651 -105.65913 307.24363
55.0000 -107.59675 -106.16637 1.43037 1.71452 -105.80633 295.22236
60.0000 -107.91370 -106.21253 1.70117 1.67346 -106.31027 252.49042
65.0000 -107.74733 -106.17998 1.56735 1.68100 -106.21780 259.93163
70.0000 -107.31514 -105.68271 1.63243 1.71685 -105.77771 296.33839
75.0000 -107.15242 -105.74108 1.41134 1.74347 -105.45097 323.24498
80.0000 -107.41223 -105.59460 1.81763 1.72051 -105.73280 302.95767
85.0000 -107.17218 -105.59580 1.57638 1.72946 -105.62301 308.83551
90.0000 -107.66093 -105.88645 1.77449 1.71073 -105.85291 284.52113
95.0000 -107.23234 -105.71315 1.51920 1.70657 -105.90390 286.29411
100.0000 -107.43866 -105.74737 1.69128 1.73566 -105.54690 317.89867
105.0000 -107.45570 -106.27803 1.17766 1.70768 -105.89031 284.09306
110.0000 -107.44829 -105.92718 1.52112 1.69595 -106.03423 268.06510
115.0000 -107.39884 -105.78525 1.61359 1.72284 -105.70423 294.54363
120.0000 -107.56547 -106.11532 1.45015 1.70866 -105.87821 279.04578
125.0000 -107.15773 -105.67422 1.48351 1.71995 -105.73968 291.89378
130.0000 -106.94886 -105.35721 1.59165 1.73277 -105.58231 304.83054
135.0000 -107.09676 -105.92509 1.17167 1.72383 -105.69203 293.83559
140.0000 -107.15971 -105.76113 1.39859 1.71417 -105.81058 272.33496
145.0000 -107.48802 -105.69619 1.79183 1.72459 -105.68275 289.70580
150.0000 -107.47988 -105.67091 1.80897 1.73615 -105.54088 307.33510
155.0000 -107.59383 -106.05159 1.54224 1.71044 -105.85647 285.03018
160.0000 -107.15456 -105.42625 1.72831 1.72709 -105.65205 294.36899
165.0000 -106.90170 -105.63538 1.26633 1.73166 -105.59595 292.59295
170.0000 -107.22776 -105.49326 1.73450 1.73064 -105.60851 280.91637
175.0000 -107.10098 -105.72595 1.37503 1.71146 -105.84390 263.25771
180.0000 -107.35421 -106.11482 1.23940 1.69595 -106.03421 272.22664
185.0000 -107.74870 -106.26484 1.48387 1.68718 -106.14194 262.62938
190.0000 -107.32029 -105.60685 1.71344 1.70469 -105.92694 276.06827
195.0000 -107.22196 -105.45427 1.76769 1.73727 -105.52713 314.86872
200.0000 -107.01107 -105.30232 1.70876 1.74215 -105.46724 312.42852
205.0000 -106.96802 -105.30397 1.66405 1.76070 -105.23958 325.39761
210.0000 -107.57382 -105.97753 1.59629 1.72464 -105.68211 292.27649
215.0000 -106.94799 -105.28561 1.66238 1.71689 -105.77721 285.93619
220.0000 -106.95106 -105.35174 1.59933 1.76268 -105.21521 335.92917
225.0000 -107.64818 -105.58170 2.06648 1.74259 -105.46182 324.19422
230.0000 -107.48370 -105.63592 1.84778 1.71307 -105.82415 293.28376
235.0000 -107.27626 -105.82322 1.45304 1.71559 -105.79326 301.14447
240.0000 -107.68695 -106.01100 1.67595 1.69831 -106.00528 280.40327
245.0000 -107.43238 -106.12744 1.30494 1.70651 -105.90463 294.74240
250.0000 -108.00040 -106.35190 1.64849 1.69829 -106.00549 278.29128
MELTING PROCESS: loop number 2 T-loop= 320.00000000000000
main_MD> interactions number 2 at Temperature= 320.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.35447 0.31438 -0.83084
force_rgl> df(natom) -0.85903 -2.41106 -1.81529
255.0000 -107.09400 -105.57957 1.51443 1.71664 -105.78030 302.63645
260.0000 -107.73530 -106.11841 1.61689 1.69836 -106.00468 276.44927
265.0000 -107.61242 -105.88891 1.72351 1.68221 -106.20293 262.43456
270.0000 -107.18581 -105.11823 2.06758 1.73263 -105.58411 313.95999
275.0000 -106.88373 -104.93720 1.94653 1.76308 -105.21037 344.49032
280.0000 -107.27406 -105.47610 1.79796 1.76499 -105.18690 346.82079
285.0000 -107.25615 -105.56281 1.69334 1.76564 -105.17892 355.24276
290.0000 -107.24765 -105.22279 2.02487 1.74143 -105.47605 317.48933
295.0000 -107.26237 -105.30927 1.95309 1.75769 -105.27646 330.85217
300.0000 -107.02903 -105.40740 1.62163 1.72996 -105.61676 306.63239
305.0000 -106.98946 -105.05374 1.93572 1.75034 -105.36672 321.82800
310.0000 -107.14413 -105.41055 1.73358 1.76469 -105.19055 333.38824
315.0000 -107.09416 -104.81025 2.28390 1.76775 -105.15305 339.64062
320.0000 -107.22343 -105.28589 1.93754 1.80184 -104.73462 377.69348
325.0000 -107.09092 -105.25095 1.83997 1.76435 -105.19475 330.87216
330.0000 -107.38133 -105.38724 1.99408 1.77387 -105.07793 361.74775
335.0000 -107.30865 -105.54425 1.76441 1.75887 -105.26195 337.23381
340.0000 -107.06389 -105.52065 1.54324 1.73594 -105.54344 309.17661
345.0000 -107.53818 -105.67221 1.86597 1.72946 -105.62295 312.48962
350.0000 -107.65221 -105.73113 1.92107 1.73065 -105.60839 310.21433
355.0000 -107.21559 -105.27611 1.93948 1.73229 -105.58820 309.60761
360.0000 -107.55197 -105.52602 2.02596 1.72908 -105.62758 310.00491
365.0000 -107.47277 -105.48375 1.98902 1.73876 -105.50878 320.34310
370.0000 -107.18170 -105.17084 2.01086 1.72798 -105.64116 303.65394
375.0000 -107.42611 -105.86886 1.55726 1.73149 -105.59808 317.14104
380.0000 -107.66414 -105.98124 1.68290 1.70906 -105.87330 293.63571
385.0000 -107.40476 -105.87163 1.53313 1.72762 -105.64556 305.13092
390.0000 -107.45118 -105.76174 1.68944 1.71583 -105.79029 293.90147
395.0000 -107.47876 -105.17273 2.30602 1.72729 -105.64961 312.22910
400.0000 -107.45051 -105.59775 1.85276 1.73948 -105.50002 318.91185
405.0000 -107.61546 -105.81076 1.80470 1.71810 -105.76238 301.79592
410.0000 -107.17432 -105.10665 2.06766 1.75201 -105.34618 331.13847
415.0000 -107.25818 -105.57455 1.68363 1.75994 -105.24888 337.58987
420.0000 -107.16450 -105.13237 2.03213 1.75063 -105.36315 333.29323
425.0000 -107.77210 -106.07727 1.69483 1.71941 -105.74627 301.64891
430.0000 -107.70201 -105.75009 1.95192 1.70127 -105.96897 283.50024
435.0000 -107.06047 -104.84203 2.21844 1.75501 -105.30937 335.56080
440.0000 -106.91585 -105.14336 1.77250 1.79403 -104.83044 378.94073
445.0000 -107.01717 -105.33197 1.68520 1.74747 -105.40193 329.88956
450.0000 -107.62525 -106.08693 1.53832 1.71981 -105.74138 308.26255
455.0000 -107.12257 -105.10694 2.01563 1.75477 -105.31226 333.83601
460.0000 -107.39112 -105.17589 2.21523 1.78307 -104.96501 365.02537
465.0000 -107.04290 -105.02509 2.01781 1.76047 -105.24232 339.48059
470.0000 -106.98126 -105.43177 1.54949 1.76066 -105.24007 339.87708
475.0000 -107.16307 -105.49700 1.66607 1.73957 -105.49887 323.75937
480.0000 -107.26109 -105.50220 1.75888 1.74784 -105.39731 330.13679
485.0000 -107.30437 -105.42606 1.87831 1.73123 -105.60128 313.07609
490.0000 -107.39292 -105.85536 1.53755 1.74421 -105.44190 324.50481
495.0000 -107.45116 -105.69346 1.75771 1.72894 -105.62936 310.02071
500.0000 -107.54121 -106.02769 1.51352 1.70776 -105.88929 278.93447
MELTING PROCESS: loop number 3 T-loop= 345.00000000000000
main_MD> interactions number 3 at Temperature= 345.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.18783 -1.43540 0.14928
force_rgl> df(natom) 0.64048 0.41659 0.55028
505.0000 -107.35045 -105.20404 2.14641 1.72227 -105.71127 296.31993
510.0000 -107.00826 -105.61120 1.39706 1.73716 -105.52845 316.72529
515.0000 -107.03877 -105.44790 1.59088 1.74709 -105.40653 329.22972
520.0000 -106.73810 -105.13986 1.59823 1.77374 -105.07952 355.68150
525.0000 -107.37501 -104.85443 2.52058 1.75609 -105.29605 331.84540
530.0000 -107.55094 -105.67702 1.87391 1.75956 -105.25347 351.68444
535.0000 -107.00602 -104.90551 2.10051 1.73584 -105.54461 313.80866
540.0000 -107.32090 -104.99727 2.32363 1.76841 -105.14489 334.64057
545.0000 -107.18686 -104.79442 2.39244 1.78726 -104.91350 362.03775
550.0000 -106.89411 -104.97867 1.91543 1.78685 -104.91855 360.63741
555.0000 -106.70200 -105.01285 1.68914 1.76579 -105.17710 337.01353
560.0000 -107.37240 -105.68823 1.68417 1.75557 -105.30251 318.31620
565.0000 -107.02981 -105.41201 1.61781 1.73797 -105.51848 301.45867
570.0000 -107.00223 -105.19385 1.80838 1.75998 -105.24839 330.18119
575.0000 -107.28889 -105.32304 1.96586 1.75097 -105.35896 321.19947
580.0000 -107.15572 -105.70696 1.44876 1.74871 -105.38674 310.99768
585.0000 -106.87428 -105.15688 1.71741 1.74011 -105.49228 301.64889
590.0000 -107.16479 -105.63416 1.53063 1.74979 -105.37341 312.19229
595.0000 -107.17548 -105.56790 1.60758 1.74804 -105.39496 321.09836
600.0000 -106.90179 -105.21899 1.68280 1.76098 -105.23604 336.79493
605.0000 -107.20725 -105.64450 1.56276 1.74276 -105.45972 320.36428
610.0000 -106.85491 -104.98979 1.86512 1.74436 -105.44011 318.99198
615.0000 -107.43857 -105.56643 1.87214 1.76979 -105.12790 345.43538
620.0000 -107.27986 -105.70537 1.57449 1.71698 -105.77609 292.23672
625.0000 -106.98628 -105.39455 1.59174 1.74131 -105.47754 310.14614
630.0000 -107.08614 -105.04384 2.04230 1.77655 -105.04494 354.23242
635.0000 -106.98138 -105.15337 1.82800 1.75584 -105.29917 329.12159
640.0000 -107.06949 -105.38490 1.68460 1.77328 -105.08513 345.43616
645.0000 -107.33492 -105.43543 1.89948 1.74855 -105.38869 313.92934
650.0000 -107.17557 -105.28306 1.89251 1.75623 -105.29435 325.99433
655.0000 -107.14927 -105.09818 2.05109 1.76233 -105.21955 338.32083
660.0000 -106.98175 -105.01974 1.96201 1.76657 -105.16751 341.24412
665.0000 -106.91576 -105.18762 1.72814 1.76364 -105.20338 327.84232
670.0000 -107.11484 -105.39473 1.72011 1.75534 -105.30526 324.75606
675.0000 -107.10948 -105.48727 1.62221 1.74757 -105.40065 310.72506
680.0000 -107.29594 -105.50919 1.78675 1.76044 -105.24274 327.41597
685.0000 -107.60142 -105.70879 1.89263 1.74015 -105.49180 336.34963
690.0000 -106.38610 -104.47047 1.91562 1.78319 -104.96352 379.47321
695.0000 -107.30815 -105.11551 2.19264 1.78171 -104.98169 380.31906
700.0000 -107.13129 -105.13509 1.99620 1.77568 -105.05562 369.74611
705.0000 -107.55033 -105.76563 1.78470 1.75435 -105.31745 348.51627
710.0000 -107.63437 -105.51497 2.11940 1.72841 -105.63588 323.17039
715.0000 -107.00903 -105.40036 1.60867 1.75544 -105.30404 354.08436
720.0000 -107.46282 -105.91202 1.55079 1.75234 -105.34216 349.28743
725.0000 -107.26994 -105.55933 1.71060 1.73703 -105.53007 331.23747
730.0000 -107.38666 -105.83614 1.55052 1.73156 -105.59719 326.63038
735.0000 -107.44970 -105.69071 1.75899 1.73604 -105.54221 334.73695
740.0000 -107.48908 -105.28158 2.20750 1.72072 -105.73025 315.55302
745.0000 -106.84709 -104.86572 1.98137 1.75066 -105.36275 344.67605
750.0000 -106.94722 -104.95876 1.98847 1.77304 -105.08806 366.90015
MELTING PROCESS: loop number 4 T-loop= 370.00000000000000
main_MD> interactions number 4 at Temperature= 370.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.78152 0.57382 0.16688
force_rgl> df(natom) -0.76380 0.25823 0.78250
755.0000 -107.00382 -105.21245 1.79137 1.76317 -105.20919 360.19431
760.0000 -107.21655 -104.93237 2.28418 1.75117 -105.35646 346.64372
765.0000 -106.96503 -105.21208 1.75295 1.78715 -104.91493 379.67488
770.0000 -107.02582 -104.83084 2.19499 1.77637 -105.04721 370.50232
775.0000 -107.05484 -104.09865 2.95619 1.81109 -104.62101 401.23324
780.0000 -106.33129 -103.93420 2.39708 1.84863 -104.16029 441.41348
785.0000 -106.81381 -104.31839 2.49542 1.87311 -103.85984 465.04890
790.0000 -106.88956 -104.60773 2.28183 1.82272 -104.47833 409.33983
795.0000 -107.18711 -105.25870 1.92841 1.77642 -105.04657 369.27239
800.0000 -107.22814 -105.20635 2.02179 1.77188 -105.10233 369.65890
805.0000 -107.20457 -104.87342 2.33115 1.72893 -105.62942 322.62975
810.0000 -107.05248 -104.81279 2.23968 1.77529 -105.06039 366.34451
815.0000 -106.85782 -104.96657 1.89126 1.76892 -105.13865 362.68603
820.0000 -106.93251 -104.92354 2.00897 1.77772 -105.03065 371.95823
825.0000 -107.20891 -105.37615 1.83276 1.79574 -104.80946 389.76797
830.0000 -107.56003 -105.12588 2.43415 1.75135 -105.35432 342.40372
835.0000 -107.29646 -105.34327 1.95318 1.75309 -105.33295 347.40909
840.0000 -106.47356 -104.66941 1.80415 1.75508 -105.30852 345.60614
845.0000 -106.77920 -104.48580 2.29340 1.81081 -104.62442 394.81107
850.0000 -107.02079 -105.30286 1.71793 1.79666 -104.79817 392.96776
855.0000 -107.09761 -105.37631 1.72130 1.75172 -105.34972 346.36603
860.0000 -106.71665 -104.60669 2.10996 1.76084 -105.23787 355.89857
865.0000 -107.82626 -105.41060 2.41566 1.74785 -105.39719 342.85264
870.0000 -107.27863 -105.31507 1.96356 1.74751 -105.40147 339.47801
875.0000 -106.50142 -104.51088 1.99054 1.78802 -104.90415 389.97761
880.0000 -106.78775 -104.43934 2.34841 1.80860 -104.65162 404.35967
885.0000 -107.31134 -104.89962 2.41172 1.80485 -104.69770 392.32732
890.0000 -106.71220 -104.63482 2.07737 1.80324 -104.71735 387.74483
895.0000 -107.09767 -104.61740 2.48027 1.82708 -104.42483 414.88260
900.0000 -106.85288 -105.02972 1.82316 1.80133 -104.74081 400.50157
905.0000 -107.33354 -105.04734 2.28620 1.77671 -105.04302 377.47950
910.0000 -107.63090 -105.68833 1.94257 1.75016 -105.36887 350.75661
915.0000 -107.03148 -104.81518 2.21630 1.76533 -105.18270 361.63914
920.0000 -107.13040 -104.78368 2.34672 1.79996 -104.75766 391.33776
925.0000 -107.50717 -105.56326 1.94391 1.76296 -105.21185 354.91741
930.0000 -107.27122 -105.04395 2.22727 1.76644 -105.16904 366.64288
935.0000 -107.04702 -105.14214 1.90488 1.77531 -105.06016 371.53547
940.0000 -107.35368 -105.65278 1.70091 1.75656 -105.29028 355.76367
945.0000 -107.64374 -104.94147 2.70228 1.77267 -105.09260 370.66488
950.0000 -107.32650 -105.10697 2.21953 1.79838 -104.77711 392.38002
955.0000 -107.29371 -105.60278 1.69093 1.75052 -105.36451 350.12227
960.0000 -107.58658 -105.81327 1.77331 1.70046 -105.97889 301.51639
965.0000 -107.55041 -105.99048 1.55992 1.72054 -105.73241 325.01308
970.0000 -107.26783 -105.57834 1.68950 1.72462 -105.68241 326.60667
975.0000 -106.93365 -105.10863 1.82502 1.75310 -105.33279 352.13155
980.0000 -107.39073 -105.11138 2.27934 1.78613 -104.92737 382.10508
985.0000 -107.06832 -105.06984 1.99847 1.77509 -105.06292 368.32189
990.0000 -107.02944 -105.01335 2.01609 1.77118 -105.11090 364.64277
995.0000 -107.31832 -105.45952 1.85880 1.76631 -105.17073 364.54001
1000.0000 -107.62799 -105.45026 2.17772 1.74769 -105.39920 351.66161
MELTING PROCESS: loop number 5 T-loop= 395.00000000000000
main_MD> interactions number 5 at Temperature= 395.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.29544 0.45208 0.80687
force_rgl> df(natom) -1.21027 0.70186 -0.84012
1005.0000 -106.90473 -105.26032 1.64441 1.75289 -105.33534 353.69842
1010.0000 -106.36121 -104.41350 1.94771 1.80740 -104.66638 386.46800
1015.0000 -106.70268 -104.51563 2.18705 1.82162 -104.49182 407.55426
1020.0000 -106.93091 -104.19777 2.73314 1.81967 -104.51575 401.16874
1025.0000 -107.06550 -104.47191 2.59359 1.82471 -104.45383 422.71016
1030.0000 -106.24608 -104.24147 2.00461 1.79452 -104.82439 371.24706
1035.0000 -106.86242 -103.90288 2.95954 1.85084 -104.13322 436.15616
1040.0000 -106.60005 -104.41369 2.18635 1.84516 -104.20291 430.65310
1045.0000 -106.76493 -104.02694 2.73799 1.82456 -104.45569 409.24956
1050.0000 -107.01769 -104.68386 2.33382 1.81832 -104.53236 403.51157
1055.0000 -106.82646 -104.60236 2.22410 1.78315 -104.96401 378.14662
1060.0000 -106.96225 -104.64506 2.31719 1.80435 -104.70374 394.12521
1065.0000 -106.75419 -104.60694 2.14725 1.82630 -104.43430 411.51796
1070.0000 -106.78125 -104.22610 2.55514 1.82575 -104.44115 420.94990
1075.0000 -107.41602 -104.77621 2.63981 1.81017 -104.63236 403.87649
1080.0000 -107.51252 -105.35329 2.15923 1.77716 -105.03751 369.93097
1085.0000 -107.44819 -105.55787 1.89032 1.75802 -105.27240 356.34093
1090.0000 -107.12573 -104.89357 2.23216 1.78883 -104.89420 380.60270
1095.0000 -106.95337 -104.55645 2.39692 1.82335 -104.47055 420.57552
1100.0000 -107.14140 -104.65401 2.48739 1.80148 -104.73904 382.31927
1105.0000 -107.10168 -104.87640 2.22527 1.79444 -104.82540 382.98548
1110.0000 -107.28547 -104.43869 2.84678 1.82047 -104.50592 403.52235
1115.0000 -107.08224 -104.80521 2.27703 1.80680 -104.67371 395.77276
1120.0000 -106.52311 -104.07359 2.44952 1.83888 -104.27993 424.95798
1125.0000 -106.20650 -104.29509 1.91142 1.84072 -104.25740 409.84150
1130.0000 -106.31576 -103.83971 2.47605 1.85117 -104.12914 425.00199
1135.0000 -106.63165 -104.18762 2.44403 1.84993 -104.14430 429.88338
1140.0000 -106.88074 -104.92885 1.95189 1.80417 -104.70599 375.63061
1145.0000 -106.83540 -104.81905 2.01636 1.79228 -104.85188 376.69730
1150.0000 -106.56651 -104.70960 1.85691 1.80646 -104.67782 379.82096
1155.0000 -107.08193 -104.69955 2.38238 1.81382 -104.58755 386.11713
1160.0000 -106.60537 -104.37706 2.22831 1.82333 -104.47078 395.17569
1165.0000 -106.42756 -104.76847 1.65909 1.81122 -104.61947 378.35925
1170.0000 -106.50469 -104.08215 2.42254 1.82134 -104.49519 391.08885
1175.0000 -106.43050 -104.16970 2.26080 1.84245 -104.23616 411.70188
1180.0000 -107.06138 -105.14628 1.91509 1.80923 -104.64391 391.15129
1185.0000 -106.49710 -104.36910 2.12800 1.79666 -104.79812 381.65868
1190.0000 -107.01427 -104.05222 2.96205 1.85625 -104.06672 431.52250
1195.0000 -106.27493 -103.37927 2.89566 1.87132 -103.88184 438.39456
1200.0000 -106.58593 -104.23912 2.34681 1.85398 -104.09458 420.68695
1205.0000 -106.72794 -104.40462 2.32331 1.84662 -104.18495 417.57092
1210.0000 -106.68173 -104.28684 2.39490 1.80837 -104.65442 388.13804
1215.0000 -106.39214 -104.23655 2.15559 1.83921 -104.27589 410.35913
1220.0000 -106.85324 -104.83513 2.01811 1.79790 -104.78293 371.35434
1225.0000 -106.80966 -104.42388 2.38578 1.79258 -104.84825 362.54677
1230.0000 -106.29102 -104.17162 2.11941 1.86343 -103.97862 430.78023
1235.0000 -106.90648 -104.70024 2.20624 1.82693 -104.42666 392.80855
1240.0000 -106.87212 -104.39463 2.47749 1.82678 -104.42848 404.63714
1245.0000 -106.60601 -104.01622 2.58979 1.85938 -104.02835 426.03022
1250.0000 -106.83089 -104.26263 2.56825 1.84309 -104.22824 438.09101
MELTING PROCESS: loop number 6 T-loop= 420.00000000000000
main_MD> interactions number 6 at Temperature= 420.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -2.85820 -0.68095 -0.86015
force_rgl> df(natom) -1.12613 0.95811 1.53429
1255.0000 -107.44810 -105.52031 1.92779 1.79488 -104.82004 390.39908
1260.0000 -106.96830 -104.05517 2.91313 1.79365 -104.83515 388.01307
1265.0000 -106.67831 -103.49893 3.17938 1.90822 -103.42885 477.82241
1270.0000 -106.36903 -103.98848 2.38054 1.88262 -103.74312 452.40216
1275.0000 -106.75292 -104.40089 2.35203 1.84699 -104.18038 410.84403
1280.0000 -105.82307 -103.35686 2.46622 1.88005 -103.77469 435.35525
1285.0000 -106.36926 -103.82001 2.54925 1.89947 -103.53624 466.47903
1290.0000 -107.06159 -104.70689 2.35470 1.84910 -104.15454 420.06285
1295.0000 -106.32473 -104.01870 2.30603 1.83699 -104.30310 407.49675
1300.0000 -107.02480 -104.63250 2.39229 1.84139 -104.24919 426.31629
1305.0000 -106.81594 -104.84128 1.97467 1.80344 -104.71492 402.67093
1310.0000 -107.01878 -105.07042 1.94835 1.77918 -105.01271 381.12359
1315.0000 -106.41413 -103.91542 2.49871 1.83276 -104.35504 416.22394
1320.0000 -106.11169 -103.64557 2.46612 1.88346 -103.73276 449.96009
1325.0000 -105.82625 -103.59343 2.23283 1.89285 -103.61750 451.85350
1330.0000 -106.52784 -104.16073 2.36711 1.86452 -103.96526 424.00544
1335.0000 -106.07090 -103.72435 2.34655 1.86716 -103.93286 410.31330
1340.0000 -106.15921 -104.06908 2.09013 1.85780 -104.04770 397.18347
1345.0000 -106.35165 -104.02247 2.32918 1.84285 -104.23120 383.74203
1350.0000 -106.35917 -104.31054 2.04863 1.84390 -104.21829 399.86848
1355.0000 -105.92189 -103.35479 2.56711 1.90503 -103.46811 464.00832
1360.0000 -106.47773 -104.25497 2.22276 1.89891 -103.54314 441.26684
1365.0000 -105.82804 -103.72883 2.09920 1.86954 -103.90366 436.88479
1370.0000 -106.40369 -104.14235 2.26134 1.85609 -104.06872 443.76725
1375.0000 -106.20011 -104.13936 2.06075 1.83444 -104.33449 411.11950
1380.0000 -106.13845 -103.80773 2.33072 1.85826 -104.04213 426.33428
1385.0000 -106.32689 -103.57684 2.75005 1.88369 -103.72994 450.41858
1390.0000 -105.34458 -103.11389 2.23068 1.89514 -103.58945 460.79932
1395.0000 -106.10332 -103.82808 2.27524 1.91602 -103.33315 480.81484
1400.0000 -106.31683 -104.18197 2.13486 1.84768 -104.17198 407.31231
1405.0000 -106.88767 -104.39585 2.49182 1.82401 -104.46252 379.92833
1410.0000 -105.97475 -103.89562 2.07912 1.83540 -104.32262 396.88142
1415.0000 -106.17805 -103.92079 2.25726 1.86275 -103.98704 408.92825
1420.0000 -105.96483 -103.91312 2.05170 1.87471 -103.84017 421.02617
1425.0000 -106.28125 -103.84484 2.43641 1.85486 -104.08379 381.87501
1430.0000 -106.57790 -104.03509 2.54281 1.86117 -104.00640 425.99603
1435.0000 -106.82642 -104.24237 2.58405 1.85154 -104.12453 425.63311
1440.0000 -106.64621 -104.28080 2.36541 1.83763 -104.29532 406.50621
1445.0000 -106.88675 -105.07985 1.80690 1.79208 -104.85437 361.88591
1450.0000 -106.24654 -104.16207 2.08447 1.81192 -104.61088 376.70697
1455.0000 -106.57830 -104.66315 1.91515 1.83787 -104.29230 402.42175
1460.0000 -106.27230 -103.64383 2.62847 1.83921 -104.27595 401.66831
1465.0000 -105.96174 -103.72188 2.23986 1.88143 -103.75775 434.99275
1470.0000 -106.08187 -103.93846 2.14342 1.87224 -103.87046 430.37233
1475.0000 -106.05737 -103.48046 2.57691 1.88897 -103.66516 437.00115
1480.0000 -106.21204 -104.03795 2.17409 1.86949 -103.90428 429.42739
1485.0000 -106.63264 -104.50265 2.13000 1.83674 -104.30621 399.96623
1490.0000 -107.48364 -104.98700 2.49664 1.82586 -104.43982 399.52889
1495.0000 -107.17833 -105.27977 1.89856 1.77249 -105.09481 369.89098
1500.0000 -106.66138 -104.16077 2.50061 1.78961 -104.88473 374.37132
MELTING PROCESS: loop number 7 T-loop= 445.00000000000000
main_MD> interactions number 7 at Temperature= 445.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.97466 -0.02297 0.22169
force_rgl> df(natom) 1.98796 0.10180 -2.29387
1505.0000 -106.23173 -103.76609 2.46564 1.86025 -104.01772 447.74142
1510.0000 -106.51511 -103.68287 2.83224 1.86582 -103.94928 450.23218
1515.0000 -105.92196 -102.87758 3.04438 1.92311 -103.24618 513.24134
1520.0000 -105.43650 -102.58651 2.84999 1.97494 -102.60999 533.82158
1525.0000 -105.40514 -102.72585 2.67929 1.99093 -102.41376 531.24161
1530.0000 -105.47284 -102.71807 2.75477 1.95863 -102.81023 490.94156
1535.0000 -105.60595 -103.17876 2.42719 1.94889 -102.92976 478.98662
1540.0000 -105.65352 -103.09145 2.56207 1.96442 -102.73913 532.43110
1545.0000 -105.46228 -102.90090 2.56138 1.91939 -103.29185 463.25851
1550.0000 -105.82970 -102.86208 2.96762 1.94746 -102.94726 472.84480
1555.0000 -105.66192 -102.64539 3.01653 1.97604 -102.59648 514.88302
1560.0000 -106.04009 -103.26558 2.77451 1.95163 -102.89612 457.38077
1565.0000 -106.47048 -104.18170 2.28878 1.89099 -103.64043 441.06719
1570.0000 -106.60390 -104.26036 2.34354 1.82283 -104.47701 384.80386
1575.0000 -106.34491 -103.33634 3.00857 1.90377 -103.48357 462.96635
1580.0000 -106.14742 -103.35506 2.79237 1.89920 -103.53960 461.12708
1585.0000 -106.01502 -103.00373 3.01129 1.92371 -103.23879 485.93922
1590.0000 -105.85973 -103.40093 2.45880 1.92341 -103.24244 462.48205
1595.0000 -105.13463 -102.77013 2.36450 1.94804 -102.94013 488.69225
1600.0000 -106.01708 -103.70681 2.31027 1.90163 -103.50976 458.39176
1605.0000 -105.12758 -102.89291 2.23467 1.91657 -103.32640 463.97649
1610.0000 -106.34660 -104.12092 2.22568 1.89576 -103.58179 445.75729
1615.0000 -105.66647 -103.37138 2.29509 1.90379 -103.48332 457.75884
1620.0000 -106.16970 -104.01466 2.15504 1.90635 -103.45182 465.31751
1625.0000 -106.11292 -103.97371 2.13921 1.86455 -103.96491 411.48296
1630.0000 -105.65143 -102.90570 2.74573 1.92435 -103.23095 446.84924
1635.0000 -106.44689 -104.10327 2.34362 1.91463 -103.35017 462.15337
1640.0000 -105.82131 -103.50529 2.31601 1.89576 -103.58186 454.23583
1645.0000 -106.14847 -103.87456 2.27391 1.90489 -103.46970 456.93403
1650.0000 -105.81186 -103.28835 2.52351 1.91052 -103.40067 472.66897
1655.0000 -106.22903 -103.90729 2.32174 1.89909 -103.54099 444.27006
1660.0000 -105.74221 -103.02313 2.71908 1.88886 -103.66648 456.69594
1665.0000 -106.77072 -103.65049 3.12023 1.91369 -103.36176 486.68637
1670.0000 -106.46808 -104.35180 2.11628 1.88556 -103.70706 474.95024
1675.0000 -106.92430 -104.42822 2.49609 1.83155 -104.36997 413.41451
1680.0000 -105.67760 -103.51332 2.16428 1.87343 -103.85596 446.25539
1685.0000 -106.33662 -103.37716 2.95945 1.91279 -103.37279 475.75295
1690.0000 -107.15413 -104.55624 2.59789 1.86708 -103.93388 445.95298
1695.0000 -106.18479 -103.59575 2.58904 1.86450 -103.96556 441.87999
1700.0000 -105.93222 -103.58387 2.34835 1.89440 -103.59847 465.22662
1705.0000 -105.73523 -103.24201 2.49322 1.90723 -103.44108 474.90420
1710.0000 -105.59151 -102.61040 2.98110 1.96048 -102.78751 502.57502
1715.0000 -106.11254 -103.78256 2.32997 1.94291 -103.00317 482.89444
1720.0000 -106.20572 -103.99850 2.20723 1.85856 -104.03841 443.98371
1725.0000 -107.13290 -104.67272 2.46018 1.83388 -104.34137 435.41300
1730.0000 -107.18587 -104.15128 3.03459 1.82421 -104.46003 420.29083
1735.0000 -106.46668 -104.39528 2.07140 1.80282 -104.72253 406.95921
1740.0000 -107.13537 -104.98960 2.14577 1.77259 -105.09358 376.12516
1745.0000 -106.76843 -104.55733 2.21110 1.78768 -104.90841 392.74402
1750.0000 -106.73693 -104.37643 2.36050 1.80539 -104.69098 403.39731
MELTING PROCESS: loop number 8 T-loop= 470.00000000000000
main_MD> interactions number 8 at Temperature= 470.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.55242 -2.62041 -0.25628
force_rgl> df(natom) 0.46355 0.37742 -0.21827
1755.0000 -106.42154 -103.84662 2.57492 1.81930 -104.52027 402.75547
1760.0000 -106.24664 -103.83993 2.40671 1.86857 -103.91553 421.30338
1765.0000 -105.98722 -103.19303 2.79419 1.93494 -103.10099 493.89667
1770.0000 -105.87404 -103.50024 2.37380 1.92899 -103.17394 486.18860
1775.0000 -105.40788 -102.70240 2.70548 1.94003 -103.03847 488.45268
1780.0000 -106.01231 -103.13468 2.87763 1.95752 -102.82381 488.12021
1785.0000 -105.84620 -103.02187 2.82434 1.97095 -102.65896 517.91134
1790.0000 -105.78090 -103.31454 2.46636 1.93039 -103.15680 481.31733
1795.0000 -105.49687 -103.14773 2.34914 1.92802 -103.18589 463.13887
1800.0000 -105.09481 -102.56420 2.53061 1.95338 -102.87460 471.57131
1805.0000 -105.22122 -102.28235 2.93887 1.97674 -102.58795 514.48945
1810.0000 -105.84064 -103.10935 2.73129 1.98056 -102.54098 511.36008
1815.0000 -106.43758 -104.18096 2.25662 1.88549 -103.70788 455.80499
1820.0000 -106.52631 -104.35927 2.16704 1.86623 -103.94432 431.37448
1825.0000 -106.17711 -103.93889 2.23822 1.87583 -103.82645 433.69813
1830.0000 -106.12562 -103.77346 2.35216 1.86502 -103.95912 446.37985
1835.0000 -106.06919 -103.59099 2.47819 1.87867 -103.79156 455.53300
1840.0000 -105.71298 -103.27679 2.43619 1.90978 -103.40975 473.83625
1845.0000 -106.23688 -103.65248 2.58439 1.89661 -103.57138 464.66718
1850.0000 -106.79852 -103.95215 2.84638 1.87749 -103.80612 431.75078
1855.0000 -106.69724 -104.46230 2.23494 1.82434 -104.45845 412.23826
1860.0000 -106.99017 -105.56789 1.42228 1.81177 -104.61273 402.67601
1865.0000 -107.16491 -104.86557 2.29934 1.79058 -104.87275 381.03978
1870.0000 -106.82986 -104.37070 2.45916 1.80269 -104.72409 400.97053
1875.0000 -106.43418 -103.80912 2.62506 1.84753 -104.17380 434.77970
1880.0000 -106.49131 -103.83245 2.65886 1.88718 -103.68718 471.92509
1885.0000 -106.65976 -104.00758 2.65218 1.88676 -103.69232 461.94616
1890.0000 -105.91689 -103.37450 2.54238 1.86951 -103.90402 442.34423
1895.0000 -106.50479 -103.59891 2.90588 1.92428 -103.23182 459.67934
1900.0000 -106.30587 -103.09277 3.21309 1.89632 -103.57495 464.13394
1905.0000 -105.53636 -102.51889 3.01748 1.97782 -102.57468 552.97235
1910.0000 -105.74044 -103.21009 2.53035 1.93965 -103.04319 486.54379
1915.0000 -105.45856 -102.95475 2.50381 1.95550 -102.84864 495.88394
1920.0000 -106.45514 -103.87351 2.58163 1.88517 -103.71180 453.84601
1925.0000 -105.94567 -103.69025 2.25542 1.88999 -103.65259 453.47574
1930.0000 -106.07223 -103.15181 2.92042 1.89556 -103.58433 430.27951
1935.0000 -105.68380 -103.44242 2.24138 1.92838 -103.18143 447.21417
1940.0000 -105.89839 -103.81078 2.08762 1.89013 -103.65090 451.29277
1945.0000 -106.43009 -104.45283 1.97726 1.85077 -104.13400 413.14563
1950.0000 -106.86294 -104.06499 2.79795 1.88085 -103.76482 452.40433
1955.0000 -105.54072 -103.64802 1.89270 1.87412 -103.84741 433.31670
1960.0000 -106.22474 -103.69657 2.52817 1.88606 -103.70083 447.77212
1965.0000 -106.22769 -104.02991 2.19778 1.85702 -104.05728 421.95876
1970.0000 -106.59458 -104.12729 2.46729 1.85788 -104.04677 437.12214
1975.0000 -106.03304 -104.07416 1.95888 1.83576 -104.31830 400.02001
1980.0000 -106.63634 -103.78322 2.85312 1.88177 -103.75357 441.12559
1985.0000 -105.93690 -103.44225 2.49466 1.91057 -103.40010 468.94581
1990.0000 -106.58048 -104.14498 2.43550 1.87264 -103.86565 445.72799
1995.0000 -106.22282 -103.89785 2.32497 1.84936 -104.15132 421.24617
2000.0000 -106.39361 -103.79817 2.59544 1.85807 -104.04443 430.70025
MELTING PROCESS: loop number 9 T-loop= 495.00000000000000
main_MD> interactions number 9 at Temperature= 495.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.67983 1.90810 1.07546
force_rgl> df(natom) 1.00315 -2.71098 0.36637
2005.0000 -106.60542 -104.26067 2.34475 1.86337 -103.97934 428.13488
2010.0000 -106.03812 -102.66126 3.37686 1.89393 -103.60429 472.68802
2015.0000 -106.26975 -104.11622 2.15353 1.94582 -102.96736 508.31906
2020.0000 -106.05772 -102.78635 3.27137 1.87760 -103.80473 455.44226
2025.0000 -105.79127 -102.73820 3.05307 1.98092 -102.53657 529.65888
2030.0000 -104.86883 -102.64391 2.22493 1.94805 -102.94008 514.92886
2035.0000 -105.50244 -102.63044 2.87200 1.93522 -103.09752 491.79537
2040.0000 -105.22045 -102.31992 2.90053 1.99349 -102.38230 546.89613
2045.0000 -105.64771 -102.43854 3.20917 1.96664 -102.71184 520.78878
2050.0000 -105.38219 -102.10665 3.27554 1.98268 -102.51504 523.03287
2055.0000 -105.48471 -102.42618 3.05853 2.04428 -101.75887 567.39119
2060.0000 -104.96026 -102.14789 2.81237 2.00649 -102.22276 556.72506
2065.0000 -106.08494 -103.31376 2.77119 1.96378 -102.74691 513.20014
2070.0000 -105.75036 -103.47672 2.27365 1.92656 -103.20375 476.27670
2075.0000 -105.83276 -102.69261 3.14015 1.92675 -103.20146 477.16797
2080.0000 -106.12727 -102.79551 3.33176 1.97089 -102.65967 545.56059
2085.0000 -106.53321 -103.48474 3.04847 1.92863 -103.17841 521.04554
2090.0000 -106.53656 -103.44952 3.08704 1.92100 -103.27198 509.10990
2095.0000 -105.87748 -103.70265 2.17483 1.90787 -103.43324 468.79990
2100.0000 -105.92707 -103.29940 2.62767 1.88515 -103.71204 431.72696
2105.0000 -105.70824 -102.61387 3.09437 1.94879 -102.93095 521.06110
2110.0000 -105.87211 -102.89565 2.97646 1.97078 -102.66107 539.48292
2115.0000 -105.27515 -102.84907 2.42608 1.94902 -102.92807 495.24855
2120.0000 -106.04684 -103.12125 2.92559 1.95154 -102.89716 487.89992
2125.0000 -106.06087 -103.13430 2.92656 1.92789 -103.18747 482.24850
2130.0000 -105.99166 -103.71171 2.27994 1.93816 -103.06147 508.22240
2135.0000 -106.11645 -103.66589 2.45056 1.90056 -103.52293 460.83984
2140.0000 -105.49774 -103.00398 2.49376 1.91808 -103.30789 463.90308
2145.0000 -106.14640 -102.82226 3.32413 1.94632 -102.96123 502.36479
2150.0000 -105.99141 -103.09740 2.89401 1.95382 -102.86918 512.64229
2155.0000 -105.78048 -103.32057 2.45992 1.92464 -103.22735 482.06140
2160.0000 -105.62092 -102.67479 2.94613 1.98038 -102.54320 533.47104
2165.0000 -105.32988 -102.08457 3.24532 1.97596 -102.59747 539.03230
2170.0000 -106.00459 -102.93282 3.07177 1.99879 -102.31725 540.26730
2175.0000 -106.08202 -103.70472 2.37730 1.90786 -103.43327 448.13695
2180.0000 -105.85465 -103.13134 2.72331 1.87995 -103.77588 455.61669
2185.0000 -105.93481 -103.54603 2.38878 1.91669 -103.32499 475.76579
2190.0000 -106.18882 -103.62176 2.56707 1.91946 -103.29099 476.96743
2195.0000 -106.35291 -103.99248 2.36043 1.89847 -103.54860 472.73793
2200.0000 -106.67615 -104.16132 2.51483 1.87001 -103.89782 431.15123
2205.0000 -105.39764 -102.81511 2.58253 1.91683 -103.32320 482.70703
2210.0000 -105.67629 -103.11225 2.56404 1.95656 -102.83556 509.88791
2215.0000 -105.98519 -102.78835 3.19685 1.95629 -102.83889 519.62019
2220.0000 -105.83296 -102.69943 3.13353 1.96944 -102.67751 520.41424
2225.0000 -105.54413 -102.43300 3.11113 1.98172 -102.52673 536.89574
2230.0000 -105.45340 -102.72537 2.72803 1.98921 -102.43486 550.05188
2235.0000 -105.72599 -103.04544 2.68055 1.94727 -102.94966 487.62927
2240.0000 -105.39907 -102.68132 2.71775 1.96787 -102.69675 510.17289
2245.0000 -105.82906 -103.02802 2.80103 1.97440 -102.61665 529.39909
2250.0000 -105.68718 -102.92289 2.76429 1.95766 -102.82210 501.46120
MELTING PROCESS: loop number 10 T-loop= 520.00000000000000
main_MD> interactions number 10 at Temperature= 520.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 3.52231 0.26640 0.40698
force_rgl> df(natom) -0.79171 1.22099 -0.05663
2255.0000 -106.32892 -102.98264 3.34628 1.94129 -103.02297 494.23872
2260.0000 -105.84203 -102.97746 2.86457 1.92211 -103.25844 479.13175
2265.0000 -106.15033 -103.72498 2.42536 1.91324 -103.36728 477.19299
2270.0000 -105.75760 -103.01185 2.74575 1.91203 -103.38208 461.82450
2275.0000 -105.36721 -102.48911 2.87810 1.95830 -102.81417 504.68770
2280.0000 -105.90696 -102.82010 3.08687 1.98868 -102.44131 538.23007
2285.0000 -106.64464 -103.34261 3.30203 1.94325 -102.99894 529.43512
2290.0000 -105.29153 -103.03782 2.25372 1.92958 -103.16673 502.97010
2295.0000 -106.62995 -103.87999 2.74996 1.93000 -103.16159 512.77983
2300.0000 -106.00530 -103.10637 2.89893 1.87312 -103.85971 450.53774
2305.0000 -105.89853 -102.69743 3.20110 1.93720 -103.07325 481.95830
2310.0000 -104.78305 -101.75657 3.02648 2.05742 -101.59763 579.28978
2315.0000 -104.91879 -102.29587 2.62292 2.03935 -101.81937 542.07437
2320.0000 -106.07664 -102.75988 3.31676 1.99594 -102.35218 545.58136
2325.0000 -105.35313 -101.95366 3.39947 1.97724 -102.58173 524.88222
2330.0000 -105.32426 -102.05397 3.27029 2.01886 -102.07087 568.54191
2335.0000 -105.63217 -102.71223 2.91995 1.97741 -102.57966 510.78270
2340.0000 -105.14477 -102.23661 2.90815 1.97489 -102.61055 521.44180
2345.0000 -104.91373 -102.48904 2.42469 1.97855 -102.56571 506.41881
2350.0000 -105.19613 -102.51009 2.68604 1.97449 -102.61549 513.67909
2355.0000 -105.33699 -102.98240 2.35459 1.96845 -102.68960 521.69400
2360.0000 -105.09046 -102.38702 2.70343 1.94768 -102.94455 489.95278
2365.0000 -104.65783 -101.28151 3.37633 2.04241 -101.78184 579.47078
2370.0000 -105.08742 -102.33746 2.74996 2.04217 -101.78478 566.28373
2375.0000 -105.40555 -102.60886 2.79669 1.98160 -102.52826 500.26208
2380.0000 -105.19378 -102.48074 2.71304 1.99526 -102.36059 541.46117
2385.0000 -105.06108 -101.39128 3.66980 1.99777 -102.32974 515.06005
2390.0000 -105.49698 -102.62346 2.87353 1.99398 -102.37632 528.29285
2395.0000 -105.44175 -102.28034 3.16141 1.96288 -102.75802 509.02615
2400.0000 -104.40541 -101.85253 2.55288 2.01471 -102.12186 544.91761
2405.0000 -105.73753 -103.20275 2.53478 1.99113 -102.41124 512.89784
2410.0000 -105.47569 -102.41663 3.05906 1.94526 -102.97426 483.71642
2415.0000 -105.07626 -101.79344 3.28281 2.01771 -102.08500 547.50136
2420.0000 -104.97241 -101.77265 3.19976 2.03268 -101.90131 589.70166
2425.0000 -105.68619 -102.43699 3.24920 1.98465 -102.49077 541.32181
2430.0000 -105.83150 -102.39505 3.43645 1.98051 -102.54157 541.91072
2435.0000 -106.63427 -103.24616 3.38811 1.96765 -102.69944 517.30932
2440.0000 -106.02617 -103.49594 2.53023 1.92902 -103.17357 490.37256
2445.0000 -105.28918 -102.25127 3.03791 1.98051 -102.54166 543.09799
2450.0000 -104.72233 -101.79463 2.92771 2.03411 -101.88370 576.46221
2455.0000 -105.86438 -102.76862 3.09576 1.99536 -102.35933 550.82099
2460.0000 -105.56707 -102.56001 3.00706 1.96838 -102.69054 504.57655
2465.0000 -105.99006 -103.25209 2.73797 1.96671 -102.71101 515.99979
2470.0000 -105.33089 -102.53758 2.79331 1.92911 -103.17249 479.78855
2475.0000 -105.91805 -102.69194 3.22610 1.96353 -102.74998 512.40500
2480.0000 -105.10130 -102.32265 2.77865 2.00663 -102.22099 550.83458
2485.0000 -106.20565 -102.98809 3.21756 1.99388 -102.37751 553.38999
2490.0000 -105.57401 -102.81700 2.75701 1.96455 -102.73751 532.41000
2495.0000 -105.68775 -103.28506 2.40269 1.94995 -102.91668 501.86863
2500.0000 -105.78489 -102.64125 3.14364 1.94939 -102.92358 523.48977
MELTING PROCESS: loop number 11 T-loop= 545.00000000000000
main_MD> interactions number 11 at Temperature= 545.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.35606 -1.45947 -2.41300
force_rgl> df(natom) 1.85878 -0.16498 0.13264
2505.0000 -105.69550 -102.57138 3.12412 2.00072 -102.29351 532.63279
2510.0000 -106.30648 -103.65616 2.65031 1.94838 -102.93593 502.47113
2515.0000 -105.09523 -102.56974 2.52549 1.93415 -103.11061 484.33938
2520.0000 -105.63103 -103.30563 2.32540 1.94683 -102.95503 494.70632
2525.0000 -104.69577 -101.75363 2.94215 2.00791 -102.20530 552.81568
2530.0000 -105.50880 -102.00564 3.50315 2.02505 -101.99498 575.60632
2535.0000 -104.72166 -101.61265 3.10901 2.02133 -102.04065 568.11741
2540.0000 -105.39695 -103.03098 2.36597 1.96879 -102.68551 510.23176
2545.0000 -105.11767 -102.72949 2.38817 1.96157 -102.77410 522.34023
2550.0000 -105.54259 -102.50161 3.04098 1.98663 -102.46648 516.92537
2555.0000 -105.52490 -102.74434 2.78056 1.96887 -102.68448 506.95319
2560.0000 -104.97573 -102.14551 2.83022 1.95127 -102.90056 473.63195
2565.0000 -105.33686 -102.27236 3.06450 1.98954 -102.43083 506.64810
2570.0000 -105.13366 -102.31287 2.82079 1.98940 -102.43246 518.66822
2575.0000 -105.03783 -101.60228 3.43555 2.00858 -102.19712 550.49834
2580.0000 -104.57886 -100.75702 3.82184 2.08335 -101.27939 617.66495
2585.0000 -104.61072 -101.03862 3.57211 2.10481 -101.01596 618.61513
2590.0000 -104.69982 -101.62177 3.07804 2.05811 -101.58913 535.92959
2595.0000 -104.92443 -102.40334 2.52109 1.99762 -102.33161 483.78666
2600.0000 -104.54428 -101.96880 2.57548 2.00691 -102.21757 532.65928
2605.0000 -105.22833 -102.30119 2.92714 2.02785 -101.96053 582.04720
2610.0000 -105.97290 -103.46711 2.50579 1.98495 -102.48709 537.65252
2615.0000 -104.99578 -102.00342 2.99235 1.98512 -102.48500 534.72658
2620.0000 -103.88967 -100.64189 3.24778 2.05094 -101.67717 543.26510
2625.0000 -104.56112 -101.27887 3.28225 2.13172 -100.68567 598.88515
2630.0000 -104.70403 -101.43519 3.26884 2.05685 -101.60459 560.13748
2635.0000 -104.70555 -101.82216 2.88339 2.05431 -101.63583 570.17547
2640.0000 -105.17793 -102.29848 2.87945 2.00642 -102.22361 543.44238
2645.0000 -104.88395 -102.08745 2.79650 1.99352 -102.38191 536.49621
2650.0000 -105.52452 -102.67766 2.84685 2.00338 -102.26089 549.89206
2655.0000 -105.41030 -102.00035 3.40994 1.98678 -102.46470 532.32881
2660.0000 -105.33664 -102.64119 2.69544 1.96482 -102.73416 520.62983
2665.0000 -105.56702 -103.00264 2.56437 2.02037 -102.05236 576.96549
2670.0000 -105.47328 -102.50852 2.96476 1.94811 -102.93928 523.34522
2675.0000 -105.43031 -102.53166 2.89866 2.01536 -102.11383 549.63405
2680.0000 -105.63727 -102.79143 2.84584 1.94765 -102.94500 499.17880
2685.0000 -105.28334 -102.58095 2.70239 1.97381 -102.62384 519.94755
2690.0000 -104.75225 -102.05023 2.70203 1.99985 -102.30422 548.55015
2695.0000 -106.09589 -102.74918 3.34671 2.00431 -102.24948 545.33619
2700.0000 -104.75429 -102.07263 2.68166 2.00159 -102.28285 549.85769
2705.0000 -104.94045 -102.46720 2.47325 2.01419 -102.12827 540.92699
2710.0000 -105.63647 -102.03772 3.59874 1.99792 -102.32795 532.25361
2715.0000 -105.52682 -101.75659 3.77023 2.02034 -102.05278 552.75060
2720.0000 -104.56373 -101.14611 3.41763 2.06354 -101.52247 584.47795
2725.0000 -105.34784 -102.19250 3.15534 2.07750 -101.35117 609.85155
2730.0000 -105.02630 -101.82291 3.20339 2.03567 -101.86460 567.81979
2735.0000 -104.75821 -101.74980 3.00842 2.03835 -101.83170 572.55539
2740.0000 -105.81068 -102.94612 2.86455 1.97652 -102.59056 526.62487
2745.0000 -105.56266 -102.56356 2.99911 1.93499 -103.10034 499.80620
2750.0000 -105.24446 -102.04264 3.20182 1.98642 -102.46903 536.11964
MELTING PROCESS: loop number 12 T-loop= 570.00000000000000
main_MD> interactions number 12 at Temperature= 570.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -2.96032 -1.92277 -3.23567
force_rgl> df(natom) 0.37663 0.44654 -2.22291
2755.0000 -105.05918 -102.76309 2.29609 2.01252 -102.14876 561.03207
2760.0000 -104.65713 -101.40089 3.25624 2.02385 -102.00971 573.10635
2765.0000 -103.91580 -101.56940 2.34640 2.08769 -101.22608 590.43452
2770.0000 -104.60069 -101.51449 3.08620 2.06897 -101.45592 590.59023
2775.0000 -104.32782 -100.46230 3.86551 2.06947 -101.44977 596.42365
2780.0000 -105.49105 -101.78549 3.70556 2.11143 -100.93472 676.23213
2785.0000 -104.55751 -101.55486 3.00265 2.08465 -101.26343 618.07322
2790.0000 -105.29146 -102.24690 3.04456 2.01648 -102.10013 544.75531
2795.0000 -104.47993 -101.22678 3.25315 2.03144 -101.91652 575.92223
2800.0000 -104.62318 -101.72327 2.89990 2.05565 -101.61937 585.53690
2805.0000 -105.31686 -101.67543 3.64142 2.03570 -101.86425 572.63124
2810.0000 -104.42167 -101.57208 2.84959 2.03322 -101.89462 566.89714
2815.0000 -105.15942 -102.60854 2.55087 2.04596 -101.73827 572.90761
2820.0000 -105.20811 -101.45082 3.75728 2.05630 -101.61145 587.11183
2825.0000 -105.37753 -102.07413 3.30341 2.01567 -102.11002 543.55517
2830.0000 -105.21209 -102.31841 2.89368 1.99592 -102.35242 530.32153
2835.0000 -104.16286 -100.12044 4.04242 2.07136 -101.42651 603.92109
2840.0000 -103.73955 -100.11830 3.62125 2.19172 -99.94932 683.65388
2845.0000 -104.21830 -100.60528 3.61302 2.14429 -100.53140 635.77939
2850.0000 -104.40268 -100.34779 4.05489 2.17348 -100.17309 678.30237
2855.0000 -103.77907 -100.35388 3.42518 2.16670 -100.25636 662.69696
2860.0000 -104.34464 -101.00646 3.33818 2.14767 -100.48993 629.92506
2865.0000 -104.12245 -101.12064 3.00181 2.08943 -101.20470 600.65865
2870.0000 -105.25800 -102.69442 2.56359 1.99671 -102.34276 524.38114
2875.0000 -105.64623 -102.76137 2.88486 1.97065 -102.66262 518.10775
2880.0000 -104.89417 -101.85452 3.03966 2.00726 -102.21325 574.04651
2885.0000 -105.62054 -103.42305 2.19749 2.00164 -102.28224 541.05355
2890.0000 -105.66707 -102.96083 2.70624 1.93266 -103.12896 470.59886
2895.0000 -104.87912 -101.95637 2.92275 2.04430 -101.75862 572.38204
2900.0000 -105.36690 -102.16965 3.19725 2.01702 -102.09344 576.31186
2905.0000 -105.71089 -103.18431 2.52657 1.99200 -102.40061 548.86976
2910.0000 -104.97096 -101.46840 3.50256 1.98974 -102.42836 542.53219
2915.0000 -104.65857 -100.93942 3.71915 2.08356 -101.27675 599.92218
2920.0000 -104.56288 -101.79697 2.76592 2.08128 -101.30480 597.88989
2925.0000 -104.83597 -101.80489 3.03108 2.06196 -101.54192 600.25940
2930.0000 -105.38488 -102.78916 2.59573 1.99685 -102.34105 510.03237
2935.0000 -105.30326 -102.75075 2.55251 1.94217 -103.01220 502.36901
2940.0000 -105.15472 -102.42223 2.73249 1.99444 -102.37069 528.53217
2945.0000 -104.62779 -101.46688 3.16091 2.00891 -102.19302 528.44681
2950.0000 -105.54188 -102.15599 3.38589 2.04937 -101.69646 575.32651
2955.0000 -104.90520 -101.31242 3.59278 2.05766 -101.59464 600.44305
2960.0000 -104.49951 -100.94637 3.55314 2.10732 -100.98517 647.83514
2965.0000 -104.69496 -101.03218 3.66278 2.09255 -101.16645 627.04452
2970.0000 -105.50900 -102.09521 3.41379 2.04450 -101.75627 583.03075
2975.0000 -104.54256 -101.43151 3.11105 2.04695 -101.72617 561.55050
2980.0000 -104.30165 -100.51486 3.78679 2.10725 -100.98601 600.63333
2985.0000 -103.97316 -101.31632 2.65684 2.11538 -100.88623 641.51144
2990.0000 -104.31600 -101.83787 2.47813 2.05833 -101.58642 571.47166
2995.0000 -104.90278 -101.41789 3.48489 2.05429 -101.63607 557.74085
3000.0000 -104.91145 -101.48457 3.42688 2.06789 -101.46907 582.31104
MELTING PROCESS: loop number 13 T-loop= 595.00000000000000
main_MD> interactions number 13 at Temperature= 595.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.06433 -1.95591 1.43009
force_rgl> df(natom) -0.40331 -2.88968 -4.34923
3005.0000 -105.31931 -102.17708 3.14223 2.02239 -102.02762 546.59098
3010.0000 -104.59871 -101.35668 3.24204 2.04871 -101.70450 586.73870
3015.0000 -105.07054 -101.81938 3.25116 2.06178 -101.54414 586.49003
3020.0000 -105.32692 -102.57652 2.75039 2.02012 -102.05542 533.30679
3025.0000 -104.61933 -100.78463 3.83470 2.09250 -101.16704 604.71678
3030.0000 -103.85888 -100.08586 3.77301 2.11799 -100.85424 631.14001
3035.0000 -104.73240 -101.30579 3.42661 2.18663 -100.01178 691.18811
3040.0000 -104.85556 -101.29329 3.56227 2.04328 -101.77117 561.69629
3045.0000 -105.00136 -101.24974 3.75162 2.08536 -101.25470 638.35816
3050.0000 -105.84580 -102.54355 3.30225 2.02147 -102.03887 606.61879
3055.0000 -105.52404 -102.57458 2.94945 2.01139 -102.16260 570.15403
3060.0000 -105.34369 -102.33020 3.01349 1.99292 -102.38932 546.22250
3065.0000 -104.75596 -100.76181 3.99415 2.09749 -101.10587 635.34310
3070.0000 -103.95370 -101.01166 2.94204 2.11216 -100.92578 635.00450
3075.0000 -105.17834 -101.00947 4.16887 2.10508 -101.01268 632.43845
3080.0000 -103.92712 -100.14800 3.77912 2.07355 -101.39969 583.30847
3085.0000 -104.55972 -100.97935 3.58037 2.15554 -100.39338 690.49541
3090.0000 -104.46548 -100.38850 4.07698 2.09812 -101.09816 641.23589
3095.0000 -104.28095 -101.16900 3.11196 2.14881 -100.47597 639.98098
3100.0000 -104.02505 -100.54981 3.47524 2.10261 -101.04300 582.98096
3105.0000 -104.15765 -100.44039 3.71726 2.13664 -100.62531 649.07947
3110.0000 -104.73138 -100.55952 4.17186 2.15953 -100.34430 649.39294
3115.0000 -103.66708 -100.21582 3.45126 2.14101 -100.57173 655.19492
3120.0000 -104.53897 -100.16838 4.37059 2.18864 -99.98710 695.01259
3125.0000 -104.01401 -99.46424 4.54977 2.18758 -100.00013 719.19400
3130.0000 -104.44954 -100.74694 3.70260 2.16505 -100.27657 650.66436
3135.0000 -104.57902 -101.30882 3.27020 2.09445 -101.14318 599.95187
3140.0000 -104.70772 -101.29406 3.41365 2.11429 -100.89959 626.56881
3145.0000 -105.01023 -101.62420 3.38603 2.07051 -101.43701 598.92959
3150.0000 -103.98788 -101.29516 2.69272 2.06671 -101.48366 570.94124
3155.0000 -105.29253 -102.24964 3.04289 2.01725 -102.09064 554.16491
3160.0000 -104.62298 -101.28143 3.34155 2.07556 -101.37494 598.45587
3165.0000 -104.54472 -100.88183 3.66289 2.06752 -101.47371 590.69576
3170.0000 -105.17110 -101.91730 3.25380 2.08135 -101.30393 635.15780
3175.0000 -104.98462 -101.53445 3.45017 2.04195 -101.78755 558.88372
3180.0000 -103.83217 -101.40218 2.43000 2.07545 -101.37639 590.98573
3185.0000 -104.24546 -100.59412 3.65134 2.12138 -100.81263 636.02815
3190.0000 -103.73043 -101.02524 2.70518 2.11502 -100.89073 620.46388
3195.0000 -104.65541 -100.81019 3.84522 2.12587 -100.75744 633.35572
3200.0000 -104.58165 -101.19746 3.38419 2.10283 -101.04030 622.47441
3205.0000 -104.93567 -101.37093 3.56475 2.05445 -101.63414 577.87810
3210.0000 -104.60729 -101.09143 3.51586 2.09383 -101.15070 622.23512
3215.0000 -103.89679 -100.76449 3.13229 2.11014 -100.95052 627.29005
3220.0000 -104.42698 -100.59574 3.83124 2.14973 -100.46461 656.17387
3225.0000 -105.11928 -101.40939 3.70989 2.11778 -100.85679 621.47677
3230.0000 -104.65400 -101.58182 3.07219 2.02264 -102.02455 575.29006
3235.0000 -104.64118 -101.71251 2.92867 2.06877 -101.45832 586.02074
3240.0000 -105.29520 -101.20788 4.08733 2.05155 -101.66964 585.73606
3245.0000 -104.49445 -101.23710 3.25735 2.08751 -101.22826 605.38897
3250.0000 -104.27800 -101.16323 3.11477 2.08452 -101.26508 563.43768
MELTING PROCESS: loop number 14 T-loop= 620.00000000000000
main_MD> interactions number 14 at Temperature= 620.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.18678 -5.45751 0.92029
force_rgl> df(natom) -1.17992 2.33112 2.60341
3255.0000 -104.29931 -100.88498 3.41433 2.07409 -101.39298 559.46569
3260.0000 -104.92659 -101.70561 3.22097 2.07932 -101.32888 596.27871
3265.0000 -105.18443 -101.60448 3.57994 2.03348 -101.89150 547.01503
3270.0000 -104.36791 -101.19706 3.17085 2.06235 -101.53710 576.92800
3275.0000 -104.37213 -100.96195 3.41017 2.11460 -100.89577 630.06890
3280.0000 -104.82302 -101.08796 3.73506 2.15324 -100.42152 676.56300
3285.0000 -104.62249 -100.60859 4.01390 2.12425 -100.77737 631.44222
3290.0000 -104.47745 -101.29281 3.18464 2.10297 -101.03860 636.02522
3295.0000 -104.61987 -101.25742 3.36244 2.08594 -101.24754 609.35452
3300.0000 -104.31162 -100.46926 3.84236 2.14216 -100.55761 644.17831
3305.0000 -104.35437 -100.67918 3.67519 2.14067 -100.57591 632.77896
3310.0000 -104.42228 -100.71563 3.70665 2.11867 -100.84581 643.05103
3315.0000 -104.05297 -101.07988 2.97309 2.10632 -100.99745 616.68163
3320.0000 -104.72386 -101.39540 3.32847 2.06930 -101.45186 554.21448
3325.0000 -105.33957 -102.39088 2.94869 2.03674 -101.85151 560.67322
3330.0000 -104.92916 -101.99416 2.93500 2.00509 -102.23995 533.42552
3335.0000 -104.79033 -102.00092 2.78941 2.00337 -102.26103 530.90544
3340.0000 -104.30937 -101.27789 3.03147 2.09581 -101.12649 611.95636
3345.0000 -104.38179 -101.28214 3.09965 2.09579 -101.12669 600.23311
3350.0000 -104.36529 -100.78192 3.58337 2.11839 -100.84933 619.78682
3355.0000 -103.72731 -100.76886 2.95845 2.08842 -101.21718 624.14959
3360.0000 -103.71609 -100.65086 3.06523 2.13855 -100.60186 654.49074
3365.0000 -104.84660 -101.85752 2.98909 2.06925 -101.45242 581.91418
3370.0000 -104.82023 -101.03565 3.78458 2.07294 -101.40717 596.58521
3375.0000 -105.22422 -101.80969 3.41453 2.08120 -101.30583 607.36384
3380.0000 -105.01218 -102.08153 2.93066 2.05924 -101.57531 576.71746
3385.0000 -104.95515 -101.17101 3.78414 2.05260 -101.65683 591.94409
3390.0000 -104.72658 -101.11179 3.61478 2.10439 -101.02113 633.44044
3395.0000 -104.89531 -101.18192 3.71339 2.05190 -101.66538 572.35909
3400.0000 -104.43305 -101.79635 2.63670 2.05115 -101.67456 553.50290
3405.0000 -104.95366 -101.90161 3.05205 2.06547 -101.49890 582.45730
3410.0000 -104.31160 -100.44165 3.86995 2.11923 -100.83898 621.86652
3415.0000 -105.05039 -101.43444 3.61595 2.10255 -101.04373 626.14156
3420.0000 -105.17017 -101.90324 3.26692 2.05013 -101.68706 598.30114
3425.0000 -104.77362 -101.22912 3.54450 2.06002 -101.56567 610.70052
3430.0000 -104.59868 -100.91691 3.68177 2.08106 -101.30753 626.32912
3435.0000 -104.94683 -101.10637 3.84047 2.11357 -100.90851 632.98672
3440.0000 -104.64835 -100.91425 3.73410 2.08722 -101.23184 586.53025
3445.0000 -104.40642 -100.45599 3.95043 2.17938 -100.10070 695.30368
3450.0000 -104.10721 -100.17139 3.93582 2.17862 -100.11008 705.91893
3455.0000 -104.42392 -100.75834 3.66558 2.12688 -100.74506 671.37886
3460.0000 -103.79568 -100.91953 2.87615 2.11407 -100.90234 632.75746
3465.0000 -103.33463 -100.02856 3.30607 2.14337 -100.54267 630.73756
3470.0000 -104.85455 -100.24173 4.61282 2.18042 -100.08801 675.94622
3475.0000 -104.90719 -101.56331 3.34388 2.04326 -101.77146 570.43453
3480.0000 -104.24853 -100.50711 3.74143 2.04833 -101.70920 571.35475
3485.0000 -104.62062 -101.55569 3.06492 2.09966 -101.07921 629.79530
3490.0000 -104.54786 -100.96009 3.58777 2.13047 -100.70103 627.35112
3495.0000 -104.06859 -100.92602 3.14258 2.10296 -101.03871 650.01508
3500.0000 -104.15277 -100.33773 3.81505 2.15255 -100.43000 665.77303
MELTING PROCESS: loop number 15 T-loop= 645.00000000000000
main_MD> interactions number 15 at Temperature= 645.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.95295 -0.76904 1.75962
force_rgl> df(natom) 1.83671 1.20540 -3.92804
3505.0000 -103.32672 -99.82483 3.50189 2.19984 -99.84965 698.53647
3510.0000 -104.40347 -100.05597 4.34750 2.20241 -99.81802 703.34133
3515.0000 -103.00369 -99.09608 3.90761 2.20614 -99.77230 679.22894
3520.0000 -104.09430 -100.34828 3.74602 2.21515 -99.66172 714.30236
3525.0000 -104.25997 -100.48724 3.77274 2.16876 -100.23109 685.40627
3530.0000 -104.47984 -100.44710 4.03275 2.16977 -100.21872 681.18498
3535.0000 -104.06285 -100.46983 3.59302 2.16536 -100.27279 676.44805
3540.0000 -103.35781 -99.48739 3.87042 2.16485 -100.27904 676.13791
3545.0000 -104.08021 -100.14594 3.93427 2.22909 -99.49062 749.03474
3550.0000 -104.40334 -100.78900 3.61434 2.14404 -100.53448 669.00619
3555.0000 -104.80145 -101.44991 3.35154 2.13247 -100.67651 657.24831
3560.0000 -104.64658 -101.15012 3.49646 2.08136 -101.30387 598.20082
3565.0000 -103.76621 -99.29343 4.47279 2.18684 -100.00921 696.63933
3570.0000 -104.96518 -100.86459 4.10058 2.20668 -99.76565 687.34080
3575.0000 -104.88967 -101.70500 3.18467 2.05223 -101.66137 563.15814
3580.0000 -105.94528 -102.38435 3.56093 2.01876 -102.07216 545.95095
3585.0000 -105.36141 -101.78614 3.57527 2.01658 -102.09887 551.93375
3590.0000 -105.08084 -101.42446 3.65637 2.09362 -101.15332 622.42182
3595.0000 -103.40660 -99.75690 3.64970 2.12745 -100.73809 652.28269
3600.0000 -103.40864 -99.64640 3.76224 2.20947 -99.73135 678.90767
3605.0000 -103.77850 -100.26276 3.51573 2.16274 -100.30497 660.27616
3610.0000 -104.99407 -101.28504 3.70903 2.11084 -100.94196 612.41219
3615.0000 -104.22037 -99.39467 4.82570 2.13741 -100.61592 669.72060
3620.0000 -104.54177 -100.46595 4.07583 2.19073 -99.96143 674.43080
3625.0000 -103.97502 -100.64189 3.33313 2.14554 -100.51607 649.52719
3630.0000 -104.88127 -100.87222 4.00904 2.15415 -100.41039 692.75512
3635.0000 -104.44288 -101.12147 3.32141 2.10259 -101.04318 625.09899
3640.0000 -105.11471 -100.99011 4.12460 2.11256 -100.92087 610.63932
3645.0000 -104.51587 -100.76747 3.74840 2.10362 -101.03056 631.00869
3650.0000 -104.40451 -100.72148 3.68302 2.13820 -100.60621 684.10206
3655.0000 -104.92075 -102.13751 2.78324 2.13667 -100.62500 663.77648
3660.0000 -105.21523 -102.41706 2.79817 2.03207 -101.90875 558.34129
3665.0000 -105.09941 -101.84922 3.25019 2.02536 -101.99109 566.24415
3670.0000 -104.72207 -101.34095 3.38112 2.02949 -101.94046 567.52415
3675.0000 -103.85582 -99.97639 3.87942 2.16393 -100.29030 637.97443
3680.0000 -103.40877 -99.78028 3.62848 2.22394 -99.55383 705.22215
3685.0000 -103.17928 -99.18661 3.99266 2.20829 -99.74588 673.54597
3690.0000 -104.36774 -100.60657 3.76117 2.18535 -100.02746 670.04960
3695.0000 -104.50211 -101.28203 3.22008 2.13421 -100.65520 625.18455
3700.0000 -103.77285 -100.08374 3.68910 2.15635 -100.38338 663.94044
3705.0000 -104.53242 -101.05223 3.48019 2.12899 -100.71921 648.73291
3710.0000 -105.21878 -101.44498 3.77380 2.09100 -101.18547 628.30960
3715.0000 -104.09248 -100.95728 3.13520 2.08744 -101.22923 613.78433
3720.0000 -103.65833 -99.41596 4.24237 2.17017 -100.21376 660.96480
3725.0000 -104.30695 -100.22766 4.07929 2.22214 -99.57588 709.20178
3730.0000 -103.98318 -100.26761 3.71557 2.14588 -100.51184 637.03390
3735.0000 -103.87699 -100.44006 3.43693 2.12491 -100.76929 639.52926
3740.0000 -103.71514 -99.77084 3.94430 2.16368 -100.29345 689.36452
3745.0000 -104.19583 -101.06434 3.13148 2.12769 -100.73517 641.70383
3750.0000 -104.70368 -101.24466 3.45902 2.10504 -101.01314 609.79803
MELTING PROCESS: loop number 16 T-loop= 670.00000000000000
main_MD> interactions number 16 at Temperature= 670.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.87051 -0.49656 0.54744
force_rgl> df(natom) 0.13842 -1.75207 -1.20386
3755.0000 -104.50264 -101.14097 3.36167 2.11022 -100.94963 619.54143
3760.0000 -105.41676 -101.38656 4.03020 2.08417 -101.26935 610.12617
3765.0000 -105.17503 -101.77819 3.39684 2.02014 -102.05522 560.15120
3770.0000 -104.66742 -100.63014 4.03728 2.09306 -101.16025 628.90278
3775.0000 -103.45972 -100.39120 3.06852 2.15435 -100.40797 675.17348
3780.0000 -103.70052 -100.21025 3.49026 2.13659 -100.62587 618.13773
3785.0000 -102.75826 -98.11292 4.64534 2.24605 -99.28241 739.08201
3790.0000 -102.87619 -98.55428 4.32190 2.32057 -98.36784 780.34580
3795.0000 -103.10251 -99.26503 3.83748 2.26938 -98.99603 724.01526
3800.0000 -104.19067 -100.59442 3.59625 2.21676 -99.64195 700.29820
3805.0000 -103.44222 -99.77770 3.66453 2.22885 -99.49351 701.42738
3810.0000 -104.46916 -99.59747 4.87168 2.26272 -99.07786 700.37745
3815.0000 -103.18752 -99.17580 4.01172 2.22691 -99.51736 731.60382
3820.0000 -102.50907 -98.84129 3.66778 2.23129 -99.46355 725.51547
3825.0000 -103.50632 -99.67156 3.83476 2.20448 -99.79265 689.75941
3830.0000 -103.80374 -100.25508 3.54867 2.17393 -100.16761 674.05341
3835.0000 -103.99586 -99.91102 4.08484 2.14520 -100.52030 644.76012
3840.0000 -103.43612 -100.08729 3.34884 2.19145 -99.95264 710.11392
3845.0000 -104.43159 -101.29197 3.13962 2.15715 -100.37359 671.31623
3850.0000 -104.80482 -101.05864 3.74618 2.07190 -101.41996 613.47381
3855.0000 -104.29814 -100.98585 3.31229 2.09783 -101.10163 612.87975
3860.0000 -104.36665 -101.41788 2.94878 2.09580 -101.12653 596.45391
3865.0000 -104.46344 -100.82652 3.63693 2.08406 -101.27061 611.08886
3870.0000 -103.96303 -100.13071 3.83233 2.15496 -100.40049 673.48439
3875.0000 -104.39748 -99.64522 4.75226 2.21626 -99.64811 711.68147
3880.0000 -103.59872 -99.30314 4.29558 2.22217 -99.57552 722.40436
3885.0000 -102.47970 -98.80929 3.67041 2.25079 -99.22429 731.34728
3890.0000 -102.78204 -99.07037 3.71167 2.27270 -98.95534 749.95930
3895.0000 -102.68047 -98.93823 3.74225 2.29306 -98.70539 776.86022
3900.0000 -103.62705 -99.55423 4.07282 2.23826 -99.37804 716.65514
3905.0000 -103.22956 -98.69867 4.53089 2.27495 -98.92777 760.90297
3910.0000 -104.02190 -100.34857 3.67333 2.21626 -99.64801 704.30172
3915.0000 -104.66780 -100.72481 3.94299 2.12876 -100.72201 651.12013
3920.0000 -104.17355 -100.36533 3.80822 2.11655 -100.87185 651.50487
3925.0000 -104.30698 -100.85384 3.45314 2.11667 -100.87048 645.71997
3930.0000 -105.23289 -100.76844 4.46445 2.17022 -100.21311 669.22237
3935.0000 -104.19881 -100.67426 3.52455 2.09580 -101.12655 636.16484
3940.0000 -103.99033 -100.56278 3.42755 2.11807 -100.85320 637.74611
3945.0000 -103.75195 -99.79837 3.95357 2.16899 -100.22830 674.37645
3950.0000 -103.83079 -99.91383 3.91696 2.20793 -99.75028 699.37964
3955.0000 -103.76771 -100.67642 3.09129 2.15048 -100.45548 642.79929
3960.0000 -104.41108 -101.19303 3.21806 2.12535 -100.76383 632.61152
3965.0000 -104.51814 -100.99264 3.52550 2.11584 -100.88062 624.86400
3970.0000 -105.15920 -100.87514 4.28405 2.11642 -100.87352 666.64240
3975.0000 -103.45418 -98.98302 4.47117 2.18849 -99.98892 694.27151
3980.0000 -102.49186 -99.48030 3.01156 2.26456 -99.05520 745.48055
3985.0000 -103.05943 -98.41905 4.64038 2.25154 -99.21507 728.04923
3990.0000 -103.81886 -99.85258 3.96628 2.25069 -99.22553 767.87144
3995.0000 -103.53480 -99.41660 4.11821 2.21546 -99.65786 721.12138
4000.0000 -102.66213 -99.35222 3.30991 2.23685 -99.39531 722.61333
MELTING PROCESS: loop number 17 T-loop= 695.00000000000000
main_MD> interactions number 17 at Temperature= 695.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.53772 -1.17106 -0.36727
force_rgl> df(natom) 2.65082 0.28752 -0.76903
4005.0000 -103.87347 -99.15077 4.72270 2.24902 -99.24603 706.03233
4010.0000 -103.49514 -98.95457 4.54057 2.25290 -99.19833 730.66556
4015.0000 -103.68443 -99.72023 3.96419 2.24626 -99.27981 741.43594
4020.0000 -103.14229 -99.24496 3.89733 2.24323 -99.31709 749.18507
4025.0000 -103.57831 -99.58508 3.99324 2.23382 -99.43256 701.86721
4030.0000 -104.49143 -100.90886 3.58257 2.20609 -99.77288 693.38956
4035.0000 -103.61327 -99.71606 3.89721 2.12165 -100.80934 649.53581
4040.0000 -104.14800 -100.06687 4.08113 2.17922 -100.10275 682.20652
4045.0000 -103.48851 -100.07285 3.41566 2.17578 -100.14491 686.17394
4050.0000 -103.84147 -100.30669 3.53479 2.16436 -100.28511 685.74073
4055.0000 -103.47395 -99.33063 4.14331 2.18315 -100.05442 692.10266
4060.0000 -103.73656 -99.42393 4.31263 2.23485 -99.41989 752.18179
4065.0000 -104.09241 -100.46626 3.62615 2.17650 -100.13603 696.13020
4070.0000 -103.33178 -100.28033 3.05145 2.15304 -100.42399 658.54818
4075.0000 -104.47450 -100.32687 4.14764 2.21848 -99.62088 711.64235
4080.0000 -103.49315 -99.94667 3.54648 2.15189 -100.43811 657.40736
4085.0000 -104.11528 -100.69813 3.41715 2.15255 -100.43002 658.67467
4090.0000 -104.04504 -100.30931 3.73572 2.15817 -100.36108 671.97317
4095.0000 -103.52288 -99.90680 3.61608 2.20593 -99.77483 697.98115
4100.0000 -103.25117 -99.41243 3.83875 2.22280 -99.56775 700.44004
4105.0000 -103.17418 -98.85945 4.31473 2.24302 -99.31962 705.98098
4110.0000 -102.59314 -98.29665 4.29648 2.33310 -98.21403 811.77108
4115.0000 -102.69681 -97.59170 5.10511 2.33426 -98.19974 766.57589
4120.0000 -102.15153 -97.84838 4.30315 2.40462 -97.33612 827.61602
4125.0000 -102.92236 -98.86617 4.05618 2.30418 -98.56891 747.44172
4130.0000 -103.15293 -98.52077 4.63216 2.26515 -99.04804 702.15655
4135.0000 -102.71207 -99.12957 3.58250 2.28054 -98.85917 723.14968
4140.0000 -103.87339 -99.50593 4.36746 2.22632 -99.52454 699.92312
4145.0000 -103.70863 -100.62458 3.08406 2.20140 -99.83046 675.48766
4150.0000 -103.66848 -99.97235 3.69613 2.17746 -100.12424 670.09937
4155.0000 -103.64005 -99.70489 3.93516 2.21157 -99.70558 701.29128
4160.0000 -103.86599 -99.91234 3.95365 2.21065 -99.71698 681.29811
4165.0000 -103.94786 -99.74905 4.19881 2.17628 -100.13872 659.94949
4170.0000 -102.51889 -98.38301 4.13589 2.26415 -99.06024 722.37998
4175.0000 -103.49645 -98.92734 4.56911 2.26149 -99.09289 739.28733
4180.0000 -104.04499 -100.03623 4.00876 2.21095 -99.71326 703.73785
4185.0000 -103.67653 -99.34662 4.32991 2.19800 -99.87225 665.77182
4190.0000 -104.97413 -101.08673 3.88741 2.13337 -100.66542 624.76150
4195.0000 -104.81072 -100.86754 3.94318 2.11994 -100.83028 640.22257
4200.0000 -103.55889 -99.77034 3.78855 2.15249 -100.43081 685.22910
4205.0000 -103.21184 -99.69545 3.51639 2.19094 -99.95889 667.59811
4210.0000 -104.32999 -99.77741 4.55258 2.20738 -99.75704 715.73670
4215.0000 -103.54192 -99.95329 3.58862 2.18131 -100.07699 692.30305
4220.0000 -104.96595 -101.37292 3.59303 2.07355 -101.39961 598.65306
4225.0000 -103.62285 -99.18172 4.44113 2.11844 -100.84875 643.38162
4230.0000 -103.34916 -99.86021 3.48894 2.22095 -99.59053 713.34923
4235.0000 -103.44471 -99.32361 4.12110 2.20180 -99.82551 681.82762
4240.0000 -102.70396 -99.45747 3.24649 2.23654 -99.39913 714.40772
4245.0000 -103.44408 -98.81837 4.62571 2.24516 -99.29336 747.60634
4250.0000 -102.92612 -98.47422 4.45190 2.30803 -98.52168 811.38623
MELTING PROCESS: loop number 18 T-loop= 720.00000000000000
main_MD> interactions number 18 at Temperature= 720.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.87188 -0.89822 2.56665
force_rgl> df(natom) -1.81777 -0.67185 0.13577
4255.0000 -101.70907 -97.10421 4.60486 2.36329 -97.84349 834.76505
4260.0000 -103.62891 -99.37272 4.25620 2.34450 -98.07409 802.94184
4265.0000 -103.69313 -99.64785 4.04529 2.25824 -99.13280 743.54521
4270.0000 -103.34742 -99.70492 3.64251 2.26566 -99.04177 754.00877
4275.0000 -103.35268 -99.56109 3.79159 2.24353 -99.31342 732.55433
4280.0000 -103.17947 -99.13778 4.04170 2.21410 -99.67455 718.02483
4285.0000 -104.26801 -100.58414 3.68387 2.22100 -99.58993 705.04800
4290.0000 -102.64233 -99.20470 3.43763 2.19857 -99.86518 727.07597
4295.0000 -105.07757 -100.30485 4.77272 2.18962 -99.97505 687.41958
4300.0000 -103.28037 -99.01218 4.26819 2.22418 -99.55088 723.76848
4305.0000 -103.17022 -99.01829 4.15193 2.24630 -99.27935 754.67470
4310.0000 -103.38852 -99.25099 4.13753 2.25441 -99.17986 724.60887
4315.0000 -103.74563 -100.17679 3.56884 2.20800 -99.74949 697.38365
4320.0000 -104.86440 -100.12952 4.73488 2.18106 -100.08014 676.77129
4325.0000 -102.52640 -98.79710 3.72930 2.16698 -100.25294 658.83395
4330.0000 -102.45287 -99.12506 3.32781 2.24867 -99.25030 709.28095
4335.0000 -103.04803 -99.18565 3.86238 2.27451 -98.93311 735.99518
4340.0000 -103.62119 -99.24395 4.37724 2.25312 -99.19561 699.14025
4345.0000 -103.44091 -99.97368 3.46723 2.25871 -99.12707 698.55594
4350.0000 -103.35963 -99.57503 3.78460 2.20082 -99.83762 651.55990
4355.0000 -102.24186 -98.94638 3.29548 2.21918 -99.61229 648.63400
4360.0000 -102.97511 -99.07373 3.90138 2.25161 -99.21418 695.44330
4365.0000 -104.45789 -100.51406 3.94383 2.27356 -98.94476 748.37604
4370.0000 -104.23591 -99.67611 4.55980 2.17455 -100.16005 687.15229
4375.0000 -103.99404 -99.66048 4.33356 2.21031 -99.72110 731.74628
4380.0000 -103.40718 -99.29652 4.11066 2.21539 -99.65875 702.98042
4385.0000 -103.33408 -100.01372 3.32036 2.19957 -99.85298 695.91699
4390.0000 -103.32087 -98.94395 4.37692 2.22152 -99.58349 717.63261
4395.0000 -104.17782 -100.40428 3.77355 2.19982 -99.84989 701.64615
4400.0000 -104.24211 -100.28071 3.96141 2.17176 -100.19431 680.78333
4405.0000 -103.82046 -100.21846 3.60199 2.16386 -100.29125 676.32846
4410.0000 -104.18034 -101.00721 3.17314 2.11993 -100.83045 635.42023
4415.0000 -103.91578 -99.96377 3.95201 2.06443 -101.51165 589.84233
4420.0000 -102.41922 -98.86153 3.55769 2.24399 -99.30771 697.22203
4425.0000 -103.48695 -99.31691 4.17003 2.26571 -99.04119 742.56884
4430.0000 -104.37528 -100.59868 3.77660 2.21642 -99.64608 728.20160
4435.0000 -103.35149 -99.47393 3.87756 2.20061 -99.84011 704.97594
4440.0000 -102.55156 -98.78368 3.76788 2.22155 -99.58320 736.42537
4445.0000 -102.78657 -98.31789 4.46868 2.30956 -98.50296 775.39406
4450.0000 -102.41613 -98.08938 4.32676 2.29156 -98.72382 765.54125
4455.0000 -103.06799 -99.11761 3.95038 2.28626 -98.78893 797.83537
4460.0000 -102.36471 -98.75560 3.60910 2.26444 -99.05667 754.83238
4465.0000 -103.15265 -98.88002 4.27262 2.30496 -98.55934 800.70921
4470.0000 -102.63746 -97.81353 4.82393 2.30396 -98.57166 788.95358
4475.0000 -103.76026 -98.86526 4.89500 2.35510 -97.94402 848.47001
4480.0000 -103.42762 -99.82331 3.60431 2.24959 -99.23896 740.41105
4485.0000 -103.53667 -100.04202 3.49465 2.19764 -99.87663 724.48945
4490.0000 -103.86011 -99.37941 4.48070 2.21035 -99.72060 731.85495
4495.0000 -103.14206 -99.91096 3.23110 2.22331 -99.56152 733.29357
4500.0000 -103.73474 -99.37095 4.36379 2.22613 -99.52695 732.78331
MELTING PROCESS: loop number 19 T-loop= 745.00000000000000
main_MD> interactions number 19 at Temperature= 745.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -3.09804 -0.86548 -0.31142
force_rgl> df(natom) -0.91526 -5.68668 -8.01904
4505.0000 -103.77828 -99.59307 4.18521 2.24187 -99.33372 730.39198
4510.0000 -102.86709 -98.79413 4.07297 2.20742 -99.75658 724.61073
4515.0000 -103.23162 -98.72869 4.50293 2.28366 -98.82076 780.13672
4520.0000 -103.25628 -98.77285 4.48343 2.26238 -99.08198 751.27812
4525.0000 -102.36458 -98.39088 3.97370 2.34156 -98.11020 799.04233
4530.0000 -102.16091 -97.94917 4.21175 2.34978 -98.00922 806.70741
4535.0000 -102.09086 -98.26327 3.82759 2.36425 -97.83167 860.74374
4540.0000 -102.55892 -98.76320 3.79572 2.31819 -98.39694 774.38033
4545.0000 -102.09180 -97.42545 4.66635 2.30038 -98.61561 738.14870
4550.0000 -102.15107 -98.10389 4.04718 2.34380 -98.08267 822.85462
4555.0000 -103.18588 -98.62825 4.55762 2.25110 -99.22049 718.50955
4560.0000 -104.07755 -100.39781 3.67973 2.22627 -99.52521 735.64445
4565.0000 -104.04984 -99.50798 4.54187 2.19374 -99.92448 717.00481
4570.0000 -103.20309 -98.60527 4.59782 2.27668 -98.90655 764.53682
4575.0000 -103.89518 -98.98949 4.90569 2.24171 -99.33573 718.59105
4580.0000 -103.62327 -99.99572 3.62756 2.24480 -99.29779 762.31802
4585.0000 -103.05191 -99.62173 3.43019 2.24869 -99.25003 728.75498
4590.0000 -103.14224 -98.73539 4.40685 2.25810 -99.13456 732.72715
4595.0000 -102.33545 -98.14104 4.19441 2.25618 -99.15808 748.59978
4600.0000 -102.53127 -97.91782 4.61346 2.34120 -98.11459 800.49490
4605.0000 -102.56499 -98.79292 3.77207 2.32173 -98.35351 786.40572
4610.0000 -103.52852 -99.80370 3.72483 2.25913 -99.12184 725.41057
4615.0000 -102.73610 -99.19699 3.53911 2.29094 -98.73146 746.12752
4620.0000 -102.42372 -99.22509 3.19863 2.24099 -99.34456 703.19919
4625.0000 -103.40810 -99.59228 3.81582 2.23950 -99.36285 730.86322
4630.0000 -103.64133 -99.91605 3.72527 2.22430 -99.54941 713.90435
4635.0000 -104.52761 -100.13896 4.38864 2.16934 -100.22390 703.40756
4640.0000 -104.90335 -101.44733 3.45602 2.14701 -100.49801 680.92302
4645.0000 -103.22529 -99.30793 3.91736 2.18309 -100.05520 697.53276
4650.0000 -102.09834 -97.94057 4.15776 2.30242 -98.59056 763.33447
4655.0000 -102.56160 -98.34264 4.21896 2.32476 -98.31638 796.44538
4660.0000 -103.05131 -98.59894 4.45237 2.31475 -98.43924 777.23225
4665.0000 -102.58695 -98.72383 3.86313 2.26965 -98.99281 750.03993
4670.0000 -103.15561 -99.67877 3.47683 2.25963 -99.11578 690.41297
4675.0000 -102.78016 -98.15765 4.62252 2.28317 -98.82678 757.87605
4680.0000 -103.34133 -99.40994 3.93139 2.27459 -98.93211 750.87503
4685.0000 -103.77622 -100.47158 3.30464 2.24488 -99.29675 706.55912
4690.0000 -104.30316 -101.01606 3.28710 2.11269 -100.91922 627.57405
4695.0000 -103.21876 -99.39882 3.81994 2.22364 -99.55749 706.49046
4700.0000 -103.28140 -98.46557 4.81583 2.30536 -98.55448 762.94292
4705.0000 -103.73315 -100.46969 3.26346 2.23104 -99.46665 713.67031
4710.0000 -103.88158 -100.12950 3.75208 2.16078 -100.32900 654.25303
4715.0000 -103.71820 -99.44315 4.27504 2.18451 -100.03777 682.83131
4720.0000 -104.67376 -100.18622 4.48754 2.21125 -99.70961 715.39253
4725.0000 -103.28929 -99.46519 3.82410 2.16020 -100.33614 693.21787
4730.0000 -102.37886 -98.62384 3.75502 2.24565 -99.28737 724.31195
4735.0000 -104.23463 -99.90556 4.32907 2.21132 -99.70876 691.08526
4740.0000 -103.93991 -99.36573 4.57418 2.14509 -100.52155 684.98274
4745.0000 -102.56769 -98.42751 4.14018 2.27887 -98.87962 772.82726
4750.0000 -103.08341 -98.95513 4.12828 2.26276 -99.07735 750.94315
MELTING PROCESS: loop number 20 T-loop= 770.00000000000000
main_MD> interactions number 20 at Temperature= 770.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.60227 2.32783 -0.45669
force_rgl> df(natom) -1.34122 0.65927 0.37450
4755.0000 -101.57400 -97.35246 4.22155 2.36303 -97.84669 784.75472
4760.0000 -102.81047 -97.74229 5.06818 2.32769 -98.28041 810.02019
4765.0000 -102.32958 -98.11865 4.21093 2.32231 -98.34642 780.95800
4770.0000 -102.44238 -97.95008 4.49230 2.34257 -98.09777 809.23516
4775.0000 -103.84410 -99.92035 3.92376 2.29959 -98.62532 802.64804
4780.0000 -104.29105 -100.67425 3.61680 2.16837 -100.23588 697.15049
4785.0000 -103.32133 -98.46750 4.85383 2.19240 -99.94096 680.25492
4790.0000 -104.10808 -99.29607 4.81201 2.26240 -99.08171 753.05940
4795.0000 -102.96693 -99.14850 3.81844 2.22870 -99.49540 748.28915
4800.0000 -102.67722 -98.06359 4.61363 2.30378 -98.57392 781.22869
4805.0000 -102.90979 -99.80985 3.09994 2.28667 -98.78393 769.67257
4810.0000 -103.74828 -100.44087 3.30742 2.17424 -100.16382 688.68725
4815.0000 -102.11571 -98.25664 3.85907 2.23786 -99.38296 735.61460
4820.0000 -102.85399 -99.62717 3.22682 2.23469 -99.42189 727.59636
4825.0000 -103.13423 -99.11317 4.02106 2.24139 -99.33961 713.68758
4830.0000 -104.18660 -99.96584 4.22075 2.19901 -99.85982 713.25811
4835.0000 -103.29666 -98.93789 4.35877 2.27265 -98.95599 780.73803
4840.0000 -103.91027 -98.97979 4.93047 2.25868 -99.12742 733.97060
4845.0000 -103.69154 -100.38064 3.31091 2.24706 -99.27009 739.15302
4850.0000 -103.72147 -99.19433 4.52713 2.20046 -99.84194 713.22477
4855.0000 -101.57021 -97.16696 4.40325 2.30374 -98.57440 792.31026
4860.0000 -102.18308 -98.46089 3.72219 2.38943 -97.52263 847.32916
4865.0000 -105.17845 -100.80207 4.37637 2.17867 -100.10945 698.39896
4870.0000 -103.71851 -100.20630 3.51222 2.18530 -100.02812 697.69893
4875.0000 -102.82093 -98.65945 4.16148 2.23782 -99.38341 740.60081
4880.0000 -103.36768 -99.07176 4.29591 2.27374 -98.94257 765.27999
4885.0000 -103.78599 -99.71880 4.06719 2.24785 -99.26035 727.64048
4890.0000 -102.65468 -98.73763 3.91704 2.25699 -99.14813 764.04977
4895.0000 -103.57971 -99.09238 4.48733 2.30710 -98.53306 776.03460
4900.0000 -102.79898 -99.10560 3.69338 2.27434 -98.93515 745.23050
4905.0000 -102.36586 -98.69774 3.66813 2.33317 -98.21315 741.83094
4910.0000 -104.13361 -99.45758 4.67603 2.24881 -99.24861 748.07567
4915.0000 -103.62440 -99.38254 4.24186 2.24693 -99.27159 761.05175
4920.0000 -103.85693 -99.34642 4.51052 2.24353 -99.31335 724.74507
4925.0000 -103.64629 -100.26566 3.38062 2.25512 -99.17107 729.66803
4930.0000 -103.74680 -99.80147 3.94533 2.22060 -99.59484 700.74972
4935.0000 -102.57130 -98.38197 4.18933 2.30636 -98.54220 754.02191
4940.0000 -102.63998 -98.92276 3.71722 2.28694 -98.78058 771.39284
4945.0000 -103.86325 -100.35131 3.51194 2.24721 -99.26814 764.17210
4950.0000 -102.06428 -98.20666 3.85762 2.23288 -99.44406 757.91986
4955.0000 -102.64793 -97.81169 4.83624 2.33105 -98.23915 815.98164
4960.0000 -102.58700 -98.68559 3.90141 2.34368 -98.08413 800.38785
4965.0000 -102.36589 -98.58277 3.78312 2.32079 -98.36505 810.38237
4970.0000 -103.25604 -98.08024 5.17580 2.34426 -98.07703 846.50510
4975.0000 -103.87593 -98.64813 5.22780 2.29370 -98.69763 822.69743
4980.0000 -103.58207 -99.09792 4.48414 2.29380 -98.69642 779.88896
4985.0000 -103.45445 -98.35462 5.09983 2.30937 -98.50523 800.98885
4990.0000 -102.74375 -98.27457 4.46918 2.33341 -98.21025 835.51206
4995.0000 -103.51394 -100.04688 3.46707 2.26678 -99.02801 749.76673
5000.0000 -103.41672 -99.39662 4.02011 2.19848 -99.86633 685.10625
MELTING PROCESS: loop number 21 T-loop= 795.00000000000000
main_MD> interactions number 21 at Temperature= 795.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.41797 2.91982 0.34856
force_rgl> df(natom) 1.36480 2.31035 0.42239
5005.0000 -102.70448 -98.39850 4.30599 2.22348 -99.55942 731.11348
5010.0000 -102.00671 -97.24660 4.76011 2.29046 -98.73733 747.05278
5015.0000 -101.58806 -97.61399 3.97407 2.39759 -97.42246 857.30028
5020.0000 -101.79595 -96.98255 4.81340 2.41759 -97.17699 888.16399
5025.0000 -102.67488 -97.99694 4.67794 2.39434 -97.46233 863.21511
5030.0000 -103.37589 -98.82621 4.54968 2.30287 -98.58499 802.50603
5035.0000 -102.85332 -98.74001 4.11331 2.31957 -98.38004 801.01031
5040.0000 -103.32257 -99.20240 4.12017 2.30136 -98.60356 785.98958
5045.0000 -103.39197 -99.09389 4.29808 2.25319 -99.19485 717.83339
5050.0000 -102.93914 -98.69191 4.24724 2.30992 -98.49850 800.70439
5055.0000 -102.68246 -98.78047 3.90198 2.26907 -98.99983 749.46419
5060.0000 -103.27204 -96.90815 6.36389 2.42219 -97.12055 910.04131
5065.0000 -101.94801 -97.10488 4.84313 2.41984 -97.14933 875.47220
5070.0000 -103.61438 -99.80223 3.81215 2.33945 -98.13603 822.90596
5075.0000 -103.99350 -99.92756 4.06595 2.25811 -99.13444 735.32323
5080.0000 -102.67856 -98.67309 4.00547 2.26686 -99.02707 737.95103
5085.0000 -102.39716 -98.40379 3.99337 2.30571 -98.55017 793.39895
5090.0000 -103.30675 -98.78648 4.52028 2.32363 -98.33025 797.57551
5095.0000 -102.43970 -98.14625 4.29345 2.35650 -97.92674 817.63567
5100.0000 -101.97789 -97.89193 4.08597 2.39015 -97.51382 862.72146
5105.0000 -103.28126 -99.18832 4.09293 2.26876 -99.00367 746.14045
5110.0000 -102.56578 -98.33043 4.23535 2.27601 -98.91466 734.79671
5115.0000 -102.65364 -97.97647 4.67717 2.34616 -98.05371 803.08983
5120.0000 -102.32523 -97.58965 4.73558 2.34573 -98.05902 818.94644
5125.0000 -101.20361 -95.90025 5.30336 2.43774 -96.92965 896.63488
5130.0000 -103.03700 -98.01025 5.02675 2.47459 -96.47740 933.84032
5135.0000 -102.54545 -97.83287 4.71258 2.33608 -98.17737 832.79541
5140.0000 -102.09995 -97.57033 4.52962 2.38727 -97.54918 824.03533
5145.0000 -102.78363 -98.64395 4.13968 2.29795 -98.64543 789.27869
5150.0000 -102.55675 -98.76340 3.79334 2.26116 -99.09699 760.02036
5155.0000 -104.06277 -99.38797 4.67480 2.25322 -99.19438 760.71067
5160.0000 -102.88841 -98.90226 3.98615 2.26507 -99.04904 761.26420
5165.0000 -102.87590 -98.17288 4.70302 2.23346 -99.43698 765.46809
5170.0000 -102.73869 -98.40513 4.33357 2.33460 -98.19564 801.45503
5175.0000 -101.40196 -97.17902 4.22294 2.36661 -97.80271 808.37824
5180.0000 -101.98779 -98.02123 3.96656 2.39138 -97.49871 846.79545
5185.0000 -103.25934 -97.95414 5.30521 2.34339 -98.08772 844.38071
5190.0000 -102.89401 -97.60263 5.29138 2.33204 -98.22705 807.03662
5195.0000 -102.70260 -98.73931 3.96329 2.31756 -98.40478 818.88456
5200.0000 -102.02631 -97.29758 4.72873 2.37607 -97.68663 839.95604
5205.0000 -102.45202 -98.19605 4.25597 2.36525 -97.81937 806.77445
5210.0000 -102.29279 -97.94695 4.34584 2.34029 -98.12581 803.12908
5215.0000 -103.30804 -99.38277 3.92527 2.30398 -98.57146 760.94358
5220.0000 -101.83092 -96.26704 5.56388 2.37337 -97.71970 849.14421
5225.0000 -102.01280 -96.71069 5.30211 2.43268 -96.99177 868.58222
5230.0000 -103.17463 -98.73135 4.44329 2.37428 -97.70855 833.49359
5235.0000 -102.69180 -98.31212 4.37968 2.31161 -98.47778 760.90447
5240.0000 -101.78015 -97.89068 3.88947 2.32973 -98.25535 794.05030
5245.0000 -103.67807 -99.20126 4.47681 2.25707 -99.14715 751.58166
5250.0000 -102.67614 -98.57077 4.10537 2.30010 -98.61905 796.59413
MELTING PROCESS: loop number 22 T-loop= 820.00000000000000
main_MD> interactions number 22 at Temperature= 820.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.37966 -1.80367 1.87910
force_rgl> df(natom) 1.23782 2.51491 1.19478
5255.0000 -102.28808 -96.74993 5.53815 2.38123 -97.62328 858.00369
5260.0000 -101.07232 -96.20081 4.87151 2.43459 -96.96835 882.01736
5265.0000 -101.79817 -97.40289 4.39528 2.50719 -96.07729 969.23215
5270.0000 -101.99612 -96.71239 5.28373 2.41076 -97.26082 834.72868
5275.0000 -100.98416 -96.40231 4.58185 2.45520 -96.71542 898.18381
5280.0000 -100.68199 -95.94430 4.73769 2.52149 -95.90175 946.93841
5285.0000 -102.41921 -97.89724 4.52198 2.39600 -97.44192 834.39923
5290.0000 -102.36412 -98.41753 3.94659 2.33786 -98.15555 762.21508
5295.0000 -103.96407 -100.37333 3.59075 2.25185 -99.21119 710.98111
5300.0000 -103.33004 -99.54484 3.78520 2.21299 -99.68821 679.35076
5305.0000 -102.90016 -99.54633 3.35383 2.24360 -99.31245 725.93653
5310.0000 -103.24505 -99.02088 4.22417 2.24948 -99.24029 736.34638
5315.0000 -101.46559 -96.62940 4.83619 2.30884 -98.51178 791.18053
5320.0000 -102.37696 -98.55541 3.82155 2.32380 -98.32810 821.44909
5325.0000 -101.97979 -97.92659 4.05320 2.36823 -97.78285 801.84549
5330.0000 -103.67833 -99.01857 4.65976 2.28935 -98.75097 760.72752
5335.0000 -102.75828 -99.07020 3.68808 2.22817 -99.50186 728.36157
5340.0000 -102.37111 -97.59753 4.77358 2.35487 -97.94675 849.03094
5345.0000 -101.54367 -97.86976 3.67391 2.38057 -97.63140 805.90076
5350.0000 -102.25790 -96.95816 5.29974 2.33378 -98.20565 780.17204
5355.0000 -102.69336 -98.10344 4.58992 2.36423 -97.83192 807.67113
5360.0000 -103.00230 -98.84271 4.15959 2.30025 -98.61720 781.10996
5365.0000 -103.17653 -99.60766 3.56887 2.29695 -98.65770 800.44864
5370.0000 -101.81908 -97.41811 4.40097 2.28799 -98.76771 794.17280
5375.0000 -100.35500 -95.20327 5.15172 2.50240 -96.13603 984.44941
5380.0000 -101.17748 -96.10369 5.07379 2.52372 -95.87443 956.53213
5385.0000 -102.04015 -98.13952 3.90063 2.37395 -97.71256 846.55798
5390.0000 -102.41992 -97.90511 4.51481 2.30990 -98.49873 772.10624
5395.0000 -102.01568 -97.16258 4.85310 2.35069 -97.99807 835.39950
5400.0000 -101.19339 -95.90169 5.29170 2.45081 -96.76930 880.24183
5405.0000 -101.99400 -97.61247 4.38153 2.46070 -96.64791 858.23866
5410.0000 -102.83642 -98.04758 4.78884 2.35487 -97.94684 815.73135
5415.0000 -101.00144 -97.19858 3.80286 2.36750 -97.79177 827.36236
5420.0000 -103.05124 -97.89315 5.15809 2.41733 -97.18020 848.85060
5425.0000 -102.17739 -97.55612 4.62128 2.38303 -97.60117 829.69805
5430.0000 -101.35428 -96.83870 4.51558 2.40267 -97.36015 864.32567
5435.0000 -102.87711 -98.47271 4.40441 2.31465 -98.44040 790.81395
5440.0000 -102.29497 -98.74383 3.55114 2.27617 -98.91281 775.27684
5445.0000 -102.44065 -97.99233 4.44832 2.35070 -97.99793 823.65684
5450.0000 -102.89651 -97.99689 4.89962 2.34348 -98.08659 800.87319
5455.0000 -102.19441 -97.50909 4.68532 2.35937 -97.89153 811.86064
5460.0000 -102.75505 -99.24048 3.51456 2.36102 -97.87128 827.68689
5465.0000 -102.97728 -98.28983 4.68745 2.32696 -98.28937 774.77410
5470.0000 -103.39678 -99.33829 4.05849 2.28847 -98.76184 762.75540
5475.0000 -102.77095 -98.45738 4.31357 2.26910 -98.99957 757.54850
5480.0000 -101.70797 -97.82991 3.87806 2.32582 -98.30339 820.38481
5485.0000 -101.48044 -97.37731 4.10312 2.36388 -97.83620 814.20006
5490.0000 -101.51373 -97.90232 3.61141 2.44392 -96.85381 865.44282
5495.0000 -103.36762 -97.69381 5.67381 2.38363 -97.59381 836.58651
5500.0000 -102.41930 -97.92930 4.49000 2.37453 -97.70545 840.52176
MELTING PROCESS: loop number 23 T-loop= 845.00000000000000
main_MD> interactions number 23 at Temperature= 845.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.35648 -4.02943 0.38937
force_rgl> df(natom) 0.09895 1.43336 2.36697
5505.0000 -102.19904 -98.19040 4.00865 2.35714 -97.91891 783.50917
5510.0000 -103.14877 -98.61551 4.53326 2.32284 -98.33993 780.62175
5515.0000 -102.63142 -98.44226 4.18916 2.31817 -98.39723 820.29871
5520.0000 -102.49043 -98.25860 4.23183 2.35301 -97.96963 858.94506
5525.0000 -102.13237 -97.23053 4.90185 2.34846 -98.02550 819.46324
5530.0000 -101.83303 -97.36793 4.46510 2.38941 -97.52288 853.24619
5535.0000 -101.87332 -97.78722 4.08610 2.39218 -97.48889 847.44284
5540.0000 -102.16537 -97.89390 4.27147 2.35637 -97.92836 818.53291
5545.0000 -101.79448 -96.67891 5.11557 2.40865 -97.28666 865.76935
5550.0000 -102.49387 -96.81837 5.67550 2.38016 -97.63640 832.59419
5555.0000 -101.51061 -97.14347 4.36714 2.46583 -96.58490 934.90432
5560.0000 -101.56875 -96.45679 5.11196 2.39541 -97.44924 826.01064
5565.0000 -101.95330 -96.91699 5.03631 2.46255 -96.62514 927.82256
5570.0000 -102.38880 -97.02055 5.36824 2.44431 -96.84902 844.23065
5575.0000 -101.94671 -97.13195 4.81476 2.48445 -96.35631 896.65077
5580.0000 -102.41432 -98.21081 4.20351 2.34095 -98.11767 801.90984
5585.0000 -102.79561 -98.82114 3.97447 2.27562 -98.91949 753.10252
5590.0000 -102.74248 -98.59711 4.14537 2.27876 -98.88097 759.38137
5595.0000 -103.13724 -98.31666 4.82058 2.29890 -98.63382 823.51466
5600.0000 -102.97103 -98.14286 4.82817 2.35195 -97.98261 784.65516
5605.0000 -103.45016 -97.85620 5.59396 2.35517 -97.94307 825.63038
5610.0000 -103.09130 -98.33300 4.75830 2.36223 -97.85652 829.20780
5615.0000 -102.08045 -97.68131 4.39914 2.42089 -97.13648 871.64218
5620.0000 -102.87723 -97.84477 5.03246 2.35298 -97.96998 831.96231
5625.0000 -103.17790 -97.90747 5.27043 2.37834 -97.65868 835.69097
5630.0000 -102.52550 -97.58938 4.93612 2.39917 -97.40312 847.41853
5635.0000 -101.77972 -97.24304 4.53668 2.44272 -96.86853 911.46054
5640.0000 -102.66384 -98.07082 4.59302 2.34698 -98.04366 828.12999
5645.0000 -102.51086 -98.69053 3.82033 2.29698 -98.65738 793.98577
5650.0000 -103.65063 -99.27170 4.37893 2.22418 -99.55083 701.17009
5655.0000 -103.42474 -99.38156 4.04318 2.26204 -99.08623 774.93853
5660.0000 -102.78468 -98.52800 4.25668 2.27559 -98.91984 774.01973
5665.0000 -103.07320 -98.38241 4.69079 2.32512 -98.31197 828.26067
5670.0000 -102.27365 -97.10694 5.16671 2.41950 -97.15352 862.31807
5675.0000 -102.52948 -98.23111 4.29836 2.35507 -97.94429 844.98291
5680.0000 -103.41237 -99.10714 4.30523 2.26031 -99.10745 730.51220
5685.0000 -103.68315 -99.16619 4.51696 2.27823 -98.88746 730.46155
5690.0000 -103.78329 -99.30113 4.48216 2.24190 -99.33331 718.76631
5695.0000 -101.56566 -96.77243 4.79324 2.33527 -98.18740 810.70319
5700.0000 -101.60519 -96.38451 5.22068 2.41207 -97.24477 904.22168
5705.0000 -103.05676 -98.74203 4.31472 2.35807 -97.90755 843.11755
5710.0000 -102.07797 -98.36061 3.71735 2.39235 -97.48677 838.00404
5715.0000 -101.57308 -97.51233 4.06075 2.30168 -98.59970 776.61548
5720.0000 -103.74598 -98.58879 5.15720 2.36185 -97.86108 827.00900
5725.0000 -102.84106 -97.99716 4.84390 2.27770 -98.89397 759.76705
5730.0000 -102.25589 -97.46488 4.79101 2.34563 -98.06027 814.61975
5735.0000 -102.21515 -97.28699 4.92815 2.39336 -97.47436 825.66856
5740.0000 -102.13888 -97.77683 4.36205 2.41447 -97.21523 863.48591
5745.0000 -101.83069 -96.52927 5.30142 2.43518 -96.96110 863.92272
5750.0000 -101.30989 -95.87669 5.43321 2.50473 -96.10748 965.50725
MELTING PROCESS: loop number 24 T-loop= 870.00000000000000
main_MD> interactions number 24 at Temperature= 870.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.36097 0.00256 -0.58348
force_rgl> df(natom) -0.81693 -0.61244 0.77187
5755.0000 -102.98763 -97.36648 5.62115 2.48901 -96.30036 932.39987
5760.0000 -101.71358 -96.66145 5.05213 2.43051 -97.01836 884.74235
5765.0000 -102.00249 -97.28222 4.72027 2.40840 -97.28984 854.37251
5770.0000 -102.09820 -97.61320 4.48500 2.43772 -96.92992 876.98243
5775.0000 -101.15034 -95.70649 5.44385 2.44437 -96.84835 870.82181
5780.0000 -101.53985 -96.44825 5.09160 2.52310 -95.88202 975.54134
5785.0000 -102.03291 -96.17253 5.86039 2.50475 -96.10725 973.70594
5790.0000 -101.24975 -96.89060 4.35916 2.49753 -96.19580 980.03036
5795.0000 -101.75415 -97.35947 4.39468 2.44879 -96.79402 893.43856
5800.0000 -102.01769 -97.28575 4.73194 2.38753 -97.54600 855.07079
5805.0000 -102.31990 -97.47051 4.84939 2.42240 -97.11793 880.95576
5810.0000 -102.44095 -97.86278 4.57817 2.37188 -97.73801 841.49936
5815.0000 -102.27094 -97.15387 5.11707 2.37865 -97.65498 834.05267
5820.0000 -102.30111 -97.89448 4.40663 2.37881 -97.65291 835.09673
5825.0000 -101.52931 -97.32522 4.20409 2.35098 -97.99454 792.07857
5830.0000 -102.97325 -98.17886 4.79439 2.36987 -97.76267 808.04489
5835.0000 -102.76686 -98.28132 4.48554 2.35494 -97.94591 831.91144
5840.0000 -102.92308 -97.58083 5.34225 2.33530 -98.18694 810.82453
5845.0000 -100.48072 -96.19504 4.28568 2.43045 -97.01909 875.29320
5850.0000 -100.83674 -96.40467 4.43208 2.45519 -96.71551 892.70535
5855.0000 -101.69202 -96.03385 5.65818 2.48835 -96.30851 897.78241
5860.0000 -101.75472 -96.44739 5.30733 2.51122 -96.02781 955.84564
5865.0000 -102.07457 -97.33118 4.74339 2.42622 -97.07110 872.76152
5870.0000 -100.66976 -96.22878 4.44097 2.48592 -96.33826 884.22589
5875.0000 -102.06327 -96.32852 5.73475 2.46686 -96.57232 890.65627
5880.0000 -101.76106 -96.93390 4.82717 2.40996 -97.27058 849.38708
5885.0000 -102.21580 -97.59972 4.61608 2.43587 -96.95266 846.53752
5890.0000 -101.23620 -96.54238 4.69382 2.40968 -97.27410 830.27122
5895.0000 -101.65420 -97.32547 4.32872 2.45305 -96.74170 910.80909
5900.0000 -102.57923 -96.92045 5.65878 2.44147 -96.88393 914.10054
5905.0000 -101.24801 -96.31362 4.93439 2.44700 -96.81607 922.22617
5910.0000 -102.60061 -97.70660 4.89401 2.44143 -96.88441 889.95392
5915.0000 -102.79128 -98.66607 4.12521 2.29524 -98.67871 782.33412
5920.0000 -102.28344 -98.50953 3.77392 2.32153 -98.35595 788.62700
5925.0000 -101.91536 -97.36067 4.55468 2.31064 -98.48973 766.07986
5930.0000 -101.62281 -95.72815 5.89466 2.49879 -96.18034 901.64050
5935.0000 -101.57332 -96.59502 4.97829 2.53792 -95.70003 980.96790
5940.0000 -102.13611 -97.47599 4.66012 2.40332 -97.35210 866.33859
5945.0000 -103.80947 -98.53705 5.27242 2.34999 -98.00666 842.94089
5950.0000 -101.74599 -96.72579 5.02020 2.45684 -96.69519 919.62861
5955.0000 -102.71136 -97.74454 4.96681 2.41719 -97.18191 884.19682
5960.0000 -101.25234 -96.80676 4.44558 2.38915 -97.52601 853.49203
5965.0000 -102.23288 -97.63151 4.60137 2.40852 -97.28830 844.23872
5970.0000 -102.17360 -96.50005 5.67354 2.34056 -98.12243 806.25174
5975.0000 -100.85666 -96.01400 4.84265 2.52145 -95.90219 960.94572
5980.0000 -102.55290 -97.75538 4.79752 2.37792 -97.66387 874.08688
5985.0000 -103.06887 -97.96015 5.10871 2.34449 -98.07420 839.89927
5990.0000 -102.42378 -97.50984 4.91394 2.38971 -97.51923 861.15598
5995.0000 -101.73587 -97.31165 4.42422 2.43221 -96.99756 901.42682
6000.0000 -102.59656 -98.82171 3.77485 2.34562 -98.06033 838.67823
MELTING PROCESS: loop number 25 T-loop= 895.00000000000000
main_MD> interactions number 25 at Temperature= 895.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.10410 0.27163 0.92379
force_rgl> df(natom) 0.96491 4.41765 2.29878
6005.0000 -101.86207 -97.15354 4.70853 2.34568 -98.05954 784.06731
6010.0000 -101.30161 -96.41821 4.88340 2.51633 -95.96511 956.09119
6015.0000 -101.45750 -96.15077 5.30673 2.54569 -95.60474 957.22368
6020.0000 -101.67781 -96.85068 4.82713 2.43786 -96.92824 905.24204
6025.0000 -102.63850 -98.09680 4.54170 2.39499 -97.45440 818.00845
6030.0000 -102.60737 -98.14884 4.45853 2.34535 -98.06361 814.84591
6035.0000 -102.86447 -97.64383 5.22063 2.34454 -98.07362 830.41981
6040.0000 -101.24564 -96.47764 4.76800 2.43698 -96.93905 907.38358
6045.0000 -102.54813 -98.17788 4.37026 2.43435 -96.97127 854.91238
6050.0000 -102.84377 -98.21681 4.62696 2.32487 -98.31506 809.63216
6055.0000 -102.45951 -97.49124 4.96827 2.39782 -97.41959 849.23739
6060.0000 -101.69849 -96.78743 4.91106 2.40347 -97.35026 885.58118
6065.0000 -101.28946 -96.36442 4.92504 2.43152 -97.00602 888.31616
6070.0000 -101.24399 -97.25006 3.99393 2.44197 -96.87775 856.39296
6075.0000 -102.40826 -96.65745 5.75080 2.44320 -96.86261 844.88303
6080.0000 -101.49788 -95.81242 5.68546 2.50297 -96.12907 968.25286
6085.0000 -101.64758 -96.19754 5.45004 2.45262 -96.74706 864.58572
6090.0000 -102.60951 -97.92219 4.68733 2.42947 -97.03115 877.99079
6095.0000 -102.35206 -98.68668 3.66538 2.33804 -98.15334 802.84964
6100.0000 -101.75876 -96.53847 5.22028 2.37522 -97.69703 816.34652
6105.0000 -102.18685 -97.28764 4.89920 2.47907 -96.42245 931.93709
6110.0000 -101.20608 -96.84717 4.35891 2.40967 -97.27422 852.94051
6115.0000 -100.94049 -96.30650 4.63399 2.44557 -96.83352 901.13613
6120.0000 -102.33002 -97.71773 4.61229 2.38952 -97.52147 841.20713
6125.0000 -103.32110 -98.27087 5.05023 2.32816 -98.27466 791.27239
6130.0000 -102.84136 -97.33355 5.50781 2.43209 -96.99905 859.41069
6135.0000 -101.15656 -96.92612 4.23045 2.47974 -96.41419 913.94778
6140.0000 -102.09586 -96.70538 5.39049 2.42971 -97.02824 860.41520
6145.0000 -101.75199 -96.79312 4.95887 2.42015 -97.14551 845.82723
6150.0000 -101.82588 -95.60752 6.21837 2.55232 -95.52335 943.26075
6155.0000 -102.02555 -96.44095 5.58460 2.48856 -96.30592 929.66491
6160.0000 -100.97804 -96.73032 4.24772 2.46771 -96.56184 913.18488
6165.0000 -102.36566 -98.33467 4.03098 2.36915 -97.77156 835.51626
6170.0000 -100.10217 -95.05025 5.05192 2.40677 -97.30984 845.65037
6175.0000 -101.12823 -95.71264 5.41559 2.60115 -94.92401 977.82575
6180.0000 -101.26588 -96.18293 5.08296 2.51083 -96.03260 924.07869
6185.0000 -101.41521 -96.36724 5.04797 2.48044 -96.40559 923.98890
6190.0000 -102.19684 -96.23874 5.95810 2.52445 -95.86544 949.31824
6195.0000 -101.76969 -97.24381 4.52588 2.46788 -96.55973 917.04270
6200.0000 -101.88643 -96.97183 4.91460 2.43140 -97.00751 821.40220
6205.0000 -102.46007 -96.24852 6.21155 2.47833 -96.43153 911.68275
6210.0000 -102.16462 -97.06978 5.09484 2.44097 -96.89004 894.03285
6215.0000 -102.21407 -97.63104 4.58303 2.38182 -97.61604 848.08367
6220.0000 -102.90042 -98.65406 4.24636 2.36977 -97.76398 839.43918
6225.0000 -102.60472 -98.10564 4.49908 2.31829 -98.39582 821.73527
6230.0000 -100.19367 -95.11297 5.08070 2.44969 -96.78301 902.34428
6235.0000 -101.53028 -96.06112 5.46916 2.55014 -95.55012 985.61802
6240.0000 -100.85206 -96.39607 4.45599 2.48063 -96.40326 917.30913
6245.0000 -102.05842 -97.56402 4.49440 2.48998 -96.28853 923.68741
6250.0000 -102.89227 -98.07613 4.81614 2.34133 -98.11296 836.12675
MELTING PROCESS: loop number 26 T-loop= 920.00000000000000
main_MD> interactions number 26 at Temperature= 920.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.08221 7.38136 -0.30596
force_rgl> df(natom) 1.70946 0.37730 -1.46899
6255.0000 -101.69105 -96.89758 4.79348 2.42401 -97.09823 896.01571
6260.0000 -102.26422 -97.36010 4.90412 2.41397 -97.22147 878.08988
6265.0000 -101.76057 -97.46075 4.29982 2.38762 -97.54481 790.70593
6270.0000 -102.85314 -97.36676 5.48637 2.40151 -97.37430 857.91325
6275.0000 -103.48684 -96.80776 6.67908 2.37580 -97.68994 851.85350
6280.0000 -102.33221 -97.02184 5.31037 2.47484 -96.47428 942.23957
6285.0000 -101.31403 -96.74367 4.57036 2.45662 -96.69800 912.45260
6290.0000 -101.18570 -95.80829 5.37741 2.51411 -95.99237 966.53432
6295.0000 -101.39250 -95.81494 5.57756 2.55192 -95.52820 960.78021
6300.0000 -100.18825 -95.19226 4.99599 2.54489 -95.61448 971.25779
6305.0000 -101.42502 -95.88542 5.53960 2.58563 -95.11447 977.67344
6310.0000 -100.38109 -95.06839 5.31270 2.56390 -95.38120 984.90777
6315.0000 -101.26676 -95.42362 5.84314 2.58887 -95.07478 1038.85916
6320.0000 -102.47272 -96.72922 5.74350 2.47132 -96.51757 968.67885
6325.0000 -101.04185 -95.62422 5.41762 2.48848 -96.30685 938.88804
6330.0000 -100.75176 -94.90483 5.84693 2.54050 -95.66847 977.68557
6335.0000 -101.06622 -95.28248 5.78373 2.60879 -94.83019 1024.93197
6340.0000 -101.30438 -95.56769 5.73669 2.50826 -96.06412 990.46118
6345.0000 -100.61677 -95.87486 4.74191 2.51834 -95.94039 937.88607
6350.0000 -100.67947 -95.56631 5.11316 2.48131 -96.39488 926.56310
6355.0000 -101.67316 -97.25455 4.41861 2.46168 -96.63587 873.73618
6360.0000 -101.76800 -96.02639 5.74161 2.47794 -96.43631 889.24857
6365.0000 -102.20721 -97.68417 4.52304 2.44425 -96.84979 917.19279
6370.0000 -101.21748 -95.97013 5.24735 2.43941 -96.90922 889.69299
6375.0000 -100.62808 -95.90365 4.72443 2.45873 -96.67208 905.88982
6380.0000 -102.01654 -96.62383 5.39271 2.43769 -96.93033 893.63176
6385.0000 -100.12376 -94.87696 5.24680 2.48626 -96.33413 908.68487
6390.0000 -102.61723 -95.61492 7.00231 2.52976 -95.80027 968.98848
6395.0000 -101.33581 -96.37529 4.96052 2.52055 -95.91331 968.37854
6400.0000 -101.67444 -96.73119 4.94325 2.47758 -96.44063 922.21456
6405.0000 -102.39324 -96.74411 5.64913 2.46111 -96.64281 892.88118
6410.0000 -101.63206 -96.24215 5.38991 2.47688 -96.44926 930.07313
6415.0000 -101.50569 -95.41373 6.09196 2.53495 -95.73651 944.45890
6420.0000 -101.41750 -95.80321 5.61429 2.50790 -96.06858 936.69118
6425.0000 -99.59749 -94.51821 5.07928 2.56513 -95.36615 942.21923
6430.0000 -100.10992 -94.74116 5.36876 2.62882 -94.58434 989.47970
6435.0000 -100.62530 -96.11026 4.51504 2.53169 -95.77657 923.39391
6440.0000 -99.95551 -94.08706 5.86844 2.56483 -95.36980 990.39575
6445.0000 -101.54160 -97.01468 4.52692 2.55126 -95.53640 940.27389
6450.0000 -102.08514 -96.13365 5.95149 2.47959 -96.41598 930.67394
6455.0000 -100.04222 -94.75081 5.29142 2.52701 -95.83399 968.81546
6460.0000 -101.10268 -95.70436 5.39832 2.51515 -95.97956 948.57094
6465.0000 -99.58744 -94.31149 5.27594 2.62208 -94.66709 1005.74695
6470.0000 -100.69542 -95.34409 5.35132 2.58152 -95.16498 956.69486
6475.0000 -100.28268 -94.80358 5.47910 2.62909 -94.58106 974.89995
6480.0000 -101.87621 -96.70610 5.17011 2.53713 -95.70980 980.61749
6485.0000 -101.91034 -96.72979 5.18055 2.42125 -97.13205 873.19945
6490.0000 -102.45779 -97.22643 5.23136 2.46819 -96.55590 923.35173
6495.0000 -102.50656 -96.54614 5.96043 2.41225 -97.24250 862.59163
6500.0000 -100.80943 -95.56586 5.24357 2.48837 -96.30821 892.58783
MELTING PROCESS: loop number 27 T-loop= 945.00000000000000
main_MD> interactions number 27 at Temperature= 945.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.82768 3.16161 0.41080
force_rgl> df(natom) 1.00264 -0.14412 -2.38207
6505.0000 -102.05578 -96.94152 5.11426 2.50949 -96.04897 934.59696
6510.0000 -101.78838 -98.18086 3.60752 2.40931 -97.27861 887.01123
6515.0000 -101.71413 -97.76777 3.94636 2.34197 -98.10511 770.14577
6520.0000 -100.29800 -94.76892 5.52907 2.48718 -96.32291 938.16221
6525.0000 -101.92952 -97.76975 4.15977 2.53638 -95.71903 991.16297
6530.0000 -102.46468 -97.26550 5.19918 2.33059 -98.24476 777.01988
6535.0000 -102.29877 -97.80956 4.48921 2.39903 -97.40479 890.88984
6540.0000 -101.01697 -97.37768 3.63930 2.41917 -97.15760 852.73205
6545.0000 -102.56662 -96.94344 5.62318 2.45303 -96.74199 902.80585
6550.0000 -103.32403 -98.28794 5.03609 2.40126 -97.37742 875.11410
6555.0000 -101.87942 -97.42124 4.45818 2.32132 -98.35864 798.47728
6560.0000 -100.57204 -93.45472 7.11732 2.55873 -95.44471 977.48882
6565.0000 -100.55136 -94.25283 6.29853 2.65354 -94.28100 1065.46497
6570.0000 -100.81439 -95.42078 5.39361 2.60892 -94.82869 1023.96958
6575.0000 -100.55649 -95.30119 5.25530 2.60352 -94.89496 1013.61760
6580.0000 -100.97216 -95.62605 5.34611 2.57940 -95.19094 1032.10895
6585.0000 -100.34856 -95.43766 4.91090 2.50644 -96.08645 947.27000
6590.0000 -100.61702 -94.89804 5.71898 2.59913 -94.94886 1002.50652
6595.0000 -100.23967 -95.38822 4.85145 2.60228 -94.91015 1004.28413
6600.0000 -100.67486 -95.40106 5.27380 2.56920 -95.31622 979.42525
6605.0000 -99.37670 -92.90496 6.47174 2.69748 -93.74166 1063.52074
6610.0000 -101.63000 -94.64196 6.98804 2.72025 -93.46218 1130.61059
6615.0000 -98.76544 -93.82203 4.94341 2.65919 -94.21164 1035.18362
6620.0000 -102.29673 -97.06122 5.23551 2.58888 -95.07458 993.91609
6625.0000 -101.67513 -95.98130 5.69383 2.45602 -96.70530 916.86189
6630.0000 -102.52897 -97.77504 4.75393 2.45013 -96.77764 869.79697
6635.0000 -100.88343 -96.56665 4.31678 2.38068 -97.63001 841.12206
6640.0000 -102.32246 -97.06499 5.25747 2.47128 -96.51796 936.27068
6645.0000 -101.05313 -95.54139 5.51174 2.48062 -96.40343 906.07473
6650.0000 -100.29323 -95.03703 5.25619 2.53170 -95.77639 1003.12149
6655.0000 -100.12181 -95.13972 4.98209 2.52456 -95.86412 957.06746
6660.0000 -101.85928 -98.22564 3.63365 2.41737 -97.17974 866.91416
6665.0000 -101.93696 -95.94308 5.99388 2.41338 -97.22865 854.71747
6670.0000 -101.49536 -95.85839 5.63697 2.46559 -96.58781 882.69913
6675.0000 -101.39817 -95.14068 6.25749 2.50171 -96.14446 930.28904
6680.0000 -101.44389 -95.63690 5.80699 2.58274 -95.14994 1024.93945
6685.0000 -101.06749 -95.20004 5.86745 2.59061 -95.05341 960.63156
6690.0000 -101.51224 -96.79111 4.72113 2.57495 -95.24562 973.58569
6695.0000 -101.36375 -96.06021 5.30353 2.48709 -96.32399 928.17556
6700.0000 -102.33069 -96.29514 6.03555 2.54674 -95.59183 982.19886
6705.0000 -101.21591 -96.00167 5.21424 2.52600 -95.84644 955.63855
6710.0000 -99.82917 -94.98944 4.83973 2.55292 -95.51601 1008.17872
6715.0000 -101.04782 -96.36005 4.68778 2.54497 -95.61359 987.94824
6720.0000 -102.32501 -97.50497 4.82004 2.46113 -96.64259 909.50844
6725.0000 -101.90638 -97.02887 4.87750 2.37537 -97.69515 813.28457
6730.0000 -100.32749 -96.08563 4.24186 2.44166 -96.88155 855.79151
6735.0000 -100.39972 -95.49352 4.90619 2.50452 -96.11006 917.77864
6740.0000 -100.65655 -94.77700 5.87955 2.57404 -95.25674 1010.46064
6745.0000 -98.70229 -94.01471 4.68758 2.65647 -94.24505 1048.81083
6750.0000 -101.19994 -95.43126 5.76869 2.57338 -95.26484 1007.08490
MELTING PROCESS: loop number 28 T-loop= 970.00000000000000
main_MD> interactions number 28 at Temperature= 970.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.05098 1.83793 -2.51960
force_rgl> df(natom) -1.02839 1.22758 1.82787
6755.0000 -101.32096 -96.09729 5.22367 2.51053 -96.03622 952.00981
6760.0000 -101.26871 -95.78410 5.48461 2.55935 -95.43706 994.17461
6765.0000 -100.87680 -95.72837 5.14843 2.51748 -95.95095 955.83910
6770.0000 -101.29887 -96.43391 4.86496 2.55197 -95.52762 979.50738
6775.0000 -99.48170 -94.28586 5.19585 2.60991 -94.81652 962.30367
6780.0000 -99.74607 -94.98394 4.76213 2.59205 -95.03576 927.12926
6785.0000 -99.36421 -94.22946 5.13475 2.68429 -93.90357 1043.17529
6790.0000 -100.87639 -95.29609 5.58030 2.62210 -94.66694 1046.51527
6795.0000 -100.18396 -95.49803 4.68593 2.58609 -95.10881 1032.24173
6800.0000 -101.08560 -96.00386 5.08174 2.52068 -95.91173 936.98897
6805.0000 -101.16232 -96.28889 4.87342 2.48630 -96.33360 941.04032
6810.0000 -101.91467 -96.13184 5.78283 2.51546 -95.97571 950.67414
6815.0000 -100.20648 -95.29511 4.91137 2.54669 -95.59245 964.07451
6820.0000 -99.55810 -94.82569 4.73242 2.60598 -94.86477 1007.52309
6825.0000 -99.49244 -94.00031 5.49214 2.65480 -94.26553 1063.82239
6830.0000 -101.08814 -95.31839 5.76975 2.55668 -95.46988 971.79895
6835.0000 -100.02742 -94.15081 5.87662 2.59286 -95.02572 960.43606
6840.0000 -100.15640 -94.32227 5.83413 2.66972 -94.08235 1102.75241
6845.0000 -100.82740 -96.00452 4.82288 2.59607 -94.98640 1016.14588
6850.0000 -101.31114 -96.56558 4.74556 2.46976 -96.53662 921.92767
6855.0000 -101.80431 -95.66248 6.14183 2.63044 -94.56448 1045.26206
6860.0000 -100.86991 -95.48495 5.38496 2.55068 -95.54343 990.32271
6865.0000 -101.18812 -94.95420 6.23391 2.62886 -94.58395 1036.87995
6870.0000 -101.24110 -96.72689 4.51422 2.53844 -95.69370 954.14410
6875.0000 -99.97614 -94.29854 5.67761 2.54024 -95.67157 946.72697
6880.0000 -101.68121 -95.13441 6.54680 2.59903 -94.95004 1027.12186
6885.0000 -99.93813 -95.47445 4.46368 2.52690 -95.83529 987.51473
6890.0000 -100.78596 -94.51671 6.26925 2.65271 -94.29119 1038.36266
6895.0000 -101.46096 -96.20050 5.26047 2.57633 -95.22867 975.18190
6900.0000 -102.06136 -95.31804 6.74333 2.49369 -96.24300 927.85858
6905.0000 -100.66731 -95.07251 5.59479 2.59324 -95.02114 988.66425
6910.0000 -101.60100 -95.76846 5.83253 2.57498 -95.24522 1001.56053
6915.0000 -99.93776 -94.51180 5.42596 2.57392 -95.25824 1038.09647
6920.0000 -99.78497 -95.05194 4.73303 2.63167 -94.54939 1011.63295
6925.0000 -102.21179 -95.47083 6.74096 2.51842 -95.93942 969.91929
6930.0000 -100.57756 -95.63101 4.94656 2.57177 -95.28458 985.02899
6935.0000 -101.88720 -96.44899 5.43820 2.58482 -95.12439 1026.28523
6940.0000 -102.25266 -96.73299 5.51967 2.41479 -97.21141 925.67995
6945.0000 -100.64210 -95.88767 4.75443 2.49604 -96.21413 954.23381
6950.0000 -100.48742 -95.14786 5.33956 2.55415 -95.50090 954.96439
6955.0000 -100.51838 -95.29728 5.22110 2.53210 -95.77152 905.89272
6960.0000 -100.99001 -94.71738 6.27262 2.57618 -95.23054 974.98339
6965.0000 -101.00711 -95.78849 5.21862 2.60950 -94.82150 1014.53568
6970.0000 -99.87024 -94.28450 5.58574 2.61784 -94.71918 953.32260
6975.0000 -101.47864 -94.20371 7.27493 2.67004 -94.07846 1058.71381
6980.0000 -100.09130 -95.12479 4.96651 2.56295 -95.39281 962.34118
6985.0000 -101.70660 -95.86102 5.84558 2.50741 -96.07453 950.22084
6990.0000 -101.70445 -96.54129 5.16316 2.53121 -95.78244 1001.20548
6995.0000 -101.34420 -95.51218 5.83201 2.53873 -95.69016 960.37318
7000.0000 -101.29460 -95.37002 5.92458 2.60965 -94.81963 1014.55057
MELTING PROCESS: loop number 29 T-loop= 995.00000000000000
main_MD> interactions number 29 at Temperature= 995.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.94692 1.34934 1.67877
force_rgl> df(natom) 4.03963 -3.63063 5.33923
7005.0000 -100.45256 -94.85658 5.59597 2.61387 -94.76789 1022.19453
7010.0000 -100.53233 -95.38089 5.15144 2.54275 -95.64082 995.17195
7015.0000 -101.42789 -95.98099 5.44690 2.49319 -96.24915 953.35089
7020.0000 -101.84399 -96.39926 5.44473 2.54096 -95.66278 975.66384
7025.0000 -101.87022 -96.72040 5.14982 2.42834 -97.04508 914.41020
7030.0000 -100.66922 -95.10042 5.56880 2.53348 -95.75459 953.68210
7035.0000 -100.56551 -94.72055 5.84496 2.61315 -94.77675 1012.68680
7040.0000 -100.33260 -92.80127 7.53133 2.68782 -93.86028 1077.35247
7045.0000 -102.66312 -95.88517 6.77795 2.61568 -94.74564 1012.72854
7050.0000 -101.06822 -95.58537 5.48285 2.54530 -95.60947 977.67090
7055.0000 -101.58623 -96.75491 4.83132 2.50451 -96.11011 941.73138
7060.0000 -100.64422 -96.28164 4.36258 2.49837 -96.18551 905.64709
7065.0000 -102.02412 -95.30151 6.72261 2.52935 -95.80521 961.60688
7070.0000 -102.49966 -96.84666 5.65301 2.51593 -95.96998 972.51625
7075.0000 -101.54806 -94.85529 6.69277 2.51286 -96.00766 969.01877
7080.0000 -100.40582 -94.86176 5.54406 2.57033 -95.30229 1020.00171
7085.0000 -100.86963 -93.85643 7.01320 2.60845 -94.83441 1044.88980
7090.0000 -99.28667 -93.91420 5.37247 2.69144 -93.81578 1060.69324
7095.0000 -99.34221 -94.35133 4.99088 2.64141 -94.42985 991.93270
7100.0000 -99.31709 -94.24747 5.06962 2.66815 -94.10161 1054.12740
7105.0000 -100.69033 -94.67357 6.01676 2.69421 -93.78178 1069.68619
7110.0000 -100.78561 -95.68793 5.09769 2.58256 -95.15216 987.87916
7115.0000 -99.45347 -93.62788 5.82559 2.64179 -94.42515 1063.89491
7120.0000 -100.97262 -95.69449 5.27813 2.60845 -94.83440 1011.99969
7125.0000 -101.34138 -95.63700 5.70437 2.58167 -95.16312 1024.41585
7130.0000 -101.58244 -96.28874 5.29371 2.53602 -95.72334 1000.76721
7135.0000 -101.45029 -96.60777 4.84253 2.52289 -95.88452 965.69470
7140.0000 -100.05755 -94.94815 5.10941 2.54380 -95.62796 950.92271
7145.0000 -100.30467 -93.65519 6.64948 2.62669 -94.61058 1055.02508
7150.0000 -100.61689 -95.93200 4.68489 2.61987 -94.69418 1048.79381
7155.0000 -99.20287 -93.85697 5.34590 2.62569 -94.62287 1016.50059
7160.0000 -101.39862 -95.39411 6.00451 2.59196 -95.03677 1028.64181
7165.0000 -99.68859 -94.25728 5.43130 2.56407 -95.37908 971.18820
7170.0000 -100.32967 -94.23527 6.09440 2.66171 -94.18075 1026.64771
7175.0000 -101.16861 -96.05772 5.11089 2.56368 -95.38386 989.53486
7180.0000 -101.73711 -96.19835 5.53876 2.49149 -96.26991 944.29773
7185.0000 -101.73955 -97.27739 4.46215 2.45498 -96.71809 901.30906
7190.0000 -101.62466 -97.09991 4.52475 2.49259 -96.25650 933.67437
7195.0000 -102.29903 -97.31818 4.98085 2.40600 -97.31927 857.19957
7200.0000 -100.61563 -95.45408 5.16155 2.51878 -95.93496 962.79068
7205.0000 -100.53773 -95.30728 5.23044 2.51474 -95.98461 979.59425
7210.0000 -97.99587 -92.27407 5.72180 2.71386 -93.54058 1129.48250
7215.0000 -99.25949 -92.98316 6.27633 2.68517 -93.89274 1091.88787
7220.0000 -100.36453 -93.61816 6.74637 2.69640 -93.75488 1064.76935
7225.0000 -99.78115 -93.89514 5.88602 2.66777 -94.10635 1082.08993
7230.0000 -99.58711 -94.27800 5.30911 2.68070 -93.94758 1067.89961
7235.0000 -101.51820 -94.54718 6.97102 2.62724 -94.60381 1012.13371
7240.0000 -101.09926 -95.65489 5.44437 2.58948 -95.06727 1002.15329
7245.0000 -100.89574 -95.83935 5.05638 2.50262 -96.13329 953.54253
7250.0000 -101.87146 -96.74069 5.13076 2.51201 -96.01815 950.76351
MELTING PROCESS: loop number 30 T-loop= 1020.0000000000000
main_MD> interactions number 30 at Temperature= 1020.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 3.37059 -4.02836 -1.56466
force_rgl> df(natom) 1.61821 2.53519 -1.50645
7255.0000 -100.39079 -95.45423 4.93656 2.50097 -96.15366 942.21105
7260.0000 -100.39399 -94.23208 6.16191 2.56575 -95.35853 967.39791
7265.0000 -99.97541 -95.14511 4.83030 2.63880 -94.46190 1042.86945
7270.0000 -100.18039 -94.76365 5.41674 2.55977 -95.43186 998.35670
7275.0000 -101.85985 -95.85310 6.00675 2.59541 -94.99444 1006.23737
7280.0000 -101.30062 -96.15196 5.14866 2.59381 -95.01408 1006.82869
7285.0000 -101.79525 -95.97783 5.81742 2.48818 -96.31059 960.26906
7290.0000 -100.01294 -94.52277 5.49017 2.56783 -95.33302 980.33329
7295.0000 -99.66511 -93.14756 6.51755 2.65742 -94.23333 1066.65969
7300.0000 -100.20538 -93.70581 6.49957 2.71328 -93.54775 1122.30683
7305.0000 -99.64853 -93.29002 6.35851 2.72995 -93.34309 1117.58376
7310.0000 -100.18965 -94.75752 5.43213 2.69693 -93.74837 1044.08701
7315.0000 -100.37359 -94.45318 5.92042 2.64305 -94.40977 1016.23365
7320.0000 -100.76299 -94.26436 6.49863 2.62077 -94.68324 1058.18292
7325.0000 -98.59829 -94.04909 4.54920 2.72594 -93.39237 1132.26598
7330.0000 -101.23208 -95.02676 6.20532 2.65030 -94.32080 1047.16539
7335.0000 -100.28900 -95.12982 5.15919 2.56056 -95.42219 976.84686
7340.0000 -99.60401 -94.87341 4.73060 2.59881 -94.95279 987.59377
7345.0000 -100.48672 -94.79681 5.68990 2.57877 -95.19865 995.40221
7350.0000 -100.55663 -96.36406 4.19258 2.50581 -96.09423 950.75421
7355.0000 -100.32855 -95.28031 5.04825 2.49525 -96.22387 923.27489
7360.0000 -101.73852 -95.35823 6.38030 2.56198 -95.40482 975.05869
7365.0000 -98.84937 -92.40924 6.44013 2.69151 -93.81501 1086.30681
7370.0000 -99.33738 -92.92849 6.40889 2.79046 -92.60047 1165.86235
7375.0000 -99.16437 -93.43293 5.73144 2.77456 -92.79559 1146.57621
7380.0000 -100.17925 -95.39622 4.78304 2.65659 -94.24352 1030.91425
7385.0000 -100.58338 -95.27280 5.31058 2.54962 -95.55644 950.17817
7390.0000 -100.55573 -95.38636 5.16937 2.57864 -95.20023 984.83786
7395.0000 -100.64524 -95.38888 5.25636 2.57993 -95.18449 968.26725
7400.0000 -99.93439 -94.83932 5.09507 2.62983 -94.57203 1029.67981
7405.0000 -101.02248 -96.81604 4.20644 2.57820 -95.20567 939.33144
7410.0000 -100.82459 -95.11745 5.70714 2.54804 -95.57584 950.15897
7415.0000 -101.16770 -96.12325 5.04445 2.57730 -95.21679 1005.09624
7420.0000 -100.51232 -96.17273 4.33959 2.53104 -95.78452 938.67578
7425.0000 -102.51590 -97.66347 4.85243 2.42916 -97.03500 891.29007
7430.0000 -99.40584 -94.48894 4.91690 2.49722 -96.19960 943.28206
7435.0000 -99.33679 -94.08955 5.24724 2.63686 -94.48567 1019.34164
7440.0000 -100.43499 -95.60321 4.83178 2.62467 -94.63533 1039.21808
7445.0000 -99.55400 -93.87059 5.68341 2.66850 -94.09731 1027.98047
7450.0000 -99.83314 -95.03115 4.80200 2.67021 -94.07641 1060.39363
7455.0000 -101.49712 -96.25681 5.24030 2.57073 -95.29742 1004.62886
7460.0000 -101.22241 -95.33892 5.88349 2.56090 -95.41804 995.58665
7465.0000 -101.18121 -94.79975 6.38146 2.64940 -94.33175 1098.91129
7470.0000 -100.54152 -95.20505 5.33647 2.61049 -94.80936 1039.17676
7475.0000 -100.02056 -94.99535 5.02520 2.60017 -94.93602 989.56909
7480.0000 -99.84665 -94.27353 5.57312 2.60495 -94.87733 1010.93507
7485.0000 -101.06404 -95.08326 5.98078 2.62113 -94.67878 1071.34995
7490.0000 -99.33246 -94.24131 5.09115 2.59441 -95.00677 1031.75575
7495.0000 -99.73381 -93.79078 5.94303 2.65761 -94.23106 1058.77550
7500.0000 -101.08211 -95.40015 5.68195 2.61630 -94.73809 1029.06912
MELTING PROCESS: loop number 31 T-loop= 1045.0000000000000
main_MD> interactions number 31 at Temperature= 1045.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.93265 4.84955 1.40729
force_rgl> df(natom) -2.66286 -2.37816 -2.54208
7505.0000 -100.50197 -95.82803 4.67394 2.61613 -94.74020 1033.48609
7510.0000 -102.20178 -97.03425 5.16753 2.53187 -95.77437 987.42155
7515.0000 -101.79730 -96.69777 5.09953 2.42500 -97.08604 900.59612
7520.0000 -101.43813 -97.00117 4.43696 2.47770 -96.43924 923.97982
7525.0000 -101.82596 -95.02156 6.80440 2.54867 -95.56808 982.21346
7530.0000 -100.23487 -95.67861 4.55626 2.57785 -95.21004 1005.93317
7535.0000 -102.03125 -96.30172 5.72952 2.55353 -95.50854 965.53771
7540.0000 -101.85440 -96.68287 5.17153 2.49517 -96.22478 876.07817
7545.0000 -102.86292 -97.86265 5.00027 2.43979 -96.90454 885.21465
7550.0000 -101.40954 -95.65294 5.75660 2.48574 -96.34052 950.74344
7555.0000 -100.77076 -95.05345 5.71731 2.51972 -95.92344 932.48303
7560.0000 -100.23946 -94.86352 5.37593 2.61193 -94.79169 1002.79282
7565.0000 -102.38822 -95.88739 6.50083 2.58279 -95.14931 961.93249
7570.0000 -101.40737 -94.91765 6.48972 2.59329 -95.02054 1043.09292
7575.0000 -100.03915 -92.78844 7.25070 2.72639 -93.38688 1116.78670
7580.0000 -99.86218 -94.14706 5.71512 2.74136 -93.20315 1109.11933
7585.0000 -100.62214 -94.67884 5.94330 2.70417 -93.65961 1092.57071
7590.0000 -100.53109 -95.05496 5.47612 2.60105 -94.92518 1002.16340
7595.0000 -99.79100 -93.47631 6.31469 2.68434 -93.90291 1072.49442
7600.0000 -100.64645 -95.45052 5.19593 2.63931 -94.45560 1043.13295
7605.0000 -99.68770 -93.34397 6.34373 2.68681 -93.87258 1075.63611
7610.0000 -100.44847 -94.18507 6.26340 2.64763 -94.35351 1047.52698
7615.0000 -100.89985 -93.70492 7.19493 2.70693 -93.62573 1089.69621
7620.0000 -99.42362 -94.24819 5.17543 2.74117 -93.20547 1114.66135
7625.0000 -98.71599 -92.28623 6.42977 2.69236 -93.80452 1098.59711
7630.0000 -100.59465 -93.14668 7.44796 2.72620 -93.38921 1121.03754
7635.0000 -101.97983 -94.73441 7.24542 2.68437 -93.90256 1119.15067
7640.0000 -99.69804 -94.05697 5.64107 2.59399 -95.01192 1046.72965
7645.0000 -101.07671 -96.30126 4.77545 2.57627 -95.22942 971.20792
7650.0000 -101.85535 -94.70529 7.15006 2.55367 -95.50682 1007.56155
7655.0000 -101.12730 -95.93291 5.19440 2.63031 -94.56612 1033.46361
7660.0000 -99.73123 -94.11773 5.61350 2.63308 -94.53211 1044.74027
7665.0000 -100.80388 -94.97527 5.82861 2.71322 -93.54851 1082.98041
7670.0000 -100.42651 -94.66463 5.76188 2.61228 -94.78739 1022.39081
7675.0000 -99.43802 -94.27792 5.16010 2.62954 -94.57558 1017.82472
7680.0000 -98.96492 -93.47185 5.49306 2.64427 -94.39479 950.69401
7685.0000 -99.39666 -92.47882 6.91784 2.73837 -93.23974 1081.43733
7690.0000 -99.41430 -92.44121 6.97308 2.86337 -91.70560 1215.84543
7695.0000 -99.24994 -93.21795 6.03199 2.76755 -92.88170 1138.43619
7700.0000 -101.05075 -96.47021 4.58054 2.64192 -94.42361 1057.98916
7705.0000 -100.23901 -95.80488 4.43413 2.57248 -95.27593 1008.71007
7710.0000 -99.91171 -93.88592 6.02578 2.61688 -94.73097 1030.75020
7715.0000 -99.86311 -93.61819 6.24493 2.74664 -93.13833 1107.49151
7720.0000 -100.68203 -95.14732 5.53471 2.65210 -94.29862 1055.29630
7725.0000 -102.26242 -97.10995 5.15247 2.49285 -96.25329 876.06426
7730.0000 -99.95141 -94.79628 5.15513 2.50818 -96.06508 926.00835
7735.0000 -101.72440 -95.14433 6.58007 2.60600 -94.86454 1013.25238
7740.0000 -99.74543 -94.27952 5.46591 2.63571 -94.49980 1003.31655
7745.0000 -101.34137 -95.79825 5.54312 2.61190 -94.79210 1009.08916
7750.0000 -99.02057 -92.47884 6.54172 2.65809 -94.22515 1059.02274
MELTING PROCESS: loop number 32 T-loop= 1070.0000000000000
main_MD> interactions number 32 at Temperature= 1070.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 5.92123 -2.05175 -2.09206
force_rgl> df(natom) -0.76566 2.20531 -0.33579
7755.0000 -98.70935 -92.95623 5.75312 2.80262 -92.45123 1174.75826
7760.0000 -100.67063 -94.36039 6.31024 2.68790 -93.85927 1113.84734
7765.0000 -100.45484 -94.83333 5.62151 2.64303 -94.40998 1052.89632
7770.0000 -100.07787 -93.59298 6.48490 2.62153 -94.67387 1038.65541
7775.0000 -98.97122 -94.10632 4.86490 2.67312 -94.04067 1061.20818
7780.0000 -98.98460 -94.08847 4.89613 2.65225 -94.29686 1053.64567
7785.0000 -100.61750 -94.83411 5.78340 2.60339 -94.89657 1059.34169
7790.0000 -100.99072 -94.52692 6.46380 2.63097 -94.55806 1059.66894
7795.0000 -99.46909 -94.05598 5.41311 2.65640 -94.24589 1052.95638
7800.0000 -98.98799 -93.15876 5.82923 2.75321 -93.05767 1132.21657
7805.0000 -99.98294 -93.83228 6.15066 2.75939 -92.98184 1144.60312
7810.0000 -100.14981 -94.13554 6.01427 2.65134 -94.30794 1092.40142
7815.0000 -100.96233 -93.92815 7.03418 2.68217 -93.92953 1087.30414
7820.0000 -101.11130 -94.51801 6.59329 2.63979 -94.44975 1047.77205
7825.0000 -101.66272 -96.62294 5.03978 2.49364 -96.24351 947.08357
7830.0000 -101.82869 -95.69511 6.13358 2.52321 -95.88059 970.43701
7835.0000 -100.14567 -94.72605 5.41962 2.60213 -94.91201 991.62705
7840.0000 -100.29611 -94.51155 5.78456 2.59377 -95.01459 944.90038
7845.0000 -100.57629 -96.14313 4.43316 2.58377 -95.13727 983.32567
7850.0000 -99.82342 -94.81604 5.00738 2.53675 -95.71439 968.14044
7855.0000 -100.17634 -93.77341 6.40293 2.66451 -94.14634 1072.64950
7860.0000 -101.35182 -94.78431 6.56751 2.67012 -94.07743 1053.66317
7865.0000 -100.34121 -94.33794 6.00327 2.61852 -94.71077 985.71113
7870.0000 -100.63314 -94.55838 6.07476 2.61373 -94.76962 1027.03758
7875.0000 -99.75576 -93.55951 6.19625 2.65932 -94.21007 1043.80250
7880.0000 -100.05108 -94.14170 5.90939 2.66009 -94.20065 1063.42342
7885.0000 -99.11542 -92.70604 6.40938 2.75328 -93.05675 1091.97388
7890.0000 -99.39900 -93.51429 5.88471 2.66748 -94.10992 1087.80012
7895.0000 -97.94725 -92.41790 5.52935 2.86151 -91.72842 1225.96235
7900.0000 -100.36942 -94.97356 5.39585 2.66653 -94.12153 1058.35644
7905.0000 -101.17398 -94.49915 6.67483 2.65096 -94.31266 1041.91747
7910.0000 -100.29773 -94.43630 5.86144 2.69919 -93.72067 1080.08585
7915.0000 -100.26347 -93.91537 6.34809 2.67281 -94.04445 1079.36554
7920.0000 -100.98212 -96.05967 4.92245 2.62454 -94.63689 1024.71707
7925.0000 -101.53429 -96.17182 5.36247 2.49338 -96.24672 941.32805
7930.0000 -101.59915 -95.05790 6.54125 2.56417 -95.37790 992.65331
7935.0000 -99.83708 -94.46596 5.37112 2.61568 -94.74564 1009.92479
7940.0000 -100.61560 -94.29199 6.32360 2.64328 -94.40697 1058.96494
7945.0000 -99.69623 -94.37076 5.32547 2.55889 -95.44270 1000.11213
7950.0000 -100.32724 -95.14764 5.17960 2.59837 -94.95810 989.74723
7955.0000 -99.97579 -94.31514 5.66065 2.66553 -94.13383 1080.37587
7960.0000 -99.60463 -93.70075 5.90388 2.69260 -93.80157 1067.36693
7965.0000 -99.20393 -93.00014 6.20379 2.68390 -93.90841 1119.42004
7970.0000 -99.64043 -92.41799 7.22245 2.88500 -91.44005 1254.10488
7975.0000 -100.03866 -94.15536 5.88329 2.75555 -93.02899 1129.62645
7980.0000 -101.79048 -95.33130 6.45919 2.61880 -94.70740 1036.58377
7985.0000 -98.82685 -93.00373 5.82312 2.66244 -94.17176 1062.81026
7990.0000 -97.97698 -92.94536 5.03162 2.68116 -93.94201 1050.23420
7995.0000 -99.64903 -92.96208 6.68696 2.77198 -92.82727 1067.18438
8000.0000 -100.99018 -95.10309 5.88709 2.72192 -93.44175 1107.98823
MELTING PROCESS: loop number 33 T-loop= 1095.0000000000000
main_MD> interactions number 33 at Temperature= 1095.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.66265 0.75648 -1.91638
force_rgl> df(natom) -1.83850 2.59936 -1.58640
8005.0000 -99.27883 -93.46941 5.80942 2.66367 -94.15666 1067.66027
8010.0000 -102.08081 -95.32534 6.75547 2.67631 -94.00148 1079.71520
8015.0000 -98.74531 -93.51746 5.22785 2.70337 -93.66940 1057.50874
8020.0000 -100.24683 -95.36935 4.87748 2.69401 -93.78423 1092.35435
8025.0000 -101.03465 -95.55362 5.48102 2.55072 -95.54298 945.12500
8030.0000 -100.82809 -95.39168 5.43641 2.53349 -95.75450 992.70832
8035.0000 -99.52721 -92.82210 6.70511 2.63328 -94.52968 1010.47410
8040.0000 -98.21169 -92.17696 6.03473 2.84048 -91.98658 1218.21700
8045.0000 -99.98609 -94.36699 5.61909 2.72009 -93.46411 1038.11711
8050.0000 -99.91317 -92.28513 7.62804 2.82276 -92.20405 1192.00460
8055.0000 -99.25784 -92.87788 6.37996 2.75324 -93.05731 1112.73454
8060.0000 -100.76038 -94.43123 6.32914 2.65828 -94.22280 1049.95448
8065.0000 -100.30822 -94.94033 5.36789 2.62082 -94.68263 1079.69653
8070.0000 -101.37910 -95.08283 6.29627 2.59969 -94.94196 1031.98752
8075.0000 -100.73081 -94.27164 6.45917 2.64965 -94.32867 1075.69273
8080.0000 -101.65388 -93.90514 7.74875 2.69708 -93.74653 1160.20231
8085.0000 -99.51352 -94.00108 5.51244 2.69055 -93.82670 1115.41996
8090.0000 -99.76859 -93.38654 6.38205 2.66725 -94.11275 1072.37465
8095.0000 -100.60248 -94.23484 6.36764 2.62869 -94.58598 1041.77420
8100.0000 -99.05219 -94.13292 4.91926 2.68980 -93.83589 1113.82285
8105.0000 -98.26661 -91.05425 7.21236 2.85379 -91.82311 1241.66662
8110.0000 -98.34612 -90.52859 7.81752 2.87020 -91.62177 1244.19403
8115.0000 -99.14649 -92.16659 6.97991 2.84058 -91.98525 1174.89299
8120.0000 -99.67771 -93.39802 6.27968 2.76399 -92.92538 1112.53429
8125.0000 -100.10589 -93.45374 6.65214 2.71166 -93.56769 1095.84515
8130.0000 -101.46010 -95.42725 6.03285 2.62219 -94.66583 1023.47489
8135.0000 -99.32794 -92.93446 6.39348 2.65946 -94.20832 1071.39005
8140.0000 -100.64868 -94.08130 6.56737 2.67805 -93.98020 1083.12832
8145.0000 -99.92667 -93.06562 6.86105 2.61969 -94.69643 1028.86006
8150.0000 -100.33650 -94.71195 5.62455 2.75215 -93.07065 1123.70098
8155.0000 -101.38501 -95.09250 6.29250 2.59527 -94.99619 1013.27274
8160.0000 -100.34934 -93.44244 6.90690 2.61784 -94.71910 1047.45196
8165.0000 -100.72440 -93.91212 6.81228 2.70225 -93.68311 1144.10071
8170.0000 -98.87043 -93.40426 5.46616 2.72064 -93.45735 1114.03736
8175.0000 -98.95424 -92.72910 6.22514 2.75863 -92.99111 1153.58853
8180.0000 -100.56850 -93.79332 6.77518 2.70478 -93.65210 1083.28618
8185.0000 -98.62635 -93.18754 5.43882 2.76685 -92.89022 1147.88946
8190.0000 -98.76207 -92.27521 6.48686 2.81283 -92.32589 1194.84210
8195.0000 -98.50482 -91.54079 6.96403 2.77556 -92.78338 1170.01960
8200.0000 -98.71165 -91.65459 7.05706 2.89645 -91.29955 1240.04193
8205.0000 -99.98801 -94.20050 5.78752 2.78788 -92.63210 1175.97210
8210.0000 -100.27082 -95.37016 4.90066 2.62029 -94.68909 1026.35723
8215.0000 -100.76907 -94.40410 6.36497 2.61925 -94.70183 1017.65846
8220.0000 -100.25246 -93.48676 6.76570 2.71071 -93.57927 1108.67836
8225.0000 -100.03861 -94.06713 5.97148 2.73422 -93.29068 1126.99767
8230.0000 -100.20068 -94.37739 5.82329 2.63951 -94.45321 1038.23915
8235.0000 -100.89301 -94.74898 6.14403 2.61126 -94.79992 1055.83648
8240.0000 -98.41242 -92.19646 6.21595 2.74235 -93.19091 1099.09699
8245.0000 -99.65825 -93.84179 5.81646 2.83674 -92.03243 1172.41389
8250.0000 -98.78381 -92.59277 6.19104 2.71509 -93.52556 1116.65792
MELTING PROCESS: loop number 34 T-loop= 1120.0000000000000
main_MD> interactions number 34 at Temperature= 1120.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -3.33226 -2.20704 6.27575
force_rgl> df(natom) -0.19707 -1.77859 -2.70217
8255.0000 -99.30743 -94.43714 4.87030 2.73354 -93.29906 1108.40679
8260.0000 -98.30468 -91.94244 6.36225 2.78008 -92.72786 1166.55296
8265.0000 -99.37288 -93.19968 6.17320 2.79840 -92.50302 1199.20210
8270.0000 -99.58607 -92.67665 6.90942 2.75512 -93.03424 1165.82602
8275.0000 -99.63865 -93.56611 6.07254 2.67835 -93.97643 1068.88101
8280.0000 -98.84429 -91.94037 6.90392 2.79702 -92.51994 1165.16408
8285.0000 -99.66768 -93.48683 6.18084 2.80371 -92.43785 1134.47750
8290.0000 -98.33791 -92.48593 5.85198 2.78995 -92.60672 1156.09158
8295.0000 -100.14583 -93.46255 6.68328 2.71452 -93.53257 1123.99165
8300.0000 -100.08943 -93.71733 6.37210 2.68529 -93.89131 1058.53545
8305.0000 -98.58786 -92.59790 5.98996 2.77913 -92.73955 1173.58737
8310.0000 -99.55436 -92.39460 7.15976 2.78584 -92.65721 1179.86625
8315.0000 -100.79456 -96.73190 4.06266 2.58069 -95.17510 1028.96608
8320.0000 -99.85312 -94.93697 4.91615 2.53962 -95.67921 981.72480
8325.0000 -100.98946 -95.14524 5.84422 2.60723 -94.84942 1050.59018
8330.0000 -99.49126 -94.40451 5.08675 2.60202 -94.91339 1009.70322
8335.0000 -100.98923 -95.20436 5.78487 2.61390 -94.76752 1011.93215
8340.0000 -99.64296 -94.33209 5.31087 2.56627 -95.35206 987.16479
8345.0000 -100.83434 -94.45247 6.38187 2.60209 -94.91248 990.23626
8350.0000 -100.18682 -94.72184 5.46497 2.56260 -95.39713 967.98552
8355.0000 -100.01244 -93.66182 6.35062 2.68425 -93.90412 1054.10291
8360.0000 -100.15435 -93.57668 6.57767 2.73822 -93.24168 1116.08924
8365.0000 -98.55421 -92.27177 6.28243 2.78402 -92.67944 1188.38750
8370.0000 -100.45411 -93.83297 6.62114 2.74043 -93.21447 1129.87568
8375.0000 -100.55677 -94.18769 6.36908 2.60429 -94.88547 1035.76466
8380.0000 -101.75846 -95.48100 6.27746 2.59808 -94.96164 981.22136
8385.0000 -99.57841 -94.39200 5.18641 2.63107 -94.55672 1044.54859
8390.0000 -99.35001 -95.04621 4.30381 2.55675 -95.46900 977.24472
8395.0000 -100.34685 -95.17392 5.17293 2.52671 -95.83764 939.53406
8400.0000 -100.60754 -94.34835 6.25920 2.60564 -94.86895 1003.18625
8405.0000 -98.83737 -92.04463 6.79275 2.78282 -92.69417 1171.35871
8410.0000 -98.40813 -92.40268 6.00545 2.80584 -92.41167 1196.70857
8415.0000 -100.17406 -92.78325 7.39081 2.80904 -92.37241 1214.58972
8420.0000 -100.61349 -94.22541 6.38808 2.71110 -93.57445 1088.88633
8425.0000 -98.80294 -92.48831 6.31463 2.70343 -93.66861 1053.29164
8430.0000 -99.85167 -93.34543 6.50624 2.71064 -93.58012 1067.29813
8435.0000 -98.79259 -92.83512 5.95747 2.78773 -92.63402 1134.69505
8440.0000 -99.42689 -93.84561 5.58128 2.73877 -93.23492 1132.18130
8445.0000 -99.50033 -93.27005 6.23028 2.65336 -94.28323 1079.12582
8450.0000 -100.45516 -93.99007 6.46509 2.70736 -93.62037 1087.35276
8455.0000 -100.30540 -94.87468 5.43072 2.66488 -94.14175 1063.30590
8460.0000 -100.92379 -94.37727 6.54652 2.64135 -94.43058 1057.59226
8465.0000 -100.25318 -94.62354 5.62964 2.61078 -94.80582 1045.60106
8470.0000 -99.12286 -92.08974 7.03311 2.68781 -93.86042 1080.10382
8475.0000 -100.02203 -93.54921 6.47282 2.75617 -93.02131 1194.69802
8480.0000 -100.26275 -93.18039 7.08236 2.72719 -93.37698 1166.28430
8485.0000 -100.93330 -94.45317 6.48013 2.69564 -93.76423 1097.31811
8490.0000 -98.98658 -92.96095 6.02563 2.69246 -93.80331 1064.56619
8495.0000 -100.52858 -94.01748 6.51109 2.64596 -94.37401 1061.86884
8500.0000 -99.44907 -93.15775 6.29133 2.72702 -93.37916 1120.95448
MELTING PROCESS: loop number 35 T-loop= 1145.0000000000000
main_MD> interactions number 35 at Temperature= 1145.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -2.52019 0.35275 0.97986
force_rgl> df(natom) -1.40717 -0.88203 -1.71376
8505.0000 -98.70687 -93.52190 5.18497 2.73621 -93.26636 1188.52675
8510.0000 -101.47054 -92.44060 9.02994 2.70849 -93.60660 1120.23357
8515.0000 -99.60017 -92.11742 7.48274 2.87048 -91.61835 1264.12464
8520.0000 -98.74879 -93.70128 5.04751 2.77501 -92.79009 1094.18828
8525.0000 -98.25477 -91.54806 6.70671 2.79023 -92.60326 1184.39767
8530.0000 -98.30402 -90.93112 7.37290 2.92246 -90.98029 1278.72123
8535.0000 -98.94539 -93.24381 5.70158 2.85291 -91.83398 1200.84035
8540.0000 -98.52340 -92.33740 6.18600 2.80381 -92.43660 1119.44820
8545.0000 -98.47752 -92.20101 6.27651 2.77835 -92.74907 1169.10181
8550.0000 -98.04573 -91.87704 6.16869 2.82746 -92.14629 1184.46692
8555.0000 -98.61279 -93.02309 5.58970 2.84229 -91.96430 1190.90950
8560.0000 -99.69646 -93.93391 5.76255 2.64579 -94.37608 1056.64274
8565.0000 -98.46042 -93.66882 4.79160 2.71368 -93.54285 1099.80519
8570.0000 -99.46204 -91.95140 7.51064 2.79907 -92.49475 1090.68239
8575.0000 -98.02711 -89.81895 8.20815 2.98297 -90.23765 1295.65112
8580.0000 -98.71200 -93.90449 4.80751 2.85493 -91.80914 1214.76683
8585.0000 -99.29683 -93.38632 5.91050 2.74224 -93.19233 1101.01775
8590.0000 -100.88440 -94.38856 6.49583 2.72179 -93.44331 1131.27770
8595.0000 -99.28254 -93.13931 6.14323 2.67400 -94.02988 1047.22019
8600.0000 -100.41852 -95.48665 4.93187 2.62584 -94.62095 1026.47447
8605.0000 -98.85661 -93.47195 5.38466 2.64260 -94.41521 1051.72488
8610.0000 -99.91551 -93.02215 6.89336 2.64980 -94.32689 1050.40047
8615.0000 -99.71999 -93.28360 6.43639 2.72017 -93.46318 1137.34219
8620.0000 -98.77098 -91.22363 7.54735 2.81715 -92.27291 1157.80039
8625.0000 -97.61982 -92.50340 5.11641 2.79039 -92.60136 1132.14627
8630.0000 -98.87945 -92.29613 6.58332 2.89213 -91.35255 1272.13843
8635.0000 -98.74469 -92.61690 6.12778 2.83352 -92.07191 1205.61162
8640.0000 -99.32304 -92.72341 6.59962 2.80935 -92.36866 1151.30778
8645.0000 -101.11005 -94.72500 6.38505 2.67223 -94.05154 1089.38971
8650.0000 -102.37191 -94.63283 7.73908 2.64805 -94.34837 1109.40274
8655.0000 -99.32533 -92.73002 6.59532 2.69454 -93.77782 1096.77979
8660.0000 -99.05246 -92.66499 6.38747 2.74418 -93.16854 1142.01196
8665.0000 -99.78663 -92.50720 7.27944 2.83557 -92.04678 1180.41108
8670.0000 -98.00107 -90.51632 7.48475 2.85665 -91.78806 1224.32702
8675.0000 -99.21819 -91.21347 8.00472 2.95744 -90.55102 1355.54359
8680.0000 -98.32713 -90.86403 7.46310 2.88228 -91.47349 1246.02694
8685.0000 -98.41708 -92.31235 6.10473 2.87367 -91.57921 1223.27842
8690.0000 -96.98974 -91.39794 5.59180 2.86266 -91.71431 1227.40776
8695.0000 -98.39628 -90.70091 7.69538 2.86924 -91.63347 1253.55831
8700.0000 -97.81575 -90.72731 7.08844 2.94613 -90.68983 1257.90137
8705.0000 -97.68056 -91.00311 6.67745 2.91758 -91.04023 1238.38894
8710.0000 -99.16769 -93.04650 6.12119 2.81813 -92.26088 1138.21215
8715.0000 -97.96111 -91.68939 6.27173 2.83687 -92.03089 1168.81653
8720.0000 -99.48237 -93.18189 6.30048 2.80920 -92.37043 1153.04373
8725.0000 -97.05821 -89.94730 7.11091 2.88274 -91.46779 1212.03088
8730.0000 -98.62322 -91.82029 6.80293 2.89394 -91.33039 1239.13820
8735.0000 -98.97274 -91.90799 7.06475 2.88409 -91.45131 1253.06623
8740.0000 -99.45553 -92.52179 6.93374 2.77836 -92.74900 1185.10597
8745.0000 -97.87756 -92.40381 5.47376 2.74137 -93.20303 1141.36654
8750.0000 -99.73936 -92.94688 6.79248 2.79989 -92.48471 1146.23819
MELTING PROCESS: loop number 36 T-loop= 1170.0000000000000
main_MD> interactions number 36 at Temperature= 1170.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.92287 1.91352 0.31231
force_rgl> df(natom) -1.71341 0.54960 -3.49313
8755.0000 -97.76057 -92.44854 5.31203 2.72686 -93.38109 1133.39884
8760.0000 -100.97123 -94.17249 6.79874 2.73461 -93.28591 1156.83188
8765.0000 -100.29926 -94.14001 6.15925 2.65903 -94.21364 1097.86655
8770.0000 -98.99797 -92.26647 6.73150 2.74766 -93.12574 1118.42994
8775.0000 -98.79142 -92.28700 6.50442 2.80766 -92.38937 1151.43408
8780.0000 -98.53635 -91.76888 6.76747 2.83295 -92.07896 1229.79798
8785.0000 -99.07923 -93.42199 5.65725 2.76028 -92.97093 1135.93182
8790.0000 -99.00628 -91.88307 7.12321 2.79121 -92.59130 1169.82303
8795.0000 -98.41941 -92.48521 5.93420 2.85229 -91.84156 1225.23747
8800.0000 -98.91188 -91.88766 7.02422 2.82363 -92.19334 1201.27657
8805.0000 -98.86564 -92.59438 6.27126 2.78517 -92.66534 1154.39045
8810.0000 -98.48659 -91.77594 6.71065 2.88989 -91.38008 1250.42400
8815.0000 -99.24652 -91.23663 8.00988 2.89561 -91.30985 1301.75939
8820.0000 -99.54773 -92.65018 6.89754 2.73604 -93.26846 1143.94113
8825.0000 -99.45544 -92.95704 6.49840 2.74808 -93.12058 1111.60578
8830.0000 -97.77259 -92.15929 5.61330 2.79723 -92.51736 1202.40127
8835.0000 -99.25781 -93.03687 6.22094 2.79352 -92.56284 1124.19462
8840.0000 -100.73933 -94.65072 6.08861 2.72330 -93.42477 1108.15279
8845.0000 -99.78486 -95.51032 4.27454 2.60652 -94.85815 1049.15712
8850.0000 -99.51231 -93.65556 5.85675 2.69292 -93.79769 1079.99611
8855.0000 -98.48710 -91.47033 7.01677 2.86552 -91.67924 1186.18981
8860.0000 -98.33375 -92.59358 5.74016 2.83579 -92.04410 1210.49398
8865.0000 -98.30710 -91.08468 7.22242 2.84405 -91.94265 1219.41280
8870.0000 -98.89696 -93.39296 5.50400 2.83219 -92.08829 1214.41341
8875.0000 -100.42393 -94.59260 5.83134 2.68977 -93.83627 1093.04772
8880.0000 -98.48250 -92.04565 6.43685 2.76298 -92.93771 1167.21035
8885.0000 -98.48643 -93.08545 5.40098 2.81821 -92.25981 1233.38629
8890.0000 -99.23930 -92.68330 6.55600 2.74655 -93.13944 1131.94294
8895.0000 -98.91034 -92.33573 6.57460 2.82888 -92.12889 1217.93876
8900.0000 -98.35772 -93.00330 5.35442 2.73903 -93.23164 1079.46624
8905.0000 -97.38265 -91.47521 5.90744 2.81833 -92.25842 1160.04914
8910.0000 -97.96885 -92.05775 5.91109 2.85629 -91.79253 1225.40836
8915.0000 -98.81396 -91.39301 7.42095 2.89078 -91.36915 1238.21644
8920.0000 -96.90172 -90.32423 6.57749 2.95924 -90.52889 1308.77213
8925.0000 -98.94328 -92.04195 6.90133 2.86311 -91.70878 1270.95958
8930.0000 -98.01790 -92.47523 5.54267 2.83852 -92.01054 1191.17981
8935.0000 -99.37072 -92.01716 7.35356 2.83688 -92.03068 1227.97540
8940.0000 -99.48699 -93.00627 6.48073 2.81212 -92.33458 1142.93529
8945.0000 -98.13543 -91.49893 6.63650 2.82176 -92.21634 1217.16121
8950.0000 -100.09083 -92.88754 7.20329 2.83703 -92.02886 1195.63704
8955.0000 -97.79513 -90.00048 7.79465 2.93390 -90.83990 1272.87042
8960.0000 -96.64129 -91.39784 5.24345 2.95386 -90.59495 1275.53867
8965.0000 -98.08059 -91.34094 6.73965 2.88962 -91.38339 1255.38318
8970.0000 -98.11236 -90.29730 7.81506 2.87175 -91.60267 1204.13923
8975.0000 -98.45642 -92.92185 5.53456 2.88289 -91.46605 1272.58357
8980.0000 -99.76812 -92.89724 6.87087 2.71670 -93.50579 1126.66619
8985.0000 -99.55239 -92.66163 6.89076 2.75444 -93.04255 1145.24134
8990.0000 -98.05651 -91.84180 6.21471 2.82566 -92.16845 1219.95740
8995.0000 -99.06304 -90.93260 8.13045 2.82958 -92.12030 1225.00082
9000.0000 -99.79826 -93.22238 6.57588 2.81236 -92.33166 1172.56421
MELTING PROCESS: loop number 37 T-loop= 1195.0000000000000
main_MD> interactions number 37 at Temperature= 1195.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.08817 -0.94928 -1.76431
force_rgl> df(natom) -4.00329 0.11284 -2.28316
9005.0000 -99.17141 -91.90502 7.26639 2.77625 -92.77482 1211.01390
9010.0000 -100.07645 -93.40719 6.66926 2.78539 -92.66272 1155.65063
9015.0000 -97.53941 -91.91991 5.61950 2.78206 -92.70355 1161.67708
9020.0000 -97.76975 -91.10766 6.66209 2.88908 -91.39006 1226.10702
9025.0000 -97.76142 -90.43001 7.33142 2.91706 -91.04659 1269.75029
9030.0000 -96.68291 -89.89790 6.78501 3.02864 -89.67705 1296.02053
9035.0000 -98.47868 -90.52970 7.94898 2.98242 -90.24439 1310.61540
9040.0000 -100.57176 -93.93456 6.63720 2.77410 -92.80122 1154.63500
9045.0000 -100.00163 -93.77783 6.22381 2.77066 -92.84344 1175.57157
9050.0000 -100.75126 -94.11438 6.63688 2.75519 -93.03331 1145.15600
9055.0000 -99.22979 -92.77167 6.45812 2.74073 -93.21086 1143.97424
9060.0000 -100.37356 -93.98516 6.38840 2.72437 -93.41163 1153.30998
9065.0000 -99.76205 -93.05601 6.70604 2.71596 -93.51488 1111.38063
9070.0000 -99.46897 -93.58864 5.88033 2.69637 -93.75534 1071.36355
9075.0000 -99.23817 -92.86373 6.37444 2.78857 -92.62362 1181.84122
9080.0000 -98.38674 -91.37106 7.01568 2.83208 -92.08964 1171.80042
9085.0000 -98.30366 -91.72674 6.57693 2.80345 -92.44099 1172.82575
9090.0000 -98.48903 -90.51695 7.97209 2.89065 -91.37076 1225.91723
9095.0000 -99.65512 -91.43583 8.21929 2.91398 -91.08436 1249.08137
9100.0000 -98.91034 -91.32340 7.58694 2.87171 -91.60323 1241.95819
9105.0000 -97.14159 -90.81690 6.32470 2.90633 -91.17830 1252.58953
9110.0000 -98.86713 -92.64841 6.21872 2.87323 -91.58461 1225.49355
9115.0000 -100.72543 -93.21324 7.51219 2.79544 -92.53928 1168.14337
9120.0000 -99.23679 -92.30828 6.92851 2.75618 -93.02115 1130.94280
9125.0000 -100.33520 -94.26573 6.06947 2.70279 -93.67651 1065.43539
9130.0000 -99.37702 -93.76737 5.60966 2.69101 -93.82113 1093.12268
9135.0000 -100.41842 -95.25317 5.16525 2.66018 -94.19944 1074.13384
9140.0000 -100.63744 -94.30601 6.33143 2.60014 -94.93637 983.23081
9145.0000 -98.74423 -93.43475 5.30948 2.67304 -94.04165 1082.15379
9150.0000 -97.76255 -91.07469 6.68785 2.78092 -92.71754 1136.28049
9155.0000 -98.50018 -90.73868 7.76150 2.92170 -90.98966 1275.17273
9160.0000 -100.92862 -94.80005 6.12856 2.77013 -92.84993 1175.29994
9165.0000 -99.46247 -93.64786 5.81461 2.68532 -93.89093 1076.07805
9170.0000 -99.15042 -92.57989 6.57053 2.76960 -92.85651 1142.34592
9175.0000 -99.21775 -93.67360 5.54414 2.80234 -92.45461 1155.45701
9180.0000 -99.46443 -92.19409 7.27034 2.68273 -93.92265 1064.57498
9185.0000 -99.61884 -94.08673 5.53211 2.78349 -92.68605 1150.52878
9190.0000 -98.15630 -91.99561 6.16068 2.74677 -93.13669 1109.42642
9195.0000 -99.51823 -92.63321 6.88502 2.79307 -92.56842 1162.21986
9200.0000 -97.84271 -91.81136 6.03135 2.83067 -92.10687 1177.34803
9205.0000 -99.07074 -92.98364 6.08710 2.81030 -92.35700 1181.84077
9210.0000 -99.52518 -93.09827 6.42691 2.66407 -94.15170 1060.72879
9215.0000 -98.59155 -92.99538 5.59617 2.76890 -92.86507 1152.15298
9220.0000 -97.69691 -92.42597 5.27093 2.77187 -92.82862 1104.13409
9225.0000 -98.97117 -94.30251 4.66866 2.74059 -93.21257 1092.51592
9230.0000 -100.19587 -93.47835 6.71752 2.69671 -93.75116 1069.85982
9235.0000 -98.19414 -91.28050 6.91363 2.81780 -92.26488 1196.41910
9240.0000 -99.80300 -92.61931 7.18369 2.88957 -91.38395 1218.95954
9245.0000 -100.24269 -93.33151 6.91117 2.77448 -92.79658 1118.80307
9250.0000 -99.97803 -93.02599 6.95204 2.74057 -93.21278 1105.55180
main_MD> EXECUTION TIME: 0 [day], 0 [hour], 8 [min], 22.4624586 [s].
main_MD> Deallocating global variables
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