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nanoparticlesims/growth_Melting_Silver_ICO_3269/meltingSims/run_45/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_45.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 = 45 ntipo2 = 0
read_input> Finish reading input
main_MD> Allocating global variables
main_MD> Number of outputs that will be created: 1750
main_MD> Size of nv and nvoiz: 45 4500
main_MD> Size of nv and nvoiz: 45 4500
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 = 45
main_MD> Consider changing parameter nsiz in module_parameters.f90 for performance
main_MD> collvar_wanted = F
main_MD> INPUT AND POTENTIAL FILE READING IS DONE
main_MD> THERMALIZATION IS STARTING
init> -2.3556899085195464E-002 -1.5389841792329642E-002 -1.8307564980560187E-003 initial drift of cluster / NP1 for coalescence
init> 0.31363215629176600 0.31665720142759268 0.29931612213189601 scaling for velocity /for coalescence NP1
init.f90 > facguy = 1.8811862729788730E-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) -1.47779 -2.08994 -2.76030
force_rgl> df(natom) 0.57634 0.07920 0.34829
preparo> THERMALIZATION PROCESS AT 306.31719285802745
preparo> TOTAL ENERGY, KINETIC EN., POT. ENERGY, DELTA
5000 -110.72522896676827 2.2804840002887956 -113.00571296705706 3.7677052417573755E-004
preparo> END THERMALISATION ON NPAST DEFINE IN PARACLUSTER MODULE
main_MD> Time-loop is starting for melting
main_MD> Now the computation of EXECUTION TIME starts
main_MD> Running from loop 1 to 35
MELTING PROCESS: loop number 1 T-loop= 332.00000000000000
main_MD> interactions number 1 at Temperature= 332.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.79781 1.13907 0.44956
force_rgl> df(natom) -0.95547 0.09413 -1.53710
5.0000 -112.49833 -110.45011 2.04821 1.76031 -110.47943 342.45588
10.0000 -112.28503 -110.06426 2.22076 1.77750 -110.26195 354.76383
15.0000 -112.25250 -110.22645 2.02604 1.78507 -110.16621 368.06400
20.0000 -112.66347 -110.34008 2.32339 1.76988 -110.35837 346.00736
25.0000 -112.50280 -110.06050 2.44230 1.77966 -110.23465 364.32031
30.0000 -112.56502 -110.35338 2.21164 1.78476 -110.17015 366.06780
35.0000 -113.10661 -110.99866 2.10795 1.74636 -110.65595 334.29105
40.0000 -112.37197 -110.73641 1.63556 1.73662 -110.77922 325.34586
45.0000 -112.66829 -110.69332 1.97497 1.74536 -110.66862 333.40162
50.0000 -112.65014 -110.72048 1.92966 1.74355 -110.69148 324.19365
55.0000 -112.80152 -110.72364 2.07787 1.72958 -110.86826 315.88932
60.0000 -112.39070 -110.28467 2.10603 1.74450 -110.67942 330.71414
65.0000 -112.36304 -109.78426 2.57878 1.79123 -110.08829 368.49798
70.0000 -112.30651 -110.41925 1.88726 1.78430 -110.17590 366.25030
75.0000 -112.85576 -111.07275 1.78301 1.73546 -110.79383 314.74087
80.0000 -112.84545 -110.76855 2.07690 1.73330 -110.82116 318.10590
85.0000 -112.82282 -110.81935 2.00347 1.72583 -110.91564 303.47754
90.0000 -112.55154 -110.96520 1.58634 1.72566 -110.91782 306.21879
95.0000 -112.80502 -110.82907 1.97595 1.74638 -110.65569 331.20107
100.0000 -112.72589 -110.52020 2.20569 1.74594 -110.66130 325.22619
105.0000 -112.69664 -110.61099 2.08565 1.76409 -110.43167 348.33874
110.0000 -112.26174 -110.71624 1.54550 1.75712 -110.51986 340.43852
115.0000 -112.74280 -110.54654 2.19626 1.73727 -110.77095 318.22428
120.0000 -112.63293 -110.74581 1.88711 1.74990 -110.61111 330.81105
125.0000 -112.58767 -110.69164 1.89603 1.73991 -110.73757 322.90643
130.0000 -113.09615 -111.05392 2.04223 1.73091 -110.85145 324.13679
135.0000 -112.61631 -110.32245 2.29386 1.73386 -110.81407 312.07479
140.0000 -112.60298 -110.71081 1.89216 1.75777 -110.51164 346.10915
145.0000 -112.34365 -110.35266 1.99099 1.76267 -110.44965 347.74852
150.0000 -112.79171 -110.98683 1.80489 1.76650 -110.40115 346.17501
155.0000 -112.22968 -110.44822 1.78146 1.73947 -110.74313 311.45491
160.0000 -112.66751 -110.81144 1.85607 1.76396 -110.43326 326.27963
165.0000 -112.83486 -111.23687 1.59799 1.71293 -111.07884 290.67317
170.0000 -112.91956 -111.26820 1.65136 1.69706 -111.27964 281.21599
175.0000 -112.79400 -110.90024 1.89376 1.72554 -110.91930 305.89265
180.0000 -112.54869 -110.39084 2.15785 1.73303 -110.82463 317.84544
185.0000 -111.81071 -110.18376 1.62695 1.76386 -110.43454 341.63338
190.0000 -112.27151 -110.36276 1.90874 1.77848 -110.24956 363.16791
195.0000 -112.71593 -110.80274 1.91319 1.74829 -110.63149 324.01167
200.0000 -112.65767 -110.38117 2.27649 1.73835 -110.75734 327.88689
205.0000 -112.31891 -110.17425 2.14466 1.79168 -110.08259 372.73818
210.0000 -112.25442 -110.62516 1.62926 1.74135 -110.71930 322.45746
215.0000 -112.43707 -110.26771 2.16936 1.73544 -110.79406 321.71811
220.0000 -112.46258 -110.50951 1.95307 1.77759 -110.26079 367.37937
225.0000 -112.26430 -110.14105 2.12325 1.76271 -110.44909 338.05202
230.0000 -112.23137 -110.59734 1.63403 1.74050 -110.73009 311.36503
235.0000 -112.56236 -109.98756 2.57481 1.76734 -110.39054 350.44067
240.0000 -112.45212 -110.40067 2.05145 1.82835 -109.61861 418.13169
245.0000 -112.63798 -110.61232 2.02566 1.76169 -110.46196 342.88351
250.0000 -112.36925 -110.57999 1.78926 1.74085 -110.72559 324.34420
MELTING PROCESS: loop number 2 T-loop= 357.00000000000000
main_MD> interactions number 2 at Temperature= 357.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.18118 -0.49290 0.56454
force_rgl> df(natom) -1.23907 0.58374 0.28905
255.0000 -112.13420 -110.29950 1.83470 1.75473 -110.55009 339.90459
260.0000 -112.40678 -110.59805 1.80873 1.76511 -110.41878 349.91984
265.0000 -112.65717 -110.70761 1.94957 1.74669 -110.65181 334.92636
270.0000 -112.73474 -110.58236 2.15237 1.75194 -110.58537 342.35858
275.0000 -112.41007 -110.51307 1.89700 1.75415 -110.55740 338.23492
280.0000 -112.42194 -110.55349 1.86845 1.76664 -110.39933 351.76389
285.0000 -112.62825 -110.31190 2.31635 1.77462 -110.29846 361.18854
290.0000 -112.55906 -110.31545 2.24360 1.78308 -110.19139 368.76720
295.0000 -112.28900 -110.11856 2.17044 1.77872 -110.24658 357.95919
300.0000 -112.49698 -110.44526 2.05172 1.79522 -110.03773 379.09923
305.0000 -112.46414 -110.78857 1.67558 1.73649 -110.78081 322.67177
310.0000 -112.22519 -110.04935 2.17584 1.76503 -110.41969 347.90951
315.0000 -112.04021 -109.81627 2.22394 1.81270 -109.81667 394.39745
320.0000 -112.66567 -110.63393 2.03175 1.76977 -110.35981 356.05361
325.0000 -112.21077 -110.15455 2.05622 1.76806 -110.38143 348.75552
330.0000 -112.43106 -110.47785 1.95321 1.77254 -110.32472 345.14494
335.0000 -112.71805 -110.83414 1.88391 1.75774 -110.51201 334.41367
340.0000 -112.22060 -110.34029 1.88031 1.77337 -110.31423 354.95333
345.0000 -112.50467 -110.25123 2.25344 1.77362 -110.31108 354.87133
350.0000 -112.65422 -110.34899 2.30523 1.78831 -110.12522 376.52181
355.0000 -112.08001 -109.86831 2.21169 1.79438 -110.04847 376.06329
360.0000 -112.05188 -109.96725 2.08463 1.79972 -109.98087 381.60924
365.0000 -112.27365 -110.57673 1.69693 1.77833 -110.25142 352.89567
370.0000 -112.64336 -110.91426 1.72910 1.76258 -110.45077 342.16002
375.0000 -112.20594 -110.11358 2.09236 1.76215 -110.45613 339.45092
380.0000 -112.30448 -110.57582 1.72866 1.76349 -110.43926 344.65640
385.0000 -112.65275 -110.52381 2.12894 1.76693 -110.39570 352.21273
390.0000 -112.44803 -110.85274 1.59529 1.76332 -110.44136 348.11530
395.0000 -112.53209 -110.79195 1.74014 1.75642 -110.52867 339.94447
400.0000 -112.89670 -111.18436 1.71233 1.72631 -110.90959 304.43490
405.0000 -112.74670 -110.68372 2.06297 1.73285 -110.82684 320.29041
410.0000 -111.69185 -109.63802 2.05382 1.79348 -110.05983 380.52189
415.0000 -111.79507 -109.67981 2.11526 1.83554 -109.52770 386.99838
420.0000 -111.90432 -109.75222 2.15210 1.81058 -109.84351 351.93532
425.0000 -112.10288 -109.92686 2.17603 1.80127 -109.96122 350.86009
430.0000 -111.72560 -109.24819 2.47741 1.83120 -109.58261 376.25159
435.0000 -112.16885 -110.05253 2.11633 1.84065 -109.46300 396.63431
440.0000 -112.29911 -110.07399 2.22512 1.81418 -109.79795 377.88832
445.0000 -112.47043 -110.27915 2.19128 1.79708 -110.01425 353.31795
450.0000 -111.99114 -110.12059 1.87056 1.77524 -110.29057 335.18291
455.0000 -112.27130 -109.98442 2.28688 1.78831 -110.12522 356.00339
460.0000 -112.13212 -109.95903 2.17309 1.80211 -109.95064 363.67984
465.0000 -111.81948 -109.39066 2.42882 1.81101 -109.83800 372.46283
470.0000 -111.91980 -110.07329 1.84652 1.81296 -109.81339 379.26675
475.0000 -112.08985 -109.83769 2.25217 1.79445 -110.04753 348.97497
480.0000 -111.95760 -109.90358 2.05402 1.80188 -109.95357 364.95552
485.0000 -112.38834 -109.80760 2.58074 1.80695 -109.88943 371.88246
490.0000 -111.90520 -109.71187 2.19333 1.79550 -110.03421 345.38266
495.0000 -111.42358 -109.67968 1.74390 1.78424 -110.17675 345.75310
500.0000 -111.93586 -110.12991 1.80596 1.80690 -109.89004 373.99723
MELTING PROCESS: loop number 3 T-loop= 382.00000000000000
main_MD> interactions number 3 at Temperature= 382.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.03038 0.04344 -1.80805
force_rgl> df(natom) -0.45562 2.05682 0.06614
505.0000 -112.37554 -110.20119 2.17436 1.76016 -110.48129 318.48146
510.0000 -112.49505 -110.12207 2.37298 1.80641 -109.89622 365.21562
515.0000 -111.56059 -109.13656 2.42403 1.82890 -109.61174 397.31695
520.0000 -111.97275 -109.51507 2.45768 1.85695 -109.25677 410.63998
525.0000 -111.95062 -109.78829 2.16232 1.81327 -109.80947 362.79931
530.0000 -112.10059 -110.20793 1.89266 1.83203 -109.57204 383.67330
535.0000 -112.44633 -110.48945 1.95687 1.76292 -110.44640 336.91273
540.0000 -112.12502 -109.90777 2.21724 1.77305 -110.31825 348.62410
545.0000 -112.14657 -110.30396 1.84261 1.77328 -110.31531 348.64629
550.0000 -112.73711 -110.76312 1.97399 1.75338 -110.56717 331.22852
555.0000 -112.68779 -110.89095 1.79683 1.74045 -110.73069 317.41618
560.0000 -112.53702 -110.65620 1.88082 1.73488 -110.80123 310.83588
565.0000 -112.52849 -110.34690 2.18160 1.75143 -110.59177 323.10353
570.0000 -111.78319 -109.85713 1.92606 1.81284 -109.81491 384.61620
575.0000 -112.70484 -110.65941 2.04543 1.76950 -110.36314 341.87803
580.0000 -111.71778 -109.00989 2.70790 1.81728 -109.75872 394.85597
585.0000 -112.26640 -110.22057 2.04583 1.80469 -109.91801 385.07523
590.0000 -112.42675 -110.14472 2.28203 1.77746 -110.26244 348.43281
595.0000 -111.97591 -109.40425 2.57166 1.82053 -109.71761 403.54113
600.0000 -112.19974 -110.29729 1.90245 1.81816 -109.74759 391.40123
605.0000 -112.51912 -110.36412 2.15499 1.78330 -110.18855 362.74488
610.0000 -111.77019 -109.94235 1.82784 1.78026 -110.22704 351.31592
615.0000 -112.48562 -110.20072 2.28490 1.80536 -109.90956 377.17474
620.0000 -112.44655 -110.08475 2.36180 1.78044 -110.22484 353.90598
625.0000 -112.30663 -110.28003 2.02660 1.76202 -110.45777 342.12425
630.0000 -112.11382 -109.87586 2.23796 1.78408 -110.17877 351.95956
635.0000 -111.98618 -109.74516 2.24102 1.81058 -109.84351 380.62226
640.0000 -112.23083 -109.75213 2.47870 1.81811 -109.74816 396.10609
645.0000 -111.90066 -109.58325 2.31741 1.81525 -109.78437 360.46654
650.0000 -111.94012 -109.51877 2.42135 1.80019 -109.97493 338.47244
655.0000 -111.35292 -108.99879 2.35413 1.85094 -109.33287 393.46566
660.0000 -111.04771 -109.22917 1.81853 1.85096 -109.33260 373.29545
665.0000 -111.59354 -109.44494 2.14860 1.86428 -109.16408 409.26293
670.0000 -111.99799 -109.83835 2.15964 1.82258 -109.69164 387.57550
675.0000 -112.15780 -109.73315 2.42465 1.81027 -109.84744 393.99215
680.0000 -112.12786 -109.78831 2.33955 1.81694 -109.76302 397.51674
685.0000 -112.18864 -109.96112 2.22752 1.80460 -109.91916 388.62611
690.0000 -112.31620 -110.33123 1.98497 1.79416 -110.05123 384.75248
695.0000 -112.08793 -109.61131 2.47663 1.79531 -110.03670 375.21605
700.0000 -111.91835 -109.76915 2.14920 1.80845 -109.87040 387.04617
705.0000 -112.40150 -109.86440 2.53710 1.81892 -109.73790 404.64102
710.0000 -112.17300 -109.87598 2.29702 1.80957 -109.85624 387.13440
715.0000 -112.24475 -110.07874 2.16601 1.78500 -110.16712 369.12543
720.0000 -111.93475 -109.70934 2.22541 1.76585 -110.40938 351.36110
725.0000 -111.83245 -109.72418 2.10827 1.82101 -109.71146 403.89284
730.0000 -112.20640 -110.08432 2.12208 1.79130 -110.08740 380.53917
735.0000 -111.68837 -109.17789 2.51048 1.82281 -109.68880 409.36284
740.0000 -112.03585 -109.24382 2.79203 1.85712 -109.25465 443.43195
745.0000 -111.80789 -109.34621 2.46168 1.83450 -109.54090 393.33011
750.0000 -112.40917 -110.20069 2.20848 1.79826 -109.99938 352.03488
MELTING PROCESS: loop number 4 T-loop= 407.00000000000000
main_MD> interactions number 4 at Temperature= 407.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.69917 -0.49898 -0.62697
force_rgl> df(natom) 1.06936 2.06633 1.05259
755.0000 -112.30670 -109.61030 2.69640 1.82822 -109.62024 386.64054
760.0000 -112.71312 -110.40730 2.30582 1.81952 -109.73038 399.08711
765.0000 -112.06121 -109.57214 2.48907 1.81195 -109.82618 396.71885
770.0000 -111.90468 -109.43794 2.46675 1.83941 -109.47867 423.41175
775.0000 -111.93160 -109.22367 2.70793 1.83143 -109.57968 410.96287
780.0000 -111.75487 -108.53710 3.21776 1.88000 -108.96525 463.11820
785.0000 -112.29523 -110.10489 2.19034 1.83835 -109.49214 426.05445
790.0000 -112.17942 -110.22795 1.95148 1.79079 -110.09381 377.92004
795.0000 -112.21554 -109.63109 2.58445 1.81272 -109.81645 404.52422
800.0000 -112.04174 -109.71706 2.32468 1.81900 -109.73688 409.06735
805.0000 -111.90879 -109.56401 2.34478 1.83427 -109.54371 430.96294
810.0000 -111.73896 -109.54754 2.19143 1.82852 -109.61644 410.54461
815.0000 -112.30743 -109.68109 2.62634 1.82520 -109.65856 407.85442
820.0000 -112.10462 -109.99960 2.10502 1.82361 -109.67865 399.46922
825.0000 -112.25271 -110.27663 1.97608 1.78903 -110.11606 377.04062
830.0000 -111.78799 -109.54503 2.24296 1.80437 -109.92203 381.93528
835.0000 -111.75720 -109.35875 2.39845 1.85268 -109.31082 421.74438
840.0000 -111.42660 -108.86531 2.56129 1.84551 -109.40149 417.59494
845.0000 -111.98133 -109.00108 2.98026 1.88049 -108.95904 457.76392
850.0000 -111.87452 -109.48447 2.39004 1.83418 -109.54495 419.35072
855.0000 -112.41842 -109.90348 2.51494 1.84888 -109.35894 406.53671
860.0000 -111.57407 -109.22862 2.34545 1.83886 -109.48571 390.24374
865.0000 -112.47182 -109.70085 2.77097 1.84830 -109.36620 428.99257
870.0000 -111.81529 -109.13643 2.67886 1.84394 -109.42145 426.30721
875.0000 -111.80122 -109.24900 2.55222 1.85369 -109.29801 433.20477
880.0000 -111.79959 -109.39899 2.40060 1.82747 -109.62980 408.84575
885.0000 -112.00442 -109.66411 2.34031 1.83327 -109.55642 416.31919
890.0000 -112.27702 -109.91731 2.35970 1.81180 -109.82808 398.84670
895.0000 -111.87003 -109.20052 2.66951 1.80226 -109.94868 389.93184
900.0000 -111.78699 -109.37789 2.40910 1.84804 -109.36957 437.96004
905.0000 -111.64186 -109.53672 2.10513 1.83815 -109.49463 407.52163
910.0000 -112.23864 -109.97228 2.26636 1.82260 -109.69138 378.77592
915.0000 -111.88872 -109.58535 2.30337 1.82610 -109.64708 396.87426
920.0000 -112.19453 -110.32603 1.86851 1.82409 -109.67251 391.54283
925.0000 -112.45400 -109.93587 2.51813 1.78921 -110.11386 356.90847
930.0000 -111.67127 -109.58358 2.08769 1.81559 -109.78009 403.25257
935.0000 -111.73890 -109.84936 1.88954 1.83270 -109.56367 418.65552
940.0000 -111.73588 -108.96941 2.76647 1.85403 -109.29373 418.39759
945.0000 -111.50020 -109.20927 2.29093 1.84818 -109.36780 433.28923
950.0000 -111.89320 -109.62836 2.26485 1.82521 -109.65843 424.98531
955.0000 -111.86924 -109.28036 2.58887 1.82883 -109.61256 407.19041
960.0000 -111.95555 -109.44640 2.50915 1.85413 -109.29255 439.92741
965.0000 -112.13424 -109.79237 2.34187 1.84589 -109.39672 435.25124
970.0000 -112.01570 -109.51715 2.49854 1.82675 -109.63886 413.59634
975.0000 -111.87293 -109.84306 2.02988 1.83969 -109.47521 414.65532
980.0000 -111.89294 -109.71356 2.17938 1.79094 -110.09190 376.37692
985.0000 -112.07719 -109.74167 2.33552 1.80950 -109.85713 390.57182
990.0000 -112.09127 -109.81693 2.27434 1.83772 -109.50015 423.53424
995.0000 -111.66329 -109.29556 2.36773 1.85700 -109.25619 431.05778
1000.0000 -112.24986 -109.92301 2.32684 1.82044 -109.71872 396.19489
MELTING PROCESS: loop number 5 T-loop= 432.00000000000000
main_MD> interactions number 5 at Temperature= 432.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.57496 1.42921 1.18109
force_rgl> df(natom) 0.17081 -1.43044 3.21570
1005.0000 -111.84288 -109.50752 2.33536 1.80861 -109.86833 392.85467
1010.0000 -112.16128 -109.30052 2.86076 1.84135 -109.45422 429.91790
1015.0000 -112.15477 -109.40634 2.74843 1.84182 -109.44826 423.44056
1020.0000 -112.05088 -109.63621 2.41467 1.86175 -109.19603 442.08399
1025.0000 -112.41258 -110.16446 2.24812 1.81223 -109.82264 397.42576
1030.0000 -112.04549 -109.94867 2.09682 1.79791 -110.00374 380.44044
1035.0000 -112.04512 -109.48334 2.56179 1.81841 -109.74442 402.05443
1040.0000 -111.62457 -109.64197 1.98260 1.82592 -109.64933 415.40391
1045.0000 -111.75207 -109.57901 2.17306 1.82667 -109.63989 412.22530
1050.0000 -111.71305 -109.27665 2.43639 1.85285 -109.30871 448.17757
1055.0000 -111.31073 -108.18699 3.12374 1.90494 -108.64963 487.84476
1060.0000 -111.83802 -109.17123 2.66680 1.91341 -108.54256 495.45337
1065.0000 -111.87459 -108.97898 2.89561 1.87941 -108.97270 458.67876
1070.0000 -111.81659 -109.32809 2.48850 1.87752 -108.99655 457.85791
1075.0000 -112.16236 -109.53933 2.62303 1.83928 -109.48032 409.47452
1080.0000 -111.70151 -109.48121 2.22030 1.84138 -109.45379 416.47989
1085.0000 -111.83545 -109.42588 2.40957 1.84941 -109.35220 421.03659
1090.0000 -111.67551 -109.43031 2.24521 1.84805 -109.36935 427.61281
1095.0000 -111.72093 -108.80875 2.91218 1.88124 -108.94946 434.85190
1100.0000 -111.86699 -108.94582 2.92117 1.87999 -108.96535 414.77822
1105.0000 -111.34476 -109.23216 2.11260 1.89563 -108.76742 431.92742
1110.0000 -111.90405 -108.90835 2.99570 1.87200 -109.06647 412.60463
1115.0000 -111.96321 -109.11733 2.84588 1.88917 -108.84919 430.87600
1120.0000 -111.14312 -108.46804 2.67508 1.90170 -108.69064 431.65830
1125.0000 -111.17899 -108.41672 2.76227 1.92075 -108.44969 481.00295
1130.0000 -111.21430 -108.20115 3.01315 1.89953 -108.71807 440.71259
1135.0000 -111.53696 -108.76894 2.76802 1.89891 -108.72590 442.86528
1140.0000 -111.18488 -108.07223 3.11264 1.92792 -108.35899 446.47349
1145.0000 -110.80759 -107.37127 3.43632 1.97801 -107.72522 491.14064
1150.0000 -110.99754 -108.34905 2.64849 1.95663 -107.99575 517.67244
1155.0000 -111.83093 -109.34871 2.48222 1.89402 -108.78788 467.98953
1160.0000 -111.80949 -109.22331 2.58618 1.84076 -109.46170 420.52860
1165.0000 -111.60478 -109.44224 2.16255 1.83990 -109.47249 404.20882
1170.0000 -111.37842 -108.74619 2.63223 1.91559 -108.51495 460.24681
1175.0000 -111.79843 -108.73193 3.06650 1.90302 -108.67390 434.77061
1180.0000 -112.07170 -109.12061 2.95108 1.91483 -108.52451 469.38497
1185.0000 -111.02121 -108.59700 2.42421 1.90874 -108.60164 453.07490
1190.0000 -111.66869 -109.61700 2.05169 1.87892 -108.97890 424.83018
1195.0000 -112.20782 -109.96732 2.24049 1.81212 -109.82401 368.73362
1200.0000 -110.93090 -108.43932 2.49158 1.85552 -109.27487 409.47966
1205.0000 -111.63517 -109.15729 2.47788 1.88639 -108.88431 435.17260
1210.0000 -111.70931 -109.16404 2.54527 1.87529 -109.02483 434.44288
1215.0000 -111.73349 -108.84498 2.88851 1.86154 -109.19875 418.24821
1220.0000 -111.57125 -108.47494 3.09631 1.89480 -108.77798 439.24453
1225.0000 -112.08027 -109.73745 2.34282 1.87434 -109.03678 431.30912
1230.0000 -111.88841 -109.21435 2.67406 1.85323 -109.30383 410.86960
1235.0000 -111.75573 -108.94055 2.81518 1.85678 -109.25891 413.00983
1240.0000 -110.81965 -108.05688 2.76277 1.91239 -108.55545 440.57906
1245.0000 -111.24592 -108.89189 2.35404 1.90651 -108.62975 424.71087
1250.0000 -110.90290 -108.33163 2.57127 1.89538 -108.77067 422.40093
MELTING PROCESS: loop number 6 T-loop= 457.00000000000000
main_MD> interactions number 6 at Temperature= 457.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.40020 3.95658 -0.88118
force_rgl> df(natom) 0.83103 -1.40660 -1.63185
1255.0000 -110.31439 -107.43732 2.87707 1.95479 -108.01895 486.71274
1260.0000 -111.09481 -108.26315 2.83166 1.95583 -108.00588 491.60973
1265.0000 -110.95409 -107.97906 2.97504 1.94517 -108.14076 469.86015
1270.0000 -111.02786 -107.91894 3.10892 1.96144 -107.93482 475.44088
1275.0000 -110.05528 -108.11641 1.93888 1.94202 -108.18059 461.09654
1280.0000 -110.67977 -107.67588 3.00388 1.95589 -108.00514 452.13543
1285.0000 -110.49683 -107.33955 3.15728 1.98431 -107.64555 497.45051
1290.0000 -110.76042 -107.87413 2.88628 1.98962 -107.57834 532.79396
1295.0000 -111.01714 -108.65673 2.36041 1.90696 -108.62412 450.38171
1300.0000 -111.36072 -108.32309 3.03763 1.96135 -107.93605 510.09619
1305.0000 -110.93359 -107.92570 3.00789 1.95675 -107.99421 499.99479
1310.0000 -110.14627 -107.75457 2.39170 1.95141 -108.06179 458.87673
1315.0000 -110.50361 -107.83784 2.66577 1.96036 -107.94849 475.74474
1320.0000 -110.71706 -108.25634 2.46072 1.96338 -107.91026 484.94275
1325.0000 -110.66949 -107.75293 2.91656 1.97409 -107.77480 484.95050
1330.0000 -110.97365 -108.49122 2.48243 1.95318 -108.03941 494.30614
1335.0000 -111.26693 -109.03336 2.23357 1.88391 -108.91569 415.19785
1340.0000 -111.51648 -108.90621 2.61027 1.89116 -108.82397 425.09750
1345.0000 -111.28503 -108.97224 2.31279 1.88790 -108.86530 426.77645
1350.0000 -110.69514 -108.72935 1.96578 1.89893 -108.72570 454.45607
1355.0000 -111.49779 -109.25768 2.24010 1.87908 -108.97684 422.48530
1360.0000 -111.17837 -109.16108 2.01729 1.86002 -109.21801 400.99016
1365.0000 -111.48500 -108.96757 2.51743 1.87512 -109.02700 438.06783
1370.0000 -111.33142 -108.45399 2.87742 1.90431 -108.65767 474.87623
1375.0000 -111.46312 -109.20642 2.25670 1.89001 -108.83862 456.55215
1380.0000 -111.33683 -108.58677 2.75006 1.86955 -109.09743 428.47510
1385.0000 -111.95316 -109.04558 2.90758 1.88228 -108.93635 465.80068
1390.0000 -111.28383 -108.25923 3.02460 1.90308 -108.67326 478.85470
1395.0000 -110.98887 -108.12056 2.86830 1.94210 -108.17952 496.80652
1400.0000 -111.36883 -108.64619 2.72264 1.89189 -108.81481 450.32813
1405.0000 -111.75648 -109.36670 2.38978 1.90770 -108.61473 457.24946
1410.0000 -111.69469 -109.07212 2.62257 1.89326 -108.79744 441.27522
1415.0000 -111.31341 -108.55279 2.76062 1.91588 -108.51125 458.19880
1420.0000 -111.11805 -108.10627 3.01178 1.91378 -108.53786 469.10768
1425.0000 -111.92204 -109.08319 2.83885 1.89569 -108.76676 452.35359
1430.0000 -111.12204 -108.27912 2.84292 1.90888 -108.59979 465.65847
1435.0000 -111.74234 -108.69434 3.04800 1.92858 -108.35056 474.80869
1440.0000 -111.67841 -108.88085 2.79756 1.93372 -108.28557 468.25880
1445.0000 -110.65989 -107.69113 2.96875 1.94004 -108.20561 508.43990
1450.0000 -110.63184 -107.45610 3.17574 1.97413 -107.77429 520.93229
1455.0000 -110.93243 -108.34276 2.58967 1.94048 -108.20005 463.70365
1460.0000 -110.50785 -107.29528 3.21256 1.94437 -108.15077 458.73953
1465.0000 -111.15066 -108.29410 2.85656 1.98722 -107.60872 533.29733
1470.0000 -110.31314 -107.59249 2.72065 1.93177 -108.31019 487.46758
1475.0000 -110.33725 -107.56586 2.77138 1.96707 -107.86364 502.55262
1480.0000 -110.84284 -107.77475 3.06808 1.97742 -107.73268 540.76044
1485.0000 -111.64043 -109.33550 2.30492 1.90241 -108.68171 465.67461
1490.0000 -111.36049 -109.45372 1.90677 1.87037 -109.08702 421.51842
1495.0000 -111.27988 -108.62753 2.65235 1.84816 -109.36797 419.07856
1500.0000 -110.96765 -108.78505 2.18260 1.91959 -108.46436 455.98633
MELTING PROCESS: loop number 7 T-loop= 482.00000000000000
main_MD> interactions number 7 at Temperature= 482.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.83436 0.80603 0.04399
force_rgl> df(natom) -0.11312 -0.13256 -0.74010
1505.0000 -110.49097 -107.49470 2.99627 1.95180 -108.05687 483.88001
1510.0000 -110.40427 -107.86331 2.54097 1.96940 -107.83412 485.38265
1515.0000 -111.09051 -108.11193 2.97859 1.91673 -108.50056 433.40868
1520.0000 -111.00012 -108.52121 2.47890 1.95141 -108.06171 489.94322
1525.0000 -110.91024 -108.24410 2.66614 1.91513 -108.52077 442.27378
1530.0000 -110.07227 -107.03990 3.03237 1.97446 -107.77018 510.94192
1535.0000 -110.63763 -107.62028 3.01735 1.97178 -107.80403 499.49968
1540.0000 -110.06052 -106.89817 3.16235 2.02886 -107.08190 553.66136
1545.0000 -110.46115 -107.45460 3.00655 2.01185 -107.29711 536.19743
1550.0000 -111.15749 -107.96258 3.19492 1.96782 -107.85416 482.43940
1555.0000 -111.27497 -108.18862 3.08635 1.96331 -107.91121 492.05485
1560.0000 -111.09676 -108.63309 2.46367 1.88815 -108.86214 441.01342
1565.0000 -111.25917 -108.70488 2.55428 1.92560 -108.38831 471.84661
1570.0000 -111.06029 -108.26106 2.79923 1.92509 -108.39477 468.72438
1575.0000 -111.57337 -108.79760 2.77577 1.91545 -108.51665 474.36253
1580.0000 -111.00016 -108.36783 2.63232 1.88998 -108.83897 445.73678
1585.0000 -111.18716 -108.28575 2.90142 1.94303 -108.16780 483.59416
1590.0000 -110.47841 -108.14507 2.33333 1.95283 -108.04383 499.88185
1595.0000 -111.15416 -108.49837 2.65578 1.92640 -108.37822 472.88870
1600.0000 -111.34303 -108.17448 3.16856 1.96088 -107.94190 517.24073
1605.0000 -110.72454 -108.03732 2.68722 1.95110 -108.06570 492.96910
1610.0000 -111.29254 -108.37113 2.92141 1.91646 -108.50393 470.53739
1615.0000 -110.67878 -108.09620 2.58259 1.91906 -108.47101 469.76436
1620.0000 -110.54369 -107.25943 3.28425 1.96434 -107.89814 506.64483
1625.0000 -110.13919 -107.18983 2.94936 2.01252 -107.28865 569.59491
1630.0000 -111.20737 -108.00889 3.19848 2.01571 -107.24826 544.86640
1635.0000 -111.07113 -108.51692 2.55421 1.93229 -108.30370 481.76395
1640.0000 -110.98694 -107.98834 2.99860 1.94870 -108.09610 493.14801
1645.0000 -111.47072 -108.28055 3.19017 1.94268 -108.17224 498.28593
1650.0000 -110.76105 -107.67795 3.08310 1.96777 -107.85479 512.03903
1655.0000 -110.90702 -108.88245 2.02457 1.92688 -108.37207 438.60666
1660.0000 -111.37028 -108.27568 3.09460 1.90204 -108.68638 433.72973
1665.0000 -110.20906 -107.30000 2.90905 1.97972 -107.70362 514.80798
1670.0000 -111.10372 -108.44152 2.66220 1.95319 -108.03929 483.41928
1675.0000 -111.61847 -108.75262 2.86585 1.91486 -108.52423 450.68025
1680.0000 -110.71562 -108.19885 2.51677 1.93671 -108.24771 472.05818
1685.0000 -110.87835 -108.78052 2.09782 1.94817 -108.10279 470.50799
1690.0000 -111.03541 -107.74484 3.29057 1.97294 -107.78940 503.33027
1695.0000 -111.29846 -108.26204 3.03642 1.94346 -108.16228 483.19703
1700.0000 -110.28328 -106.84970 3.43358 1.99855 -107.46534 538.38617
1705.0000 -110.78656 -108.17035 2.61622 1.98570 -107.62788 530.98210
1710.0000 -110.35847 -107.92395 2.43452 1.94581 -108.13255 469.43168
1715.0000 -110.00345 -107.14560 2.85785 1.99404 -107.52248 492.54207
1720.0000 -110.70682 -107.53014 3.17668 2.01306 -107.28184 545.31373
1725.0000 -110.43825 -107.57133 2.86692 1.97777 -107.72829 505.11992
1730.0000 -111.17036 -108.56771 2.60265 1.94934 -108.08799 486.94858
1735.0000 -110.47967 -107.89887 2.58080 1.94765 -108.10929 476.29823
1740.0000 -111.31946 -108.61774 2.70172 1.93024 -108.32958 475.04251
1745.0000 -111.78524 -108.76902 3.01621 1.91441 -108.52982 459.66469
1750.0000 -111.27848 -108.27333 3.00514 1.89732 -108.74604 438.70385
MELTING PROCESS: loop number 8 T-loop= 507.00000000000000
main_MD> interactions number 8 at Temperature= 507.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.00234 -2.23517 -1.38455
force_rgl> df(natom) 0.78844 1.66208 0.00870
1755.0000 -110.98915 -107.85930 3.12986 1.96317 -107.91295 504.32828
1760.0000 -110.88308 -108.80146 2.08161 1.92399 -108.40861 460.68160
1765.0000 -111.34905 -108.99812 2.35092 1.88616 -108.88729 444.45675
1770.0000 -111.79956 -109.07650 2.72306 1.88814 -108.86222 439.52104
1775.0000 -111.37209 -108.83909 2.53300 1.86314 -109.17847 405.49955
1780.0000 -111.48556 -108.78870 2.69686 1.89460 -108.78043 457.14978
1785.0000 -111.31377 -108.02273 3.29104 1.88669 -108.88060 439.88341
1790.0000 -110.10137 -107.32810 2.77327 1.98848 -107.59278 539.07501
1795.0000 -110.32318 -107.60459 2.71859 1.97597 -107.75103 531.99792
1800.0000 -110.63649 -107.59655 3.03994 1.97655 -107.74369 524.85534
1805.0000 -111.17158 -108.16551 3.00607 1.96575 -107.88031 519.78514
1810.0000 -110.56317 -106.94609 3.61708 1.98097 -107.68784 564.24376
1815.0000 -110.11992 -107.01525 3.10467 2.02356 -107.14901 570.74308
1820.0000 -110.75294 -108.14479 2.60815 2.00473 -107.38718 528.03676
1825.0000 -110.53443 -108.30201 2.23241 1.96036 -107.94855 477.75544
1830.0000 -111.00721 -108.44812 2.55909 1.93050 -108.32633 475.10830
1835.0000 -111.26073 -108.43450 2.82622 1.89641 -108.75763 426.08181
1840.0000 -110.53549 -107.77894 2.75655 1.95928 -107.96222 491.49365
1845.0000 -110.78808 -107.98310 2.80498 1.97629 -107.74693 517.06926
1850.0000 -110.90933 -108.43742 2.47191 1.96037 -107.94839 513.23065
1855.0000 -110.91027 -107.93987 2.97041 1.93252 -108.30075 470.73355
1860.0000 -111.06767 -107.99610 3.07157 1.96096 -107.94092 503.12167
1865.0000 -111.30631 -108.53885 2.76746 1.91938 -108.46697 455.39823
1870.0000 -111.33923 -108.18800 3.15123 1.94298 -108.16843 472.37222
1875.0000 -110.58867 -107.94353 2.64514 1.93221 -108.30467 450.92841
1880.0000 -110.77334 -108.53210 2.24124 1.91818 -108.48211 449.45544
1885.0000 -110.94635 -107.86741 3.07894 1.93548 -108.26329 473.49841
1890.0000 -111.37129 -107.61261 3.75868 1.96359 -107.90767 496.50374
1895.0000 -110.67099 -107.63218 3.03881 2.00206 -107.42102 544.48507
1900.0000 -110.80345 -108.38264 2.42081 1.92508 -108.39490 469.40506
1905.0000 -111.83668 -108.78483 3.05185 1.90649 -108.63000 464.47418
1910.0000 -111.34189 -108.51670 2.82519 1.90812 -108.60944 450.61603
1915.0000 -110.51376 -107.39756 3.11620 1.96277 -107.91808 513.73750
1920.0000 -110.63039 -107.20078 3.42961 2.01459 -107.26243 544.81876
1925.0000 -110.61260 -107.42688 3.18572 2.01673 -107.23530 529.91250
1930.0000 -109.51621 -107.18613 2.33008 2.00056 -107.43995 528.80234
1935.0000 -110.73840 -107.57337 3.16503 1.98011 -107.69867 497.49610
1940.0000 -110.08108 -106.93354 3.14753 1.99324 -107.53254 528.11561
1945.0000 -110.38613 -106.97756 3.40856 2.03182 -107.04443 558.04552
1950.0000 -110.11590 -107.36999 2.74591 2.04010 -106.93964 525.43516
1955.0000 -109.83221 -106.28334 3.54886 2.06348 -106.64392 573.76315
1960.0000 -109.51427 -106.57249 2.94178 2.06658 -106.60473 582.50420
1965.0000 -110.93311 -108.30727 2.62583 1.98592 -107.62521 521.39491
1970.0000 -110.21361 -107.01506 3.19855 2.02508 -107.12968 534.76085
1975.0000 -111.00431 -108.31697 2.68734 2.01007 -107.31967 500.77603
1980.0000 -109.91010 -106.91949 2.99061 1.96286 -107.91687 482.45092
1985.0000 -110.72859 -107.96187 2.76672 2.02061 -107.18629 520.77643
1990.0000 -110.23533 -107.24396 2.99136 1.99339 -107.53059 493.11223
1995.0000 -111.18162 -108.29736 2.88426 1.96368 -107.90654 500.20648
2000.0000 -110.85690 -108.20530 2.65159 1.93642 -108.25141 484.96758
MELTING PROCESS: loop number 9 T-loop= 532.00000000000000
main_MD> interactions number 9 at Temperature= 532.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.44176 0.99900 1.91080
force_rgl> df(natom) -1.30303 1.92015 1.16724
2005.0000 -110.47609 -107.32710 3.14899 1.97426 -107.77265 498.57678
2010.0000 -110.36270 -107.38513 2.97757 2.01308 -107.28152 542.44264
2015.0000 -110.26516 -107.42373 2.84143 2.02396 -107.14394 566.86290
2020.0000 -110.70071 -107.32200 3.37871 1.99509 -107.50908 546.58338
2025.0000 -110.76400 -107.60707 3.15693 1.98965 -107.57802 526.88900
2030.0000 -110.96935 -107.98370 2.98565 1.98080 -107.68989 526.20131
2035.0000 -111.00251 -108.33311 2.66941 1.94561 -108.13507 470.98780
2040.0000 -111.09832 -107.82538 3.27294 1.96005 -107.95242 497.13381
2045.0000 -110.70472 -107.49617 3.20855 1.97471 -107.76695 524.94423
2050.0000 -110.61248 -107.18768 3.42479 2.00527 -107.38029 533.20485
2055.0000 -110.38582 -106.94814 3.43767 2.01217 -107.29302 556.34068
2060.0000 -110.55378 -107.62758 2.92620 2.02829 -107.08912 564.77459
2065.0000 -110.18498 -107.64168 2.54330 1.98936 -107.58164 520.89484
2070.0000 -110.48814 -108.24848 2.23967 1.95396 -108.02952 464.99893
2075.0000 -110.80332 -107.81773 2.98559 1.99119 -107.55852 528.63062
2080.0000 -111.03978 -107.86183 3.17795 2.00654 -107.36424 540.50206
2085.0000 -110.24020 -107.35923 2.88097 1.99021 -107.57083 535.07071
2090.0000 -110.58521 -106.84303 3.74219 2.04567 -106.86918 569.36084
2095.0000 -110.15434 -108.08835 2.06599 1.98015 -107.69817 521.81365
2100.0000 -110.24716 -107.13084 3.11632 1.96985 -107.82844 510.80956
2105.0000 -109.70444 -105.86420 3.84024 2.10364 -106.13585 624.84877
2110.0000 -111.15657 -107.47578 3.68079 2.06023 -106.68497 604.35029
2115.0000 -110.70733 -107.24284 3.46449 2.05812 -106.71173 593.22091
2120.0000 -110.85384 -107.00498 3.84886 2.01286 -107.28431 591.75180
2125.0000 -111.27690 -107.62437 3.65254 2.02367 -107.14761 596.41413
2130.0000 -110.58471 -107.41896 3.16574 1.99505 -107.50971 523.32722
2135.0000 -110.19634 -107.28077 2.91556 1.98379 -107.65204 542.01731
2140.0000 -110.43717 -107.61397 2.82320 2.00168 -107.42576 544.29302
2145.0000 -111.16968 -107.92644 3.24324 1.96253 -107.92111 519.70230
2150.0000 -110.51233 -107.95568 2.55665 1.94492 -108.14391 487.45141
2155.0000 -110.54355 -108.06442 2.47913 1.95424 -108.02595 486.60237
2160.0000 -111.55391 -108.72130 2.83262 1.91867 -108.47594 457.51609
2165.0000 -110.68133 -108.21860 2.46274 1.93416 -108.28005 481.94253
2170.0000 -110.98158 -107.80248 3.17909 1.97131 -107.80997 519.50585
2175.0000 -111.08344 -107.26103 3.82241 2.00926 -107.32981 567.66660
2180.0000 -111.40405 -108.18408 3.21997 1.99719 -107.48254 552.23397
2185.0000 -111.69661 -108.98732 2.70929 1.92477 -108.39873 503.96375
2190.0000 -111.22549 -108.41831 2.80718 1.89582 -108.76505 461.46922
2195.0000 -111.08382 -107.81383 3.26999 1.96171 -107.93149 516.36539
2200.0000 -109.48297 -106.52385 2.95912 2.02845 -107.08707 554.63699
2205.0000 -110.58414 -107.46714 3.11700 2.01698 -107.23220 534.35610
2210.0000 -111.04950 -108.26298 2.78653 1.97366 -107.78028 504.58486
2215.0000 -110.42008 -107.70718 2.71289 1.95213 -108.05260 483.62146
2220.0000 -110.29275 -107.03701 3.25574 2.01644 -107.23900 541.91587
2225.0000 -110.47289 -107.11295 3.35994 2.02968 -107.07153 548.18777
2230.0000 -110.12463 -107.71490 2.40972 2.01680 -107.23452 536.38603
2235.0000 -110.99559 -108.15288 2.84271 1.94694 -108.11832 477.42432
2240.0000 -110.81875 -107.85223 2.96652 1.98493 -107.63764 522.22442
2245.0000 -111.07665 -107.66291 3.41374 1.97941 -107.70757 521.85134
2250.0000 -110.61345 -107.98804 2.62540 1.93134 -108.31566 475.87096
MELTING PROCESS: loop number 10 T-loop= 557.00000000000000
main_MD> interactions number 10 at Temperature= 557.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 3.70858 0.57949 1.11799
force_rgl> df(natom) 0.40198 -1.45567 0.50571
2255.0000 -110.09170 -106.81949 3.27221 1.99490 -107.51150 522.63945
2260.0000 -110.37440 -106.96595 3.40844 2.03893 -106.95455 562.40658
2265.0000 -110.32774 -107.03120 3.29654 2.03856 -106.95917 541.14316
2270.0000 -110.33295 -107.25631 3.07665 2.03141 -107.04967 555.26664
2275.0000 -109.86472 -106.23876 3.62597 2.07678 -106.47566 593.16800
2280.0000 -110.48091 -107.52209 2.95883 2.04071 -106.93199 562.22365
2285.0000 -110.09149 -107.24386 2.84763 2.03206 -107.04139 565.43052
2290.0000 -109.84109 -106.23571 3.60538 2.04516 -106.87562 576.55292
2295.0000 -109.90176 -106.94213 2.95962 2.03034 -107.06320 575.79593
2300.0000 -111.09536 -107.39364 3.70172 2.03999 -106.94114 564.73061
2305.0000 -109.92745 -106.82543 3.10202 1.96951 -107.83281 516.03404
2310.0000 -110.18434 -107.36925 2.81509 2.02893 -107.08100 566.62101
2315.0000 -110.47238 -106.78047 3.69191 2.04474 -106.88100 555.10963
2320.0000 -110.47372 -107.41809 3.05563 2.02964 -107.07208 547.46906
2325.0000 -110.12760 -107.49873 2.62887 2.02601 -107.11792 545.68851
2330.0000 -110.36694 -107.05112 3.31582 2.01093 -107.30880 535.72036
2335.0000 -110.36216 -106.97756 3.38461 2.03722 -106.97610 563.52747
2340.0000 -110.94516 -107.87435 3.07082 1.98308 -107.66114 527.82655
2345.0000 -110.50275 -106.76345 3.73929 1.99176 -107.55129 522.15119
2350.0000 -110.98618 -108.24619 2.73999 1.99972 -107.45056 511.22944
2355.0000 -110.46774 -107.06275 3.40500 1.98939 -107.58122 505.17292
2360.0000 -109.68934 -106.01956 3.66978 2.04485 -106.87963 557.72432
2365.0000 -110.31782 -106.03991 4.27791 2.08231 -106.40564 613.27216
2370.0000 -109.85238 -106.48787 3.36451 2.10184 -106.15860 642.15760
2375.0000 -111.16611 -107.90097 3.26514 2.05621 -106.73586 583.51129
2380.0000 -110.22644 -107.21780 3.00864 1.99055 -107.56654 521.34352
2385.0000 -110.74707 -107.68883 3.05825 1.98817 -107.59666 513.43329
2390.0000 -109.79016 -107.68744 2.10271 2.00754 -107.35164 524.05906
2395.0000 -109.96491 -107.07519 2.88972 2.01528 -107.25369 532.50570
2400.0000 -110.03315 -106.95708 3.07607 2.04108 -106.92726 575.89194
2405.0000 -109.93482 -106.55955 3.37527 2.04597 -106.86548 592.13487
2410.0000 -110.66475 -107.00679 3.65796 1.99214 -107.54644 535.00134
2415.0000 -109.73174 -106.85343 2.87831 2.02050 -107.18761 560.56605
2420.0000 -111.14573 -107.54694 3.59879 2.02726 -107.10220 568.41205
2425.0000 -109.93715 -106.88640 3.05075 1.99907 -107.45884 532.81184
2430.0000 -110.01764 -106.88905 3.12859 2.05662 -106.73070 565.17949
2435.0000 -110.20175 -107.97135 2.23040 2.02698 -107.10563 513.54801
2440.0000 -110.84890 -108.32272 2.52618 1.95941 -107.96056 486.69252
2445.0000 -110.54431 -107.52319 3.02113 1.98885 -107.58810 513.51812
2450.0000 -111.17250 -107.61856 3.55395 1.99675 -107.48814 542.84297
2455.0000 -110.37557 -107.45292 2.92264 1.96852 -107.84527 508.11358
2460.0000 -110.94688 -107.79992 3.14696 1.99801 -107.47215 534.80084
2465.0000 -111.00375 -107.72753 3.27622 1.96217 -107.92560 515.89314
2470.0000 -110.09633 -107.54343 2.55290 1.98156 -107.68025 519.98321
2475.0000 -110.97972 -107.63723 3.34250 1.94931 -108.08836 475.55559
2480.0000 -110.39531 -106.51979 3.87552 2.01359 -107.27512 539.70736
2485.0000 -110.00185 -106.86791 3.13394 2.06209 -106.66148 560.93912
2490.0000 -110.75091 -108.22807 2.52285 1.99591 -107.49880 522.24501
2495.0000 -110.16942 -106.95284 3.21658 2.00299 -107.40917 529.23015
2500.0000 -109.54910 -105.98446 3.56464 2.09142 -106.29037 607.16754
MELTING PROCESS: loop number 11 T-loop= 582.00000000000000
main_MD> interactions number 11 at Temperature= 582.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.04344 -0.33961 -0.69799
force_rgl> df(natom) 0.37816 0.33707 2.23626
2505.0000 -109.31044 -106.11292 3.19752 2.11793 -105.95498 620.75225
2510.0000 -109.87241 -106.96834 2.90408 2.10724 -106.09024 596.03462
2515.0000 -109.24864 -106.57894 2.66971 2.03386 -107.01863 550.12733
2520.0000 -110.15052 -106.77715 3.37337 2.04958 -106.81974 534.22252
2525.0000 -109.98289 -106.91024 3.07265 2.03544 -106.99862 552.88537
2530.0000 -110.60576 -107.81424 2.79153 2.00228 -107.41823 529.82475
2535.0000 -110.29857 -106.96367 3.33490 2.00090 -107.43562 515.80887
2540.0000 -109.21921 -105.53739 3.68182 2.09026 -106.30514 600.62052
2545.0000 -109.69962 -106.01428 3.68533 2.14613 -105.59827 646.46407
2550.0000 -109.93608 -106.53632 3.39975 2.09039 -106.30344 606.36932
2555.0000 -110.21673 -107.27449 2.94224 2.02557 -107.12350 569.06140
2560.0000 -109.56675 -106.33850 3.22825 2.07859 -106.45275 607.38146
2565.0000 -110.23437 -105.77580 4.45857 2.10034 -106.17762 628.70013
2570.0000 -109.47551 -105.76300 3.71251 2.11875 -105.94470 629.05308
2575.0000 -108.97983 -105.39198 3.58785 2.12925 -105.81185 601.87827
2580.0000 -109.98356 -105.36555 4.61802 2.16608 -105.34590 644.57301
2585.0000 -108.74569 -105.81079 2.93490 2.13820 -105.69859 627.65758
2590.0000 -108.65198 -105.28577 3.36621 2.14911 -105.56050 625.23075
2595.0000 -109.24558 -105.71963 3.52595 2.15646 -105.46757 638.96324
2600.0000 -109.78087 -105.57295 4.20792 2.14104 -105.66261 609.55622
2605.0000 -108.99322 -105.14804 3.84518 2.15109 -105.53545 635.98671
2610.0000 -109.45669 -105.98380 3.47289 2.13452 -105.74509 626.09734
2615.0000 -109.72867 -106.63865 3.09001 2.09693 -106.22068 592.92160
2620.0000 -109.94248 -106.79276 3.14971 2.04761 -106.84469 560.67559
2625.0000 -109.73439 -107.18079 2.55360 2.03776 -106.96934 547.42549
2630.0000 -110.46055 -106.81140 3.64915 2.00033 -107.44289 516.40648
2635.0000 -109.81740 -106.39008 3.42732 2.08201 -106.40948 584.18929
2640.0000 -109.89096 -106.88221 3.00875 2.03603 -106.99120 549.46617
2645.0000 -109.89607 -106.75611 3.13996 2.04279 -106.90566 560.34178
2650.0000 -109.85519 -106.63994 3.21525 2.09464 -106.24969 587.36281
2655.0000 -110.04477 -106.57080 3.47397 2.08348 -106.39083 596.19064
2660.0000 -110.15007 -106.98193 3.16814 2.03600 -106.99154 563.63929
2665.0000 -109.96024 -106.00236 3.95789 2.03144 -107.04925 541.84265
2670.0000 -109.02527 -104.40547 4.61980 2.18093 -105.15794 687.12078
2675.0000 -109.51146 -105.85320 3.65826 2.13628 -105.72290 626.70212
2680.0000 -109.50758 -105.84685 3.66074 2.11463 -105.99674 596.15694
2685.0000 -110.09864 -107.26628 2.83236 2.07323 -106.52055 568.35231
2690.0000 -110.51990 -107.15818 3.36172 2.04201 -106.91554 566.04642
2695.0000 -110.99023 -107.71745 3.27278 1.98480 -107.63933 514.52969
2700.0000 -109.76665 -106.70697 3.05968 1.98463 -107.64142 519.56486
2705.0000 -109.20735 -105.92304 3.28431 2.07267 -106.52770 605.94754
2710.0000 -109.84338 -106.77801 3.06537 2.12678 -105.84301 633.01718
2715.0000 -109.31349 -105.34512 3.96837 2.09275 -106.27354 593.28792
2720.0000 -109.32123 -106.37423 2.94700 2.09780 -106.20969 605.65704
2725.0000 -109.19000 -106.03729 3.15271 2.07760 -106.46531 586.03263
2730.0000 -109.38554 -105.98956 3.39598 2.08024 -106.43184 607.39124
2735.0000 -109.76550 -106.87974 2.88576 2.10717 -106.09117 603.55564
2740.0000 -110.16183 -106.49578 3.66605 2.08130 -106.41842 571.85915
2745.0000 -109.89759 -105.94538 3.95221 2.08211 -106.40816 568.53050
2750.0000 -109.92537 -106.99885 2.92652 2.08640 -106.35388 595.50395
MELTING PROCESS: loop number 12 T-loop= 607.00000000000000
main_MD> interactions number 12 at Temperature= 607.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.45025 0.76289 0.04247
force_rgl> df(natom) -4.33164 -0.16639 2.08116
2755.0000 -110.75358 -107.78962 2.96396 1.98494 -107.63759 526.76998
2760.0000 -109.82078 -106.24702 3.57376 2.04336 -106.89840 568.51479
2765.0000 -110.43031 -107.06262 3.36769 2.06835 -106.58233 616.08622
2770.0000 -110.29668 -107.26986 3.02682 2.01608 -107.24363 550.59497
2775.0000 -109.92430 -106.48340 3.44090 2.02386 -107.14515 554.55812
2780.0000 -109.79492 -105.57595 4.21896 2.08807 -106.33278 603.49844
2785.0000 -109.59123 -105.61580 3.97543 2.13882 -105.69080 618.84200
2790.0000 -109.45061 -105.46540 3.98521 2.20156 -104.89697 687.35555
2795.0000 -110.60265 -107.53687 3.06578 2.07423 -106.50787 598.40149
2800.0000 -110.26527 -106.89661 3.36866 2.04230 -106.91181 570.24486
2805.0000 -109.35346 -106.54085 2.81261 2.06268 -106.65404 586.08262
2810.0000 -109.63602 -105.94909 3.68693 2.10255 -106.14967 591.60657
2815.0000 -108.95931 -104.96006 3.99925 2.17155 -105.27663 650.02326
2820.0000 -109.51717 -105.85589 3.66128 2.16374 -105.37546 651.40012
2825.0000 -109.43641 -105.23464 4.20177 2.14018 -105.67357 613.71442
2830.0000 -110.23769 -105.87376 4.36393 2.15301 -105.51123 661.42615
2835.0000 -109.29249 -105.91695 3.37554 2.11997 -105.92926 644.63165
2840.0000 -109.63304 -106.53643 3.09661 2.10988 -106.05686 626.48425
2845.0000 -109.74449 -106.33482 3.40967 2.08823 -106.33083 598.38615
2850.0000 -110.61391 -106.54802 4.06589 2.09460 -106.25018 597.82130
2855.0000 -109.49563 -105.85058 3.64505 2.09512 -106.24358 646.55357
2860.0000 -109.33260 -105.27008 4.06252 2.11552 -105.98556 638.40982
2865.0000 -110.06062 -106.87844 3.18217 2.09704 -106.21936 569.83883
2870.0000 -109.76078 -106.28933 3.47145 2.04951 -106.82071 575.86795
2875.0000 -109.81112 -106.52033 3.29079 2.10390 -106.13254 603.68342
2880.0000 -110.95470 -107.53126 3.42344 2.03184 -107.04421 577.07947
2885.0000 -110.62573 -106.84301 3.78272 2.05690 -106.72718 606.47423
2890.0000 -109.39314 -105.74047 3.65267 2.07348 -106.51733 592.26153
2895.0000 -109.68613 -106.21182 3.47431 2.11022 -106.05255 609.90093
2900.0000 -110.39063 -106.67442 3.71620 2.04543 -106.87228 585.81610
2905.0000 -109.10460 -105.75286 3.35174 2.09129 -106.29205 602.83330
2910.0000 -110.65462 -107.01129 3.64333 2.06628 -106.60850 607.61887
2915.0000 -109.61654 -106.66409 2.95245 2.03925 -106.95050 560.80320
2920.0000 -109.78448 -106.32284 3.46165 2.07078 -106.55159 577.91603
2925.0000 -108.94783 -105.60008 3.34775 2.14914 -105.56015 638.56870
2930.0000 -109.88646 -106.23022 3.65624 2.12952 -105.80843 633.02538
2935.0000 -110.36403 -106.92234 3.44169 2.09228 -106.27957 605.99013
2940.0000 -109.26949 -105.19840 4.07109 2.13506 -105.73828 635.77776
2945.0000 -109.22441 -105.44765 3.77676 2.15020 -105.54675 665.64703
2950.0000 -109.42325 -105.72868 3.69457 2.17448 -105.23959 670.08048
2955.0000 -110.71002 -106.84721 3.86281 2.08811 -106.33225 572.74775
2960.0000 -108.98497 -105.45474 3.53024 2.09236 -106.27858 605.14303
2965.0000 -109.57268 -105.86173 3.71095 2.14016 -105.67385 637.20239
2970.0000 -109.37752 -105.42019 3.95733 2.12566 -105.85717 635.30208
2975.0000 -108.87852 -105.24632 3.63220 2.16424 -105.36910 648.58142
2980.0000 -108.87859 -104.20096 4.67764 2.21314 -104.75054 732.28772
2985.0000 -109.56548 -105.57683 3.98864 2.22244 -104.63287 711.51575
2990.0000 -110.99749 -107.83312 3.16438 2.07341 -106.51826 582.02307
2995.0000 -109.58541 -106.39605 3.18936 2.05418 -106.76160 563.65930
3000.0000 -110.29191 -106.81323 3.47868 2.05276 -106.77947 565.99440
MELTING PROCESS: loop number 13 T-loop= 632.00000000000000
main_MD> interactions number 13 at Temperature= 632.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.18308 -0.90427 0.26523
force_rgl> df(natom) -0.30790 -6.79531 -0.88178
3005.0000 -109.52393 -106.09555 3.42838 2.08750 -106.33996 599.50956
3010.0000 -109.20300 -106.10315 3.09984 2.08593 -106.35987 580.36388
3015.0000 -108.63396 -105.50538 3.12859 2.19797 -104.94239 650.23527
3020.0000 -107.87366 -104.39481 3.47886 2.15183 -105.52617 627.00431
3025.0000 -108.89866 -104.85562 4.04304 2.23945 -104.41765 715.22872
3030.0000 -107.93247 -105.19971 2.73276 2.15533 -105.48181 617.45760
3035.0000 -109.05541 -104.90020 4.15521 2.23499 -104.47403 727.84304
3040.0000 -110.06105 -106.22272 3.83833 2.14335 -105.63345 659.85335
3045.0000 -110.01102 -106.81470 3.19632 2.05702 -106.72567 575.22826
3050.0000 -110.17639 -106.73863 3.43776 2.06937 -106.56939 601.74679
3055.0000 -110.09055 -106.17106 3.91948 2.10270 -106.14770 602.66690
3060.0000 -108.89441 -105.32048 3.57393 2.12472 -105.86908 595.01137
3065.0000 -109.48584 -104.68029 4.80555 2.16408 -105.37116 646.82316
3070.0000 -109.69842 -105.49091 4.20751 2.19006 -105.04249 676.39227
3075.0000 -108.54490 -105.29095 3.25396 2.19658 -104.96001 656.83963
3080.0000 -110.07902 -106.31061 3.76841 2.11913 -105.93991 582.63712
3085.0000 -109.22894 -106.46384 2.76510 2.06132 -106.67126 576.68164
3090.0000 -109.17330 -106.40380 2.76950 2.07045 -106.55567 562.05258
3095.0000 -108.45311 -105.17215 3.28096 2.12305 -105.89027 605.27774
3100.0000 -108.86374 -105.58024 3.28350 2.18236 -105.13990 680.93244
3105.0000 -109.34635 -105.77899 3.56736 2.12592 -105.85399 631.58162
3110.0000 -109.43194 -105.09533 4.33660 2.17863 -105.18703 690.17805
3115.0000 -109.40314 -105.64057 3.76257 2.15197 -105.52441 631.65722
3120.0000 -110.26038 -106.61257 3.64781 2.09708 -106.21888 614.38440
3125.0000 -109.52062 -105.61824 3.90239 2.08153 -106.41559 602.59287
3130.0000 -108.98036 -105.36995 3.61041 2.12945 -105.80934 632.85023
3135.0000 -110.50547 -106.94416 3.56131 2.09010 -106.30710 607.50276
3140.0000 -110.32073 -106.42444 3.89630 2.00600 -107.37116 566.08761
3145.0000 -109.45232 -105.31312 4.13920 2.11204 -106.02958 633.73130
3150.0000 -109.22685 -105.51765 3.70920 2.17109 -105.28242 682.04524
3155.0000 -109.81232 -105.94801 3.86431 2.12071 -105.91989 612.31262
3160.0000 -109.22344 -105.33647 3.88697 2.15217 -105.52190 633.96212
3165.0000 -110.02263 -106.43832 3.58431 2.11917 -105.93940 617.74000
3170.0000 -109.83946 -105.22065 4.61882 2.12819 -105.82524 644.68462
3175.0000 -109.74974 -106.34113 3.40861 2.11684 -105.96888 615.93490
3180.0000 -109.76509 -105.79103 3.97406 2.09772 -106.21073 606.07070
3185.0000 -109.81341 -105.94895 3.86445 2.14005 -105.67523 647.37870
3190.0000 -109.20088 -106.24470 2.95617 2.12898 -105.81518 618.30852
3195.0000 -109.66548 -106.36937 3.29611 2.08427 -106.38093 598.81696
3200.0000 -109.73965 -105.13548 4.60417 2.12855 -105.82066 617.33660
3205.0000 -110.04062 -106.65435 3.38627 2.08786 -106.33543 601.48559
3210.0000 -110.16482 -106.81811 3.34672 2.06639 -106.60713 602.24737
3215.0000 -108.94840 -106.06591 2.88249 2.09612 -106.23101 602.41333
3220.0000 -109.43539 -105.06490 4.37049 2.14784 -105.57660 653.68444
3225.0000 -109.44621 -106.20423 3.24198 2.16375 -105.37537 628.20980
3230.0000 -109.85911 -106.40052 3.45859 2.15541 -105.48082 648.75025
3235.0000 -110.26139 -107.01748 3.24390 2.05540 -106.74618 555.70503
3240.0000 -110.49307 -106.97174 3.52133 2.02436 -107.13887 538.47505
3245.0000 -109.93415 -106.39729 3.53685 2.04014 -106.93922 567.82297
3250.0000 -109.88624 -105.52813 4.35811 2.07423 -106.50794 586.32872
MELTING PROCESS: loop number 14 T-loop= 657.00000000000000
main_MD> interactions number 14 at Temperature= 657.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.04307 -1.45870 -1.69277
force_rgl> df(natom) 1.14409 1.07034 -1.28163
3255.0000 -108.99898 -105.35157 3.64741 2.18576 -105.09683 670.48755
3260.0000 -109.07513 -105.45917 3.61596 2.16446 -105.36640 658.56621
3265.0000 -107.64293 -103.73868 3.90425 2.17827 -105.19170 653.55185
3270.0000 -108.79247 -105.24607 3.54640 2.22622 -104.58504 698.54910
3275.0000 -109.06384 -105.08265 3.98119 2.15754 -105.45388 634.30217
3280.0000 -108.98932 -105.08304 3.90628 2.19697 -104.95509 686.98565
3285.0000 -108.27380 -104.64034 3.63347 2.21015 -104.78833 690.94531
3290.0000 -109.47827 -105.48546 3.99281 2.15645 -105.46767 647.72735
3295.0000 -109.69466 -105.93759 3.75706 2.12269 -105.89481 635.34628
3300.0000 -110.01641 -105.23822 4.77819 2.16694 -105.33501 670.83568
3305.0000 -108.66116 -104.97457 3.68659 2.13874 -105.69171 619.63217
3310.0000 -109.15400 -105.59710 3.55690 2.15843 -105.44263 626.36067
3315.0000 -108.85602 -105.42189 3.43413 2.12682 -105.84251 639.04277
3320.0000 -109.42643 -105.57082 3.85560 2.13838 -105.69632 636.44640
3325.0000 -108.82458 -105.57256 3.25202 2.13308 -105.76333 637.16111
3330.0000 -108.82448 -104.99713 3.82735 2.21171 -104.76859 685.13574
3335.0000 -108.40319 -104.45466 3.94853 2.20195 -104.89206 671.83189
3340.0000 -108.13830 -104.10126 4.03704 2.25476 -104.22395 729.31172
3345.0000 -108.11893 -104.10410 4.01483 2.31266 -103.49139 767.89081
3350.0000 -107.79205 -103.93328 3.85876 2.25993 -104.15853 693.90906
3355.0000 -108.42851 -104.80986 3.61865 2.23955 -104.41640 707.35219
3360.0000 -110.01978 -106.64793 3.37185 2.11720 -105.96421 613.23680
3365.0000 -109.33652 -105.84896 3.48755 2.10120 -106.16671 615.81330
3370.0000 -108.77984 -104.92436 3.85548 2.14216 -105.64848 659.02884
3375.0000 -109.18682 -104.67116 4.51566 2.19165 -105.02238 671.33144
3380.0000 -108.79903 -104.29082 4.50821 2.21435 -104.73519 722.05768
3385.0000 -108.53085 -105.07680 3.45405 2.19257 -105.01073 662.97609
3390.0000 -110.22071 -105.87149 4.34923 2.15943 -105.43003 653.64856
3395.0000 -109.39289 -105.61058 3.78231 2.10379 -106.13394 627.99468
3400.0000 -109.05409 -104.18918 4.86491 2.17735 -105.20325 687.98464
3405.0000 -108.03521 -104.28878 3.74643 2.26606 -104.08098 706.65353
3410.0000 -109.15869 -105.07397 4.08471 2.23089 -104.52596 665.91893
3415.0000 -110.41555 -106.73775 3.67780 2.13806 -105.70034 626.82906
3420.0000 -110.14289 -107.22946 2.91343 2.06102 -106.67497 564.73402
3425.0000 -109.03589 -106.05519 2.98070 2.06661 -106.60426 592.61165
3430.0000 -109.43603 -104.73883 4.69721 2.15851 -105.44161 656.68955
3435.0000 -109.04758 -105.11470 3.93288 2.16149 -105.40397 642.18093
3440.0000 -109.03205 -105.42686 3.60520 2.15067 -105.54084 651.37702
3445.0000 -108.59556 -105.71266 2.88290 2.09536 -106.24055 570.94980
3450.0000 -109.33626 -104.56567 4.77060 2.20915 -104.80094 726.04422
3455.0000 -109.36499 -105.74577 3.61922 2.15230 -105.52024 658.09905
3460.0000 -108.78461 -104.46018 4.32443 2.18182 -105.14673 685.52514
3465.0000 -108.66305 -104.64088 4.02217 2.24245 -104.37969 719.18948
3470.0000 -109.32383 -105.75489 3.56894 2.16656 -105.33974 641.13778
3475.0000 -109.80146 -106.23086 3.57060 2.13171 -105.78070 654.80615
3480.0000 -109.21312 -105.56087 3.65226 2.12383 -105.88045 642.48669
3485.0000 -108.96641 -104.52878 4.43764 2.20429 -104.86240 691.69293
3490.0000 -109.45318 -105.72099 3.73220 2.16963 -105.30096 644.03965
3495.0000 -109.79706 -106.35971 3.43734 2.08918 -106.31878 602.63669
3500.0000 -109.66308 -106.70213 2.96096 2.08995 -106.30899 599.86064
MELTING PROCESS: loop number 15 T-loop= 682.00000000000000
main_MD> interactions number 15 at Temperature= 682.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.07949 1.12799 0.34237
force_rgl> df(natom) -0.19872 -0.19852 -0.50119
3505.0000 -108.40811 -103.98600 4.42212 2.19279 -105.00792 643.94104
3510.0000 -108.05164 -103.12586 4.92578 2.32641 -103.31742 797.87527
3515.0000 -109.29238 -104.27473 5.01765 2.26929 -104.04009 777.70636
3520.0000 -108.97345 -104.83989 4.13356 2.23945 -104.41768 729.34656
3525.0000 -108.50274 -105.09134 3.41140 2.20521 -104.85085 681.13107
3530.0000 -109.66826 -105.17311 4.49514 2.19682 -104.95695 679.40568
3535.0000 -109.05688 -105.17396 3.88293 2.17326 -105.25503 682.43845
3540.0000 -109.35884 -105.58122 3.77762 2.17048 -105.29022 653.93562
3545.0000 -108.85322 -104.94020 3.91301 2.19818 -104.93976 661.87438
3550.0000 -108.45727 -103.83772 4.61955 2.29251 -103.74636 746.99092
3555.0000 -109.40386 -105.12720 4.27665 2.23103 -104.52409 679.81154
3560.0000 -108.73816 -105.04037 3.69779 2.15590 -105.47460 667.66848
3565.0000 -107.54037 -104.01488 3.52549 2.24524 -104.34441 720.17195
3570.0000 -108.51656 -104.32312 4.19344 2.27159 -104.01105 737.89818
3575.0000 -109.93454 -106.08424 3.85030 2.17034 -105.29201 653.88255
3580.0000 -109.41694 -105.70637 3.71057 2.14308 -105.63679 653.84247
3585.0000 -110.01482 -106.21577 3.79905 2.10327 -106.14048 612.32997
3590.0000 -110.46398 -106.75323 3.71076 2.05202 -106.78885 561.09803
3595.0000 -109.40718 -105.32361 4.08357 2.11537 -105.98737 628.36416
3600.0000 -108.98227 -105.63813 3.34413 2.16954 -105.30206 656.23923
3605.0000 -109.41719 -105.49013 3.92706 2.13164 -105.78154 623.57222
3610.0000 -109.02795 -104.61796 4.41000 2.18900 -105.05587 696.37301
3615.0000 -107.65994 -103.60463 4.05532 2.24533 -104.34319 703.26445
3620.0000 -108.32048 -103.64046 4.68002 2.30506 -103.58759 766.81548
3625.0000 -109.22847 -105.46852 3.75995 2.27655 -103.94820 754.37332
3630.0000 -109.42887 -105.83329 3.59558 2.18895 -105.05655 706.32187
3635.0000 -108.57256 -105.02086 3.55170 2.18904 -105.05540 671.50674
3640.0000 -108.33229 -104.31113 4.02116 2.21237 -104.76021 669.84246
3645.0000 -107.95413 -103.49522 4.45891 2.25875 -104.17342 707.99187
3650.0000 -108.65199 -104.29981 4.35218 2.29979 -103.65426 748.77620
3655.0000 -108.68382 -105.40476 3.27906 2.21592 -104.71535 678.08549
3660.0000 -108.77525 -105.44970 3.32555 2.15480 -105.48862 624.90054
3665.0000 -109.72463 -105.21645 4.50817 2.19546 -104.97411 674.12698
3670.0000 -108.72882 -105.16541 3.56341 2.18122 -105.15425 677.60838
3675.0000 -109.22651 -104.90929 4.31722 2.17339 -105.25336 667.81674
3680.0000 -109.02020 -105.12729 3.89291 2.19748 -104.94861 696.85515
3685.0000 -109.45032 -105.50930 3.94102 2.15532 -105.48204 654.11267
3690.0000 -108.09621 -103.74875 4.34746 2.21742 -104.69627 721.98721
3695.0000 -108.89813 -104.85183 4.04630 2.23790 -104.43720 729.69670
3700.0000 -109.09928 -105.21726 3.88203 2.18406 -105.11839 699.94455
3705.0000 -109.57877 -105.41354 4.16523 2.17703 -105.20732 690.51605
3710.0000 -109.48670 -105.38404 4.10266 2.17393 -105.24653 679.82298
3715.0000 -108.65689 -104.37447 4.28243 2.22945 -104.54419 696.13397
3720.0000 -109.72512 -105.42826 4.29687 2.22537 -104.59575 714.05484
3725.0000 -108.62766 -104.39354 4.23412 2.22536 -104.59593 717.26344
3730.0000 -109.45558 -105.01154 4.44404 2.23478 -104.47673 722.99392
3735.0000 -109.37256 -105.80899 3.56357 2.12068 -105.92027 635.63664
3740.0000 -109.24537 -105.81774 3.42763 2.12397 -105.87864 634.94395
3745.0000 -110.22357 -106.02025 4.20332 2.11865 -105.94598 617.11757
3750.0000 -109.24237 -105.14383 4.09854 2.14501 -105.61244 668.93089
MELTING PROCESS: loop number 16 T-loop= 707.00000000000000
main_MD> interactions number 16 at Temperature= 707.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -3.15164 1.18429 -0.38355
force_rgl> df(natom) 1.13524 -3.89176 -0.97425
3755.0000 -109.18092 -105.45151 3.72941 2.19170 -105.02176 661.29293
3760.0000 -109.00306 -104.49524 4.50781 2.22082 -104.65332 721.25139
3765.0000 -108.09649 -104.04563 4.05086 2.22788 -104.56398 723.32268
3770.0000 -108.67690 -104.83081 3.84608 2.26708 -104.06812 746.13385
3775.0000 -108.15742 -104.70553 3.45188 2.19963 -104.92141 656.11282
3780.0000 -110.03531 -105.40403 4.63128 2.19353 -104.99858 663.00133
3785.0000 -109.20336 -105.05100 4.15236 2.17031 -105.29239 699.95892
3790.0000 -108.99681 -105.08079 3.91602 2.15863 -105.44007 688.51408
3795.0000 -108.03577 -104.29610 3.73968 2.24313 -104.37102 712.14395
3800.0000 -107.71456 -103.87813 3.83643 2.27414 -103.97874 696.53387
3805.0000 -108.19670 -103.99098 4.20572 2.29613 -103.70050 731.90353
3810.0000 -108.05095 -104.10515 3.94580 2.26528 -104.09087 766.55696
3815.0000 -109.48320 -104.78930 4.69390 2.23880 -104.42583 704.79674
3820.0000 -108.76466 -104.30521 4.45945 2.19896 -104.92986 710.21291
3825.0000 -108.24241 -104.05770 4.18471 2.20358 -104.87138 708.02109
3830.0000 -108.34338 -104.27743 4.06595 2.20112 -104.90259 663.73670
3835.0000 -107.87138 -103.81507 4.05631 2.26727 -104.06561 740.19763
3840.0000 -108.18419 -103.78875 4.39544 2.29695 -103.69017 735.37764
3845.0000 -108.07207 -103.81176 4.26031 2.30040 -103.64650 724.93807
3850.0000 -108.01710 -103.39307 4.62403 2.24028 -104.40709 692.80572
3855.0000 -109.36731 -104.33266 5.03465 2.25148 -104.26545 762.70430
3860.0000 -109.10576 -104.40329 4.70247 2.27158 -104.01110 772.27501
3865.0000 -108.95687 -105.27324 3.68363 2.18503 -105.10610 694.30056
3870.0000 -108.33341 -104.03621 4.29720 2.21271 -104.75597 712.61358
3875.0000 -108.28063 -104.46543 3.81521 2.27343 -103.98772 760.04976
3880.0000 -108.91384 -104.58648 4.32736 2.24110 -104.39677 714.68423
3885.0000 -109.07406 -105.12930 3.94476 2.16134 -105.40589 661.11271
3890.0000 -109.08165 -104.56830 4.51336 2.22891 -104.55091 745.62893
3895.0000 -108.27181 -104.66902 3.60279 2.24812 -104.30796 742.66463
3900.0000 -109.15206 -105.26035 3.89171 2.22359 -104.61829 693.95558
3905.0000 -108.70744 -104.62078 4.08666 2.18506 -105.10573 677.17720
3910.0000 -109.17333 -104.75184 4.42149 2.21737 -104.69692 700.26429
3915.0000 -108.88594 -104.45444 4.43150 2.23833 -104.43182 729.86706
3920.0000 -108.28647 -104.12889 4.15758 2.25403 -104.23321 712.69542
3925.0000 -108.95537 -104.45698 4.49839 2.22699 -104.57528 708.03393
3930.0000 -107.63427 -104.36750 3.26678 2.23370 -104.49036 741.51796
3935.0000 -108.09616 -104.13731 3.95885 2.26304 -104.11920 757.73591
3940.0000 -108.30898 -104.50811 3.80087 2.23448 -104.48047 694.85697
3945.0000 -109.25607 -104.28755 4.96852 2.19260 -105.01039 674.95707
3950.0000 -109.51276 -105.75697 3.75579 2.22101 -104.65091 719.03434
3955.0000 -109.41010 -105.90751 3.50259 2.15492 -105.48699 647.32749
3960.0000 -109.67691 -105.51226 4.16466 2.13597 -105.72679 617.93122
3965.0000 -107.70325 -103.52534 4.17791 2.27756 -103.93546 750.67807
3970.0000 -107.46776 -103.42226 4.04551 2.31478 -103.46456 766.09753
3975.0000 -108.43426 -104.11770 4.31656 2.27683 -103.94474 743.72976
3980.0000 -109.43168 -104.56880 4.86289 2.28103 -103.89157 725.33214
3985.0000 -109.24224 -104.80493 4.43731 2.21269 -104.75620 660.37657
3990.0000 -109.44956 -104.75034 4.69922 2.19376 -104.99571 681.49442
3995.0000 -108.47442 -105.03795 3.43647 2.21449 -104.73338 711.76786
4000.0000 -108.36569 -104.64270 3.72299 2.20677 -104.83104 678.55747
MELTING PROCESS: loop number 17 T-loop= 732.00000000000000
main_MD> interactions number 17 at Temperature= 732.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 3.78230 2.40213 -0.09012
force_rgl> df(natom) 0.08431 -1.29948 3.90674
4005.0000 -107.59101 -103.73345 3.85756 2.22948 -104.54374 699.75676
4010.0000 -108.27855 -103.92597 4.35257 2.28347 -103.86073 733.52656
4015.0000 -108.10712 -103.10543 5.00169 2.29077 -103.76832 736.96342
4020.0000 -108.82270 -103.87835 4.94435 2.32564 -103.32717 781.60224
4025.0000 -108.78411 -103.84995 4.93416 2.31013 -103.52341 783.46115
4030.0000 -108.55019 -104.46808 4.08211 2.23605 -104.46061 722.71439
4035.0000 -109.06438 -104.59517 4.46921 2.25785 -104.18488 721.70027
4040.0000 -109.01089 -104.03277 4.97812 2.20752 -104.82163 677.12281
4045.0000 -108.26424 -104.33440 3.92984 2.24742 -104.31685 740.12316
4050.0000 -108.95808 -105.10610 3.85198 2.20802 -104.81531 715.28333
4055.0000 -109.10582 -104.51649 4.58934 2.20988 -104.79174 675.21075
4060.0000 -106.96768 -102.46438 4.50330 2.28037 -103.89994 746.98956
4065.0000 -106.98381 -102.75825 4.22556 2.35802 -102.91749 821.15194
4070.0000 -107.80376 -103.14692 4.65684 2.39006 -102.51213 820.88984
4075.0000 -107.42458 -103.20286 4.22172 2.36563 -102.82121 850.36214
4080.0000 -108.31668 -103.66458 4.65210 2.32497 -103.33571 768.56811
4085.0000 -108.43914 -103.31237 5.12677 2.29980 -103.65410 775.63640
4090.0000 -108.06069 -104.38359 3.67710 2.27099 -104.01865 707.63658
4095.0000 -107.32687 -103.71275 3.61411 2.22758 -104.56776 701.93205
4100.0000 -107.99895 -103.28403 4.71491 2.27622 -103.95248 743.56586
4105.0000 -108.47123 -103.89890 4.57233 2.31016 -103.52297 782.40640
4110.0000 -107.39019 -103.09113 4.29906 2.31797 -103.42426 766.75636
4115.0000 -108.16267 -103.05562 5.10705 2.36107 -102.87896 814.97123
4120.0000 -109.09577 -104.16235 4.93342 2.31005 -103.52442 752.90248
4125.0000 -108.85296 -104.77825 4.07471 2.20782 -104.81775 700.23505
4130.0000 -108.60535 -104.60175 4.00360 2.22968 -104.54124 724.27417
4135.0000 -108.48581 -104.48647 3.99934 2.25492 -104.22190 735.40058
4140.0000 -109.39701 -105.68127 3.71574 2.21680 -104.70415 708.38064
4145.0000 -109.57270 -105.88164 3.69106 2.13174 -105.78032 657.92196
4150.0000 -107.25783 -103.71299 3.54484 2.17136 -105.27903 687.49830
4155.0000 -108.97782 -104.02189 4.95592 2.28438 -103.84917 774.38110
4160.0000 -107.46465 -102.29085 5.17380 2.33618 -103.19386 780.99187
4165.0000 -108.36840 -103.47323 4.89517 2.35749 -102.92427 827.30429
4170.0000 -108.00380 -104.04845 3.95535 2.33222 -103.24394 811.33114
4175.0000 -108.61838 -104.59248 4.02589 2.24591 -104.33593 703.46287
4180.0000 -108.60029 -104.11990 4.48039 2.23549 -104.46772 707.15360
4185.0000 -107.66131 -103.52410 4.13720 2.28260 -103.87171 743.13723
4190.0000 -107.65732 -103.18919 4.46813 2.32417 -103.34585 757.17330
4195.0000 -108.82851 -105.35802 3.47049 2.26600 -104.08175 719.45614
4200.0000 -108.45222 -103.95894 4.49328 2.21710 -104.70037 682.08210
4205.0000 -108.60684 -105.12281 3.48404 2.25880 -104.17287 744.65891
4210.0000 -109.23492 -106.63834 2.59658 2.13752 -105.70720 630.35161
4215.0000 -108.61458 -105.17807 3.43651 2.14575 -105.60301 667.42285
4220.0000 -108.45160 -104.82226 3.62933 2.20377 -104.86902 703.20259
4225.0000 -108.49905 -103.91990 4.57915 2.23936 -104.41881 717.81155
4230.0000 -107.88340 -104.01851 3.86489 2.23756 -104.44152 704.97582
4235.0000 -108.80036 -104.52348 4.27688 2.25935 -104.16592 741.31632
4240.0000 -107.54549 -102.86773 4.67777 2.26270 -104.12347 746.82123
4245.0000 -108.39252 -104.33786 4.05466 2.28037 -103.89996 749.73701
4250.0000 -108.75812 -104.26328 4.49484 2.22348 -104.61963 691.69422
MELTING PROCESS: loop number 18 T-loop= 757.00000000000000
main_MD> interactions number 18 at Temperature= 757.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.43239 -2.09381 0.24445
force_rgl> df(natom) 1.45361 2.68490 3.27062
4255.0000 -109.21334 -105.53970 3.67364 2.18237 -105.13982 676.15551
4260.0000 -108.63272 -103.43443 5.19830 2.24923 -104.29395 707.69944
4265.0000 -107.65752 -102.45060 5.20692 2.36198 -102.86748 809.14385
4270.0000 -107.52363 -103.24347 4.28016 2.38921 -102.52294 825.81524
4275.0000 -108.63939 -103.96325 4.67614 2.28315 -103.86475 735.18074
4280.0000 -109.01800 -103.97404 5.04395 2.28446 -103.84818 790.98773
4285.0000 -109.30752 -105.23981 4.06771 2.20904 -104.80230 679.91015
4290.0000 -107.74794 -104.03534 3.71260 2.25351 -104.23972 699.89683
4295.0000 -107.99737 -103.27248 4.72489 2.27189 -104.00726 717.82528
4300.0000 -108.61242 -103.93917 4.67325 2.30647 -103.56968 740.62687
4305.0000 -108.58998 -103.58734 5.00264 2.29240 -103.74769 749.08447
4310.0000 -107.14004 -103.05008 4.08997 2.33722 -103.18073 749.09957
4315.0000 -106.43584 -100.48102 5.95482 2.42668 -102.04894 852.21896
4320.0000 -106.38538 -101.00382 5.38156 2.56917 -100.24622 978.10415
4325.0000 -107.19530 -102.15367 5.04162 2.48779 -101.27570 902.24406
4330.0000 -108.60096 -102.96050 5.64046 2.39204 -102.48707 832.31253
4335.0000 -109.10044 -103.64342 5.45702 2.30609 -103.57449 761.99681
4340.0000 -108.33271 -104.52222 3.81049 2.32168 -103.37730 803.46483
4345.0000 -109.61155 -105.20686 4.40470 2.24098 -104.39826 730.27218
4350.0000 -107.79708 -103.32972 4.46736 2.22113 -104.64940 719.94307
4355.0000 -108.58590 -103.78129 4.80462 2.30262 -103.61846 750.77142
4360.0000 -108.29745 -103.44058 4.85686 2.32704 -103.30950 813.63511
4365.0000 -108.49425 -103.87486 4.61939 2.32027 -103.39512 776.70997
4370.0000 -108.62617 -104.06366 4.56251 2.28364 -103.85857 765.06217
4375.0000 -109.26553 -105.53430 3.73124 2.24164 -104.38986 727.28367
4380.0000 -108.40596 -104.54720 3.85877 2.17215 -105.26907 648.17398
4385.0000 -107.68415 -103.66231 4.02183 2.19894 -104.93018 704.62436
4390.0000 -108.26966 -102.90240 5.36726 2.32095 -103.38657 788.34336
4395.0000 -107.72760 -103.67547 4.05212 2.36201 -102.86699 813.34312
4400.0000 -108.49199 -103.05706 5.43493 2.30260 -103.61869 756.05949
4405.0000 -108.47574 -104.28932 4.18643 2.32909 -103.28353 799.27998
4410.0000 -109.52699 -105.13192 4.39506 2.23606 -104.46046 716.94992
4415.0000 -108.69242 -104.10626 4.58616 2.19983 -104.91887 691.25477
4420.0000 -108.38468 -104.38897 3.99571 2.23917 -104.42119 727.86906
4425.0000 -109.20368 -103.48816 5.71552 2.26512 -104.09288 756.90048
4430.0000 -108.82195 -104.03367 4.78828 2.25418 -104.23129 743.19987
4435.0000 -108.26590 -104.26006 4.00584 2.31865 -103.41556 804.89753
4440.0000 -108.97804 -104.39547 4.58257 2.25192 -104.25984 724.49312
4445.0000 -108.39051 -104.65662 3.73389 2.26601 -104.08162 757.55811
4450.0000 -107.68161 -103.67311 4.00850 2.25189 -104.26019 754.24431
4455.0000 -108.39426 -103.98313 4.41113 2.29279 -103.74273 744.02495
4460.0000 -108.00605 -104.09869 3.90737 2.23845 -104.43022 722.71820
4465.0000 -108.60543 -104.44230 4.16313 2.28300 -103.86666 744.75290
4470.0000 -108.38496 -104.66644 3.71852 2.25884 -104.17234 701.62813
4475.0000 -108.04969 -103.46027 4.58942 2.28768 -103.80743 722.73377
4480.0000 -108.49708 -103.89894 4.59814 2.30986 -103.52684 827.72056
4485.0000 -108.72556 -104.71664 4.00892 2.25548 -104.21483 727.70525
4490.0000 -108.92796 -104.79430 4.13366 2.23530 -104.47011 701.69048
4495.0000 -109.43887 -104.97178 4.46710 2.17627 -105.21699 690.31106
4500.0000 -108.74541 -104.53168 4.21373 2.20836 -104.81093 712.13561
MELTING PROCESS: loop number 19 T-loop= 782.00000000000000
main_MD> interactions number 19 at Temperature= 782.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.60881 -3.09436 0.52403
force_rgl> df(natom) -2.66456 -0.36591 -1.35401
4505.0000 -108.57959 -103.89108 4.68851 2.22867 -104.55400 733.25860
4510.0000 -107.92319 -103.75997 4.16322 2.29656 -103.69514 757.42654
4515.0000 -107.80961 -102.58125 5.22836 2.33114 -103.25761 789.96438
4520.0000 -108.02369 -103.29836 4.72533 2.35811 -102.91634 832.76928
4525.0000 -106.48095 -101.32562 5.15533 2.37888 -102.65359 824.28512
4530.0000 -107.82357 -102.79977 5.02379 2.43986 -101.88216 864.87160
4535.0000 -107.09980 -103.02786 4.07194 2.37283 -102.73021 785.43353
4540.0000 -108.37911 -103.56924 4.80987 2.32634 -103.31839 776.80746
4545.0000 -108.09039 -103.75159 4.33880 2.34024 -103.14243 794.63763
4550.0000 -108.13607 -104.13164 4.00443 2.30610 -103.57439 791.25002
4555.0000 -108.51301 -104.37439 4.13862 2.25253 -104.25213 723.21854
4560.0000 -109.15870 -104.51389 4.64481 2.21034 -104.78597 689.69529
4565.0000 -109.33132 -104.60313 4.72819 2.22310 -104.62450 689.19213
4570.0000 -108.42199 -104.24550 4.17649 2.27016 -104.02907 735.98620
4575.0000 -108.55524 -103.02184 5.53341 2.28741 -103.81082 752.74767
4580.0000 -106.64552 -101.96019 4.68533 2.38515 -102.57429 809.38288
4585.0000 -108.19048 -102.89229 5.29819 2.36965 -102.77042 796.85830
4590.0000 -108.14159 -103.90406 4.23753 2.32238 -103.36849 788.61666
4595.0000 -107.76783 -102.98622 4.78161 2.31033 -103.52093 794.66434
4600.0000 -106.91787 -102.35888 4.55899 2.36591 -102.81771 831.07349
4605.0000 -108.15328 -103.18439 4.96889 2.35675 -102.93357 799.47482
4610.0000 -107.70186 -103.50908 4.19278 2.33765 -103.17529 783.44806
4615.0000 -109.01442 -103.48548 5.52894 2.31171 -103.50346 775.09539
4620.0000 -108.98379 -103.63660 5.34719 2.27457 -103.97326 751.04684
4625.0000 -108.79741 -104.69682 4.10060 2.24856 -104.30232 703.69890
4630.0000 -108.08847 -103.47063 4.61785 2.29498 -103.71513 739.66432
4635.0000 -106.92514 -102.23185 4.69329 2.38530 -102.57238 823.42135
4640.0000 -108.13651 -103.62628 4.51023 2.41108 -102.24620 847.08203
4645.0000 -108.16995 -103.65594 4.51402 2.26831 -104.05248 758.99969
4650.0000 -108.60113 -103.19066 5.41046 2.33641 -103.19090 808.22002
4655.0000 -107.77934 -104.04201 3.73733 2.28146 -103.88618 759.21488
4660.0000 -107.89636 -104.17040 3.72596 2.27161 -104.01080 724.63812
4665.0000 -108.00214 -103.34370 4.65844 2.27636 -103.95070 734.58387
4670.0000 -107.32083 -102.86160 4.45923 2.37771 -102.66848 829.06952
4675.0000 -107.72552 -102.52082 5.20470 2.33515 -103.20682 800.96803
4680.0000 -108.46783 -103.84867 4.61916 2.34706 -103.05622 776.13478
4685.0000 -108.52448 -104.31135 4.21313 2.27806 -103.92911 728.35536
4690.0000 -107.87596 -103.54501 4.33096 2.28073 -103.89538 752.04427
4695.0000 -108.31719 -103.67352 4.64368 2.25713 -104.19397 731.93458
4700.0000 -108.31496 -104.18789 4.12707 2.30335 -103.60919 766.08504
4705.0000 -108.43300 -102.78822 5.64478 2.35054 -103.01213 795.93237
4710.0000 -107.87426 -102.01357 5.86069 2.40960 -102.26498 844.50199
4715.0000 -107.13365 -103.08914 4.04451 2.37748 -102.67128 824.76145
4720.0000 -108.32887 -104.00436 4.32451 2.31256 -103.49271 760.79420
4725.0000 -106.42372 -101.09144 5.33228 2.39474 -102.45291 825.37207
4730.0000 -106.75901 -101.85743 4.90157 2.43550 -101.93736 848.89969
4735.0000 -108.43245 -103.93059 4.50185 2.33228 -103.24317 770.87058
4740.0000 -108.07544 -102.83860 5.23684 2.32867 -103.28888 809.06712
4745.0000 -107.38027 -102.40288 4.97739 2.37781 -102.66721 834.08510
4750.0000 -107.68242 -103.49047 4.19195 2.32570 -103.32637 793.63562
MELTING PROCESS: loop number 20 T-loop= 807.00000000000000
main_MD> interactions number 20 at Temperature= 807.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 5.18956 0.86494 -0.81075
force_rgl> df(natom) 1.93302 0.03247 0.43210
4755.0000 -107.52263 -103.35794 4.16469 2.27625 -103.95207 733.94010
4760.0000 -108.14185 -103.75091 4.39094 2.29737 -103.68482 759.71432
4765.0000 -107.34980 -102.65478 4.69501 2.35174 -102.99699 818.34251
4770.0000 -108.58140 -102.93902 5.64238 2.35059 -103.01157 832.27385
4775.0000 -108.97566 -103.00318 5.97247 2.35845 -102.91214 815.70121
4780.0000 -107.98356 -103.81836 4.16520 2.33394 -103.22213 801.78518
4785.0000 -108.43255 -103.43006 5.00249 2.35813 -102.91612 814.91924
4790.0000 -107.33751 -102.83180 4.50571 2.37826 -102.66152 834.42059
4795.0000 -106.73665 -102.17277 4.56389 2.37379 -102.71800 830.33884
4800.0000 -107.08744 -102.64131 4.44613 2.38656 -102.55641 825.74593
4805.0000 -106.54659 -100.86811 5.67848 2.42680 -102.04730 833.36162
4810.0000 -108.60756 -103.68562 4.92194 2.36837 -102.78661 809.21218
4815.0000 -108.96538 -104.64973 4.31565 2.28173 -103.88268 749.58839
4820.0000 -107.93869 -103.67024 4.26846 2.33036 -103.26743 794.81815
4825.0000 -107.19045 -102.60225 4.58819 2.33936 -103.15367 773.69941
4830.0000 -104.92490 -100.92861 3.99629 2.45557 -101.68334 858.63181
4835.0000 -107.09104 -101.99603 5.09501 2.46263 -101.59408 901.61575
4840.0000 -108.01680 -103.26195 4.75485 2.34634 -103.06531 827.13720
4845.0000 -108.31206 -103.90875 4.40331 2.33408 -103.22035 773.30102
4850.0000 -108.07718 -103.10071 4.97647 2.32964 -103.27656 779.43529
4855.0000 -107.76865 -103.17781 4.59084 2.35872 -102.90863 805.51774
4860.0000 -107.00679 -102.69931 4.30748 2.29540 -103.70977 743.68292
4865.0000 -108.81278 -103.63798 5.17480 2.40611 -102.30910 814.26442
4870.0000 -109.53312 -104.95349 4.57963 2.25935 -104.16589 736.48155
4875.0000 -109.24324 -105.52581 3.71743 2.20596 -104.84134 695.18927
4880.0000 -108.68011 -103.37303 5.30707 2.24015 -104.40877 713.20823
4885.0000 -108.01354 -103.46268 4.55085 2.30241 -103.62107 765.48442
4890.0000 -106.53224 -102.07992 4.45233 2.35116 -103.00437 838.29452
4895.0000 -106.46424 -101.89312 4.57111 2.41511 -102.19528 855.80970
4900.0000 -107.80243 -102.96061 4.84183 2.35338 -102.97630 792.30724
4905.0000 -107.28971 -102.71063 4.57907 2.40414 -102.33402 836.19670
4910.0000 -107.78196 -103.17625 4.60571 2.39076 -102.50328 852.96068
4915.0000 -107.34612 -102.08032 5.26581 2.36659 -102.80915 811.04354
4920.0000 -107.12728 -102.40546 4.72182 2.37536 -102.69821 820.19358
4925.0000 -107.26224 -102.98802 4.27422 2.38285 -102.60336 841.40796
4930.0000 -107.15625 -102.13668 5.01957 2.36288 -102.85600 822.13675
4935.0000 -107.80336 -102.64417 5.15919 2.41641 -102.17887 856.59278
4940.0000 -107.86611 -102.68889 5.17723 2.36879 -102.78128 848.17555
4945.0000 -106.29048 -101.86532 4.42515 2.40774 -102.28847 830.58080
4950.0000 -107.43181 -102.82632 4.60548 2.43447 -101.95027 834.40743
4955.0000 -106.96164 -103.10308 3.85855 2.36526 -102.82590 805.20094
4960.0000 -107.97440 -103.07947 4.89492 2.34691 -103.05808 769.53582
4965.0000 -106.86624 -102.25368 4.61256 2.43229 -101.97787 856.81501
4970.0000 -106.95552 -102.69519 4.26033 2.36909 -102.77748 816.14106
4975.0000 -108.46674 -103.53325 4.93348 2.35073 -103.00976 807.47759
4980.0000 -108.35290 -103.39032 4.96258 2.28299 -103.86677 747.92707
4985.0000 -106.85918 -102.49442 4.36476 2.36501 -102.82914 838.86290
4990.0000 -107.84350 -102.54021 5.30329 2.39708 -102.42335 865.25560
4995.0000 -107.02168 -102.26130 4.76038 2.39178 -102.49037 845.45690
5000.0000 -107.09479 -102.14183 4.95296 2.38632 -102.55949 822.69647
MELTING PROCESS: loop number 21 T-loop= 832.00000000000000
main_MD> interactions number 21 at Temperature= 832.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.62821 1.30971 0.30829
force_rgl> df(natom) 1.81998 1.27087 0.81086
5005.0000 -108.52040 -103.62640 4.89400 2.34540 -103.07719 792.64124
5010.0000 -107.26779 -102.49547 4.77232 2.31272 -103.49066 793.23595
5015.0000 -105.88132 -101.60096 4.28035 2.41724 -102.16836 868.10055
5020.0000 -106.96572 -101.58014 5.38558 2.45119 -101.73874 883.71918
5025.0000 -105.80301 -101.28940 4.51360 2.41208 -102.23358 881.39275
5030.0000 -106.26878 -101.91384 4.35494 2.46400 -101.57669 892.17560
5035.0000 -107.52395 -102.27419 5.24977 2.44210 -101.85383 888.29560
5040.0000 -107.00251 -101.48949 5.51303 2.48227 -101.34564 926.91590
5045.0000 -106.71874 -102.26684 4.45191 2.39849 -102.40553 868.40761
5050.0000 -107.42225 -102.00974 5.41251 2.45598 -101.67825 876.67922
5055.0000 -107.21699 -102.24694 4.97006 2.37875 -102.65525 858.54198
5060.0000 -109.74340 -103.47202 6.27138 2.39997 -102.38677 858.11521
5065.0000 -108.44318 -104.35592 4.08726 2.30544 -103.58281 794.69068
5070.0000 -107.64029 -103.06487 4.57542 2.31623 -103.44628 783.05520
5075.0000 -104.90826 -101.17585 3.73241 2.47600 -101.42493 886.24060
5080.0000 -107.17562 -101.93065 5.24497 2.50168 -101.10000 917.17746
5085.0000 -107.69758 -102.47579 5.22179 2.42305 -102.09481 870.98495
5090.0000 -107.68936 -104.15330 3.53606 2.33115 -103.25742 791.69572
5095.0000 -105.68647 -100.52327 5.16320 2.35913 -102.90344 809.96324
5100.0000 -107.62184 -102.77201 4.84983 2.45883 -101.64212 852.84664
5105.0000 -107.58322 -103.02617 4.55705 2.33667 -103.18762 799.92676
5110.0000 -107.56789 -102.99792 4.56997 2.34253 -103.11355 808.75882
5115.0000 -107.84452 -103.98818 3.85634 2.35004 -103.01853 802.43033
5120.0000 -107.20913 -103.19469 4.01444 2.29459 -103.71997 759.60650
5125.0000 -107.84158 -101.89536 5.94622 2.35883 -102.90724 852.98447
5130.0000 -106.12166 -99.46368 6.65798 2.54019 -100.61285 963.80662
5135.0000 -105.80952 -99.45393 6.35559 2.66245 -99.06598 1047.33432
5140.0000 -106.51173 -101.25470 5.25703 2.55030 -100.48492 956.54605
5145.0000 -107.23880 -102.58777 4.65104 2.40006 -102.38572 847.39586
5150.0000 -107.47225 -102.83530 4.63695 2.42967 -102.01110 860.01663
5155.0000 -106.29306 -101.35346 4.93960 2.43316 -101.96695 843.30506
5160.0000 -107.69942 -102.68493 5.01449 2.42787 -102.03379 838.38905
5165.0000 -107.53317 -102.32000 5.21317 2.38301 -102.60134 828.88716
5170.0000 -107.04079 -102.32790 4.71289 2.40849 -102.27901 856.70926
5175.0000 -107.58884 -100.93956 6.64928 2.44620 -101.80191 855.30050
5180.0000 -106.63374 -102.02177 4.61197 2.45749 -101.65907 880.00450
5185.0000 -107.92673 -102.31428 5.61245 2.44210 -101.85379 867.58269
5190.0000 -108.46757 -103.57428 4.89329 2.35492 -102.95671 805.64074
5195.0000 -108.27568 -102.81602 5.45966 2.33624 -103.19307 797.31043
5200.0000 -107.51057 -102.84414 4.66643 2.42583 -102.05960 847.48459
5205.0000 -107.93580 -103.17867 4.75713 2.30500 -103.58831 735.12692
5210.0000 -108.68923 -102.49810 6.19113 2.35989 -102.89386 815.26828
5215.0000 -107.88487 -103.97114 3.91373 2.32628 -103.31915 808.69673
5220.0000 -108.99113 -105.10256 3.88857 2.24489 -104.34880 699.96143
5225.0000 -107.39567 -102.19925 5.19641 2.28751 -103.80960 758.07561
5230.0000 -106.89800 -101.68655 5.21145 2.41936 -102.14155 812.75153
5235.0000 -107.26233 -101.70267 5.55966 2.46981 -101.50316 920.72224
5240.0000 -105.96613 -101.76226 4.20387 2.48010 -101.37305 869.19090
5245.0000 -106.14432 -101.06952 5.07481 2.49120 -101.23264 879.13992
5250.0000 -106.93388 -101.41297 5.52091 2.46674 -101.54202 904.29492
MELTING PROCESS: loop number 22 T-loop= 857.00000000000000
main_MD> interactions number 22 at Temperature= 857.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.62001 2.93602 -0.67790
force_rgl> df(natom) -0.67791 1.16263 0.10126
5255.0000 -107.08056 -100.84913 6.23143 2.47636 -101.42032 890.80186
5260.0000 -108.41306 -102.34936 6.06369 2.47185 -101.47740 898.49581
5265.0000 -106.65512 -101.87591 4.77921 2.38786 -102.54005 823.74744
5270.0000 -106.19813 -102.44602 3.75211 2.41534 -102.19232 850.50870
5275.0000 -106.71878 -101.81014 4.90864 2.39315 -102.47309 827.49608
5280.0000 -107.11607 -102.55168 4.56439 2.43079 -101.99694 853.01034
5285.0000 -108.27833 -103.46465 4.81368 2.36153 -102.87318 822.11708
5290.0000 -106.69723 -101.35595 5.34128 2.38873 -102.52904 813.72482
5295.0000 -107.35566 -103.40556 3.95010 2.41843 -102.15324 832.87193
5300.0000 -106.52743 -101.73633 4.79110 2.39526 -102.44637 836.07221
5305.0000 -107.48662 -103.40052 4.08610 2.42972 -102.01042 832.34715
5310.0000 -106.44170 -101.52704 4.91466 2.45437 -101.69854 900.05769
5315.0000 -106.01420 -100.61337 5.40083 2.56100 -100.34958 961.64856
5320.0000 -106.62232 -101.17757 5.44475 2.50408 -101.06963 926.54272
5325.0000 -106.74351 -100.94518 5.79833 2.39617 -102.43488 820.80196
5330.0000 -107.61338 -102.31813 5.29526 2.43440 -101.95121 867.72754
5335.0000 -107.43212 -102.30409 5.12803 2.46431 -101.57275 901.78435
5340.0000 -108.41237 -102.93695 5.47542 2.38948 -102.51955 886.12341
5345.0000 -107.82321 -103.17199 4.65122 2.40073 -102.37720 836.37976
5350.0000 -107.39428 -102.56605 4.82824 2.32583 -103.32479 771.36907
5355.0000 -108.13048 -103.16413 4.96635 2.38953 -102.51890 846.29282
5360.0000 -108.17330 -103.26103 4.91228 2.40122 -102.37103 871.38395
5365.0000 -107.62876 -103.05433 4.57443 2.34717 -103.05478 781.11803
5370.0000 -107.99678 -101.99664 6.00014 2.37157 -102.74605 829.52873
5375.0000 -106.98039 -101.56589 5.41450 2.44036 -101.87577 883.14525
5380.0000 -106.39601 -101.94333 4.45267 2.49112 -101.23368 922.41802
5385.0000 -107.67013 -103.63020 4.03993 2.35783 -102.91997 771.49870
5390.0000 -108.30850 -104.74979 3.55871 2.30146 -103.63311 772.83018
5395.0000 -108.24579 -103.09106 5.15473 2.26142 -104.13972 735.83433
5400.0000 -106.95007 -102.80712 4.14295 2.33035 -103.26758 784.60129
5405.0000 -107.88886 -102.39456 5.49430 2.36803 -102.79085 821.52914
5410.0000 -106.79498 -102.03896 4.75602 2.39533 -102.44547 831.71211
5415.0000 -106.79980 -102.84175 3.95805 2.42038 -102.12859 840.44589
5420.0000 -107.41834 -102.74214 4.67621 2.36503 -102.82885 808.57241
5425.0000 -107.98836 -103.04749 4.94086 2.37477 -102.70563 830.90365
5430.0000 -107.44630 -102.02504 5.42126 2.38720 -102.54842 839.04069
5435.0000 -107.94153 -103.03961 4.90192 2.34827 -103.04086 795.35411
5440.0000 -106.36227 -101.25077 5.11149 2.41115 -102.24533 839.94255
5445.0000 -107.67423 -103.68162 3.99261 2.39708 -102.42336 803.44663
5450.0000 -106.83002 -101.68157 5.14845 2.41900 -102.14610 892.14346
5455.0000 -106.75614 -101.67603 5.08012 2.46744 -101.53326 924.40232
5460.0000 -107.18196 -102.27534 4.90662 2.40963 -102.26455 845.57658
5465.0000 -106.77825 -102.64382 4.13443 2.39626 -102.43377 834.69803
5470.0000 -107.08141 -102.18189 4.89952 2.42788 -102.03367 831.90743
5475.0000 -107.28489 -102.42055 4.86434 2.39599 -102.43712 865.07711
5480.0000 -106.72960 -102.09344 4.63616 2.46261 -101.59434 888.73885
5485.0000 -107.56693 -102.67674 4.89019 2.42751 -102.03833 868.20876
5490.0000 -108.01697 -102.89074 5.12624 2.35796 -102.91828 786.95865
5495.0000 -107.23916 -102.00452 5.23464 2.35630 -102.93935 832.91168
5500.0000 -106.89236 -101.58882 5.30354 2.42833 -102.02797 856.96193
MELTING PROCESS: loop number 23 T-loop= 882.00000000000000
main_MD> interactions number 23 at Temperature= 882.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.89768 -2.36624 -0.88468
force_rgl> df(natom) 4.73787 5.62667 -0.76545
5505.0000 -106.92941 -102.22001 4.70940 2.41137 -102.24257 819.18135
5510.0000 -106.69896 -101.62550 5.07346 2.36490 -102.83052 778.65920
5515.0000 -106.21065 -100.73770 5.47295 2.50630 -101.04160 898.04077
5520.0000 -107.75549 -101.98618 5.76931 2.42582 -102.05982 878.61547
5525.0000 -105.49240 -99.97858 5.51382 2.53620 -100.66334 942.88226
5530.0000 -106.17401 -100.86608 5.30793 2.54455 -100.55759 960.08436
5535.0000 -107.49208 -102.49534 4.99675 2.43114 -101.99241 834.07230
5540.0000 -104.36860 -99.88367 4.48493 2.52003 -100.86792 912.12685
5545.0000 -106.78579 -101.01298 5.77281 2.53027 -100.73832 910.38263
5550.0000 -106.49300 -101.70208 4.79092 2.47204 -101.47499 924.52477
5555.0000 -107.36238 -102.78508 4.57730 2.38641 -102.55840 842.80084
5560.0000 -107.47547 -102.48195 4.99353 2.37887 -102.65380 788.98299
5565.0000 -108.39868 -103.77902 4.61966 2.28593 -103.82962 743.92445
5570.0000 -108.01064 -103.75951 4.25113 2.27911 -103.91590 747.22181
5575.0000 -106.87807 -101.69485 5.18322 2.40159 -102.36634 852.72196
5580.0000 -106.59356 -100.11538 6.47818 2.49882 -101.13616 915.11414
5585.0000 -105.20028 -100.42553 4.77475 2.54074 -100.60584 952.11094
5590.0000 -106.39632 -100.74705 5.64927 2.48679 -101.28837 920.37354
5595.0000 -105.98998 -100.67200 5.31798 2.58097 -100.09685 999.32294
5600.0000 -106.11135 -100.94952 5.16183 2.50310 -101.08201 883.92290
5605.0000 -105.49551 -101.39300 4.10250 2.55686 -100.40194 925.53587
5610.0000 -106.87330 -101.37041 5.50288 2.49932 -101.12993 886.69888
5615.0000 -106.37249 -100.34085 6.03164 2.47601 -101.42485 920.57470
5620.0000 -106.99545 -102.79030 4.20515 2.46919 -101.51112 889.01141
5625.0000 -106.77601 -101.48767 5.28835 2.44860 -101.77156 881.90587
5630.0000 -107.08822 -102.26453 4.82369 2.44276 -101.84540 872.87458
5635.0000 -106.24528 -101.56509 4.68019 2.49188 -101.22407 912.64124
5640.0000 -107.24475 -102.76913 4.47562 2.44770 -101.78291 855.15926
5645.0000 -107.24065 -102.08753 5.15312 2.39354 -102.46816 831.88601
5650.0000 -107.68130 -102.66826 5.01304 2.42381 -102.08515 869.41255
5655.0000 -108.45638 -102.90996 5.54642 2.38590 -102.56486 836.51800
5660.0000 -105.90706 -100.65521 5.25185 2.47176 -101.47854 896.29246
5665.0000 -107.64930 -100.76330 6.88601 2.51911 -100.87945 936.56862
5670.0000 -106.02922 -100.25214 5.77708 2.54948 -100.49523 950.22891
5675.0000 -105.41800 -99.39102 6.02698 2.62431 -99.54853 1022.94271
5680.0000 -106.11850 -100.42133 5.69717 2.62331 -99.56116 997.65762
5685.0000 -106.13833 -100.07387 6.06447 2.52891 -100.75547 919.94772
5690.0000 -106.99664 -101.85151 5.14513 2.51723 -100.90332 905.84420
5695.0000 -106.47976 -102.14129 4.33847 2.43090 -101.99553 864.36719
5700.0000 -105.75811 -99.28940 6.46871 2.51733 -100.90206 931.65851
5705.0000 -106.37398 -102.36357 4.01041 2.54858 -100.50669 965.09409
5710.0000 -107.29293 -101.35251 5.94043 2.42702 -102.04458 897.32127
5715.0000 -107.29862 -102.58316 4.71546 2.38383 -102.59096 869.12532
5720.0000 -106.83989 -102.01694 4.82295 2.37818 -102.66242 837.63600
5725.0000 -108.12287 -103.22766 4.89521 2.36335 -102.85009 830.48887
5730.0000 -107.85512 -103.14671 4.70841 2.34094 -103.13356 791.75121
5735.0000 -108.33168 -103.48322 4.84846 2.30637 -103.57096 769.99567
5740.0000 -107.14932 -102.97133 4.17800 2.36917 -102.77646 807.80997
5745.0000 -107.82484 -102.80933 5.01552 2.37441 -102.71013 842.86708
5750.0000 -105.91642 -100.93152 4.98490 2.44707 -101.79091 877.86024
MELTING PROCESS: loop number 24 T-loop= 907.00000000000000
main_MD> interactions number 24 at Temperature= 907.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.89325 1.39527 0.34715
force_rgl> df(natom) 0.66765 1.43165 0.13125
5755.0000 -107.28942 -102.36572 4.92370 2.45417 -101.70104 845.25896
5760.0000 -106.10761 -101.64082 4.46679 2.40653 -102.30379 813.52859
5765.0000 -106.88177 -101.75959 5.12217 2.47956 -101.37991 905.37448
5770.0000 -106.20498 -101.25938 4.94561 2.47032 -101.49671 874.16361
5775.0000 -106.61628 -102.35600 4.26028 2.40164 -102.36567 819.34414
5780.0000 -106.31668 -100.23618 6.08050 2.49060 -101.24015 945.54263
5785.0000 -105.35902 -101.03809 4.32093 2.55201 -100.46331 949.23418
5790.0000 -106.87737 -99.97195 6.90541 2.51484 -100.93349 946.36429
5795.0000 -107.10066 -100.91236 6.18830 2.50353 -101.07665 912.13095
5800.0000 -108.15592 -103.21788 4.93804 2.41314 -102.22024 902.19007
5805.0000 -106.52491 -101.45494 5.06997 2.39523 -102.44682 846.45072
5810.0000 -105.54372 -101.25499 4.28873 2.47051 -101.49434 919.33592
5815.0000 -106.81159 -101.04641 5.76518 2.50334 -101.07898 893.21554
5820.0000 -106.14173 -101.00715 5.13458 2.44709 -101.79069 850.50411
5825.0000 -105.64232 -99.65338 5.98894 2.55173 -100.46686 924.06998
5830.0000 -105.69360 -99.78178 5.91182 2.64731 -99.25757 986.65104
5835.0000 -105.52233 -99.88920 5.63313 2.60834 -99.75062 1004.55349
5840.0000 -107.04668 -101.85500 5.19168 2.52361 -100.82263 898.53032
5845.0000 -108.13132 -101.98097 6.15034 2.43580 -101.93346 865.73530
5850.0000 -108.43901 -102.70065 5.73835 2.41089 -102.24859 838.88320
5855.0000 -107.06375 -101.56085 5.50290 2.44145 -101.86206 913.08210
5860.0000 -106.44427 -101.43454 5.00973 2.44535 -101.81267 853.40825
5865.0000 -107.59733 -101.73352 5.86381 2.52769 -100.77097 964.51765
5870.0000 -106.53463 -100.38207 6.15256 2.50466 -101.06233 918.41986
5875.0000 -107.35361 -101.38007 5.97354 2.48917 -101.25827 887.01069
5880.0000 -106.39234 -100.43780 5.95453 2.51802 -100.89333 946.22554
5885.0000 -106.99350 -102.32481 4.66870 2.39626 -102.43371 846.47791
5890.0000 -107.57218 -100.87443 6.69775 2.40851 -102.27871 858.77824
5895.0000 -108.47657 -102.26285 6.21372 2.48531 -101.30710 905.67196
5900.0000 -106.91118 -101.28293 5.62825 2.42732 -102.04078 841.91622
5905.0000 -106.31210 -100.55030 5.76180 2.54305 -100.57658 906.19820
5910.0000 -106.67032 -101.34873 5.32159 2.49899 -101.13402 892.86381
5915.0000 -106.84234 -101.66115 5.18119 2.48249 -101.34274 928.63461
5920.0000 -105.39782 -100.76229 4.63553 2.51341 -100.95162 891.88120
5925.0000 -107.45552 -101.20794 6.24758 2.52365 -100.82202 940.33274
5930.0000 -106.74650 -101.54624 5.20027 2.48160 -101.35406 903.84603
5935.0000 -106.06452 -100.96755 5.09697 2.43865 -101.89747 845.12759
5940.0000 -107.07895 -102.38567 4.69327 2.43125 -101.99106 840.37580
5945.0000 -107.02186 -102.45525 4.56661 2.43036 -102.00237 837.36455
5950.0000 -107.64298 -101.59720 6.04577 2.43317 -101.96681 877.45199
5955.0000 -106.80649 -102.29074 4.51575 2.43963 -101.88501 881.57252
5960.0000 -105.85689 -101.29537 4.56152 2.42411 -102.08139 833.37660
5965.0000 -107.67568 -103.08482 4.59087 2.38566 -102.56780 817.85827
5970.0000 -107.93694 -101.91321 6.02374 2.37668 -102.68149 807.30183
5975.0000 -108.30642 -103.24697 5.05945 2.34428 -103.09137 777.42059
5980.0000 -107.42233 -103.30094 4.12139 2.29269 -103.74411 755.01565
5985.0000 -105.72670 -100.92223 4.80447 2.40616 -102.30853 822.24128
5990.0000 -107.55243 -101.60836 5.94407 2.47088 -101.48971 888.54374
5995.0000 -107.43228 -103.22220 4.21008 2.46412 -101.57526 912.00261
6000.0000 -106.38226 -102.21327 4.16899 2.34787 -103.04595 790.96947
MELTING PROCESS: loop number 25 T-loop= 932.00000000000000
main_MD> interactions number 25 at Temperature= 932.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.10063 3.35715 -2.37837
force_rgl> df(natom) 0.43507 -2.13134 7.02182
6005.0000 -106.63753 -101.50293 5.13460 2.51074 -100.98536 906.77761
6010.0000 -106.27582 -101.44812 4.82769 2.46953 -101.50680 889.63564
6015.0000 -105.97382 -101.00872 4.96509 2.46805 -101.52549 906.82383
6020.0000 -106.06250 -101.15251 4.90999 2.48807 -101.27224 901.38499
6025.0000 -106.93780 -100.69586 6.24194 2.52116 -100.85363 934.39806
6030.0000 -106.10572 -101.06773 5.03799 2.58021 -100.10651 961.23696
6035.0000 -106.74830 -100.78785 5.96045 2.56914 -100.24649 1005.08662
6040.0000 -104.68516 -99.53256 5.15260 2.61526 -99.66306 992.10631
6045.0000 -105.54090 -99.46409 6.07681 2.60612 -99.77874 997.29219
6050.0000 -106.20636 -100.48595 5.72042 2.56317 -100.32212 936.45541
6055.0000 -105.41482 -100.61647 4.79835 2.54419 -100.56225 921.52893
6060.0000 -108.26461 -102.65913 5.60548 2.45209 -101.72742 858.74060
6065.0000 -106.10583 -100.80042 5.30541 2.51102 -100.98180 928.80621
6070.0000 -106.59467 -100.52431 6.07037 2.56878 -100.25116 958.01656
6075.0000 -106.84270 -100.57468 6.26802 2.53794 -100.64127 941.39944
6080.0000 -106.20790 -100.35296 5.85494 2.51529 -100.92786 924.13924
6085.0000 -106.58891 -100.92645 5.66246 2.52916 -100.75242 946.05145
6090.0000 -107.22202 -102.05795 5.16407 2.47482 -101.43986 969.71598
6095.0000 -105.20063 -100.58696 4.61366 2.49603 -101.17148 947.58959
6100.0000 -104.80760 -99.57434 5.23326 2.59226 -99.95410 986.65600
6105.0000 -106.02789 -100.11504 5.91285 2.55550 -100.41906 925.43753
6110.0000 -107.00108 -101.46685 5.53422 2.49280 -101.21234 914.57567
6115.0000 -107.28943 -102.21364 5.07580 2.42355 -102.08845 823.38911
6120.0000 -106.27636 -101.99643 4.27994 2.46069 -101.61854 877.56581
6125.0000 -106.11729 -101.10177 5.01552 2.48399 -101.32386 903.43142
6130.0000 -105.28109 -100.59416 4.68693 2.53514 -100.67672 962.22922
6135.0000 -106.10898 -101.05015 5.05884 2.55198 -100.46366 973.99750
6140.0000 -107.62758 -103.00034 4.62724 2.45153 -101.73444 875.15200
6145.0000 -107.53115 -101.90694 5.62422 2.42888 -102.02101 894.32468
6150.0000 -105.52543 -99.40949 6.11593 2.47269 -101.46679 940.50454
6155.0000 -107.54845 -101.18193 6.36652 2.54583 -100.54148 955.43719
6160.0000 -106.74505 -100.60149 6.14356 2.51282 -100.95913 922.68469
6165.0000 -104.86380 -99.66150 5.20230 2.55003 -100.48831 954.91056
6170.0000 -105.54561 -98.78758 6.75802 2.58793 -100.00880 978.67123
6175.0000 -105.79597 -100.40274 5.39322 2.59382 -99.93425 1019.23199
6180.0000 -104.99348 -99.89219 5.10129 2.56146 -100.34374 1002.65972
6185.0000 -106.29428 -99.96061 6.33366 2.58045 -100.10347 966.49821
6190.0000 -106.20716 -100.34215 5.86501 2.52675 -100.78287 942.56214
6195.0000 -105.99029 -99.85514 6.13515 2.59935 -99.86431 988.09144
6200.0000 -105.96081 -98.88510 7.07571 2.59545 -99.91374 995.04959
6205.0000 -105.63070 -100.02977 5.60093 2.66410 -99.04521 1027.43088
6210.0000 -105.49542 -99.68745 5.80797 2.58526 -100.04261 984.33011
6215.0000 -106.89562 -101.56190 5.33373 2.55454 -100.43125 971.02195
6220.0000 -107.02453 -101.79193 5.23260 2.47692 -101.41332 884.19623
6225.0000 -106.28455 -100.44788 5.83667 2.48993 -101.24864 906.10135
6230.0000 -106.37667 -101.46664 4.91003 2.49845 -101.14084 839.46155
6235.0000 -105.91286 -100.46060 5.45226 2.48391 -101.32480 902.42741
6240.0000 -106.99092 -100.71125 6.27967 2.49677 -101.16215 927.63596
6245.0000 -105.84394 -101.10582 4.73811 2.50820 -101.01758 911.35003
6250.0000 -106.22156 -101.67295 4.54861 2.45007 -101.75294 857.43406
MELTING PROCESS: loop number 26 T-loop= 957.00000000000000
main_MD> interactions number 26 at Temperature= 957.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.64709 0.38962 -0.07558
force_rgl> df(natom) 2.82055 2.46582 -0.01749
6255.0000 -107.44475 -102.48056 4.96418 2.39298 -102.47523 839.85872
6260.0000 -106.13518 -101.08204 5.05314 2.48345 -101.33060 905.26288
6265.0000 -106.06425 -99.72354 6.34071 2.58058 -100.10183 960.85331
6270.0000 -106.86036 -100.52284 6.33752 2.53538 -100.67369 953.99803
6275.0000 -106.92919 -100.53016 6.39903 2.48243 -101.34355 913.18163
6280.0000 -106.42906 -99.28392 7.14514 2.49235 -101.21802 917.96305
6285.0000 -107.30436 -101.00546 6.29890 2.59846 -99.87559 995.48181
6290.0000 -104.82144 -99.10373 5.71770 2.52336 -100.82570 943.92027
6295.0000 -106.30361 -99.50137 6.80224 2.64815 -99.24699 1031.41940
6300.0000 -106.39061 -100.62242 5.76819 2.52807 -100.76610 956.32266
6305.0000 -104.48359 -98.51304 5.97055 2.65302 -99.18530 1049.67496
6310.0000 -104.97271 -99.64397 5.32874 2.63053 -99.46992 1045.69121
6315.0000 -105.45801 -99.98411 5.47390 2.57797 -100.13487 979.44377
6320.0000 -105.70930 -100.22400 5.48530 2.59171 -99.96100 1014.65162
6325.0000 -106.02155 -99.08477 6.93678 2.61667 -99.64527 1008.22362
6330.0000 -106.63916 -101.44750 5.19166 2.56966 -100.24000 953.47939
6335.0000 -105.76320 -100.42498 5.33822 2.49119 -101.23268 925.93423
6340.0000 -105.74194 -99.80778 5.93416 2.55710 -100.39891 967.02146
6345.0000 -105.96648 -99.56154 6.40494 2.58730 -100.01678 971.22027
6350.0000 -105.95007 -100.12123 5.82884 2.58953 -99.98860 1009.40985
6355.0000 -105.45770 -100.27572 5.18198 2.55649 -100.40662 943.51046
6360.0000 -106.75483 -101.66617 5.08866 2.50782 -101.02229 926.44233
6365.0000 -105.92710 -100.26740 5.65970 2.55993 -100.36307 968.40620
6370.0000 -106.40119 -99.86243 6.53876 2.58181 -100.08626 1002.27620
6375.0000 -106.25669 -100.22331 6.03338 2.62395 -99.55314 1037.49616
6380.0000 -106.06347 -99.93518 6.12829 2.58421 -100.05593 973.10580
6385.0000 -105.81938 -100.48113 5.33825 2.54969 -100.49257 952.78781
6390.0000 -106.62039 -101.85591 4.76449 2.49175 -101.22564 888.34557
6395.0000 -105.20843 -99.95617 5.25225 2.51488 -100.93303 955.00875
6400.0000 -106.60149 -99.98102 6.62047 2.60415 -99.80362 1026.48491
6405.0000 -105.20377 -100.37357 4.83020 2.56908 -100.24731 991.51833
6410.0000 -104.62734 -99.66151 4.96583 2.63521 -99.41073 1043.68211
6415.0000 -106.06293 -98.54152 7.52141 2.70635 -98.51070 1078.63415
6420.0000 -105.79432 -99.54571 6.24861 2.61989 -99.60453 995.03388
6425.0000 -106.47174 -100.95593 5.51581 2.56616 -100.28426 939.95312
6430.0000 -106.07394 -100.55220 5.52174 2.58620 -100.03070 962.70408
6435.0000 -105.67071 -99.95309 5.71762 2.55594 -100.41358 955.59995
6440.0000 -105.53893 -99.99740 5.54153 2.60086 -99.84530 967.38205
6445.0000 -106.10795 -100.63278 5.47516 2.54698 -100.52687 959.73245
6450.0000 -106.41416 -100.05602 6.35814 2.53836 -100.63600 932.77305
6455.0000 -105.93750 -100.09420 5.84330 2.67560 -98.89967 1086.58030
6460.0000 -106.07123 -99.27911 6.79212 2.60229 -99.82717 994.09373
6465.0000 -106.30508 -100.43910 5.86598 2.55054 -100.48184 941.03646
6470.0000 -106.91086 -101.58083 5.33003 2.53680 -100.65576 956.07934
6475.0000 -106.21141 -100.34751 5.86390 2.53906 -100.62710 989.56382
6480.0000 -105.59492 -99.40291 6.19201 2.59176 -99.96035 1022.25867
6485.0000 -106.11928 -100.67420 5.44508 2.53901 -100.62769 942.86324
6490.0000 -106.93420 -102.09935 4.83485 2.50274 -101.08664 908.66921
6495.0000 -107.93988 -104.00681 3.93307 2.41408 -102.20833 843.97072
6500.0000 -106.24876 -100.64570 5.60306 2.46170 -101.60584 921.02436
MELTING PROCESS: loop number 27 T-loop= 982.00000000000000
main_MD> interactions number 27 at Temperature= 982.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.41119 -1.88181 1.02458
force_rgl> df(natom) 1.81628 0.34130 -0.88422
6505.0000 -104.76349 -99.05905 5.70444 2.58509 -100.04478 1014.59285
6510.0000 -106.18752 -100.66884 5.51868 2.62889 -99.49062 1053.24469
6515.0000 -105.81627 -99.48425 6.33202 2.60906 -99.74150 1008.89292
6520.0000 -105.71375 -99.81814 5.89561 2.60141 -99.83827 997.79610
6525.0000 -105.66470 -100.80720 4.85750 2.58248 -100.07777 938.58487
6530.0000 -106.05440 -100.18029 5.87411 2.63599 -99.40081 1037.58932
6535.0000 -106.93151 -101.09858 5.83293 2.59185 -99.95923 978.09030
6540.0000 -106.77470 -101.68135 5.09335 2.50175 -101.09916 917.61385
6545.0000 -104.48285 -98.45093 6.03192 2.68829 -98.73915 1055.62878
6550.0000 -104.30758 -99.32449 4.98309 2.66479 -99.03641 1057.35607
6555.0000 -104.01532 -99.35671 4.65861 2.66125 -99.08121 1028.23235
6560.0000 -105.91341 -100.87948 5.03392 2.58666 -100.02489 956.56821
6565.0000 -105.50329 -98.93262 6.57067 2.59503 -99.91901 1006.55034
6570.0000 -104.15859 -98.11374 6.04484 2.70976 -98.46753 1081.80818
6575.0000 -106.46135 -99.63479 6.82656 2.65125 -99.20777 1043.75897
6580.0000 -104.17551 -98.40517 5.77034 2.65524 -99.15723 1050.00411
6585.0000 -106.86281 -101.39605 5.46676 2.54624 -100.53621 966.17957
6590.0000 -105.55674 -99.68601 5.87073 2.56532 -100.29493 938.75677
6595.0000 -105.25757 -99.57556 5.68201 2.64031 -99.34615 1030.19674
6600.0000 -105.06208 -98.67341 6.38866 2.63947 -99.35671 1022.17376
6605.0000 -104.43690 -98.04133 6.39557 2.78894 -97.46569 1144.12486
6610.0000 -106.11380 -100.25306 5.86074 2.61626 -99.65044 1017.38894
6615.0000 -105.82216 -100.34669 5.47547 2.57000 -100.23566 989.40954
6620.0000 -106.23331 -100.34974 5.88357 2.54589 -100.54073 952.52998
6625.0000 -104.91948 -100.03794 4.88154 2.56773 -100.26436 978.10549
6630.0000 -104.78936 -99.11536 5.67400 2.61458 -99.67167 1031.28504
6635.0000 -107.29210 -101.32622 5.96587 2.55594 -100.41355 990.01467
6640.0000 -106.07674 -101.16797 4.90877 2.40587 -102.31219 836.54261
6645.0000 -105.49143 -99.52361 5.96782 2.55461 -100.43035 950.81448
6650.0000 -105.50351 -99.64782 5.85570 2.63819 -99.37302 1012.65126
6655.0000 -104.99881 -98.66157 6.33724 2.65073 -99.21435 1023.18965
6660.0000 -107.72350 -101.60377 6.11973 2.58815 -100.00607 1008.69868
6665.0000 -106.59201 -101.48695 5.10506 2.46793 -101.52705 925.65437
6670.0000 -105.61381 -99.33943 6.27438 2.56452 -100.30502 986.19189
6675.0000 -105.25181 -99.73194 5.51987 2.57740 -100.14203 940.80145
6680.0000 -105.45147 -98.74454 6.70693 2.70389 -98.54172 1040.96125
6685.0000 -105.01203 -99.68899 5.32305 2.65681 -99.13745 1028.13503
6690.0000 -105.01775 -98.76473 6.25303 2.60814 -99.75317 988.97304
6695.0000 -106.44925 -99.72905 6.72020 2.64631 -99.27023 1046.23912
6700.0000 -105.05020 -98.91456 6.13564 2.65016 -99.22151 1013.00196
6705.0000 -105.58038 -100.08377 5.49661 2.62410 -99.55123 997.15878
6710.0000 -104.68480 -99.28463 5.40017 2.62100 -99.59044 1010.09814
6715.0000 -105.35741 -100.30397 5.05344 2.61715 -99.63917 984.48351
6720.0000 -105.62099 -99.45263 6.16836 2.61135 -99.71259 984.82031
6725.0000 -105.74891 -99.74257 6.00634 2.65725 -99.13187 996.88051
6730.0000 -106.02024 -100.67128 5.34896 2.55054 -100.48182 913.30284
6735.0000 -103.53826 -98.68271 4.85555 2.55460 -100.43050 963.81954
6740.0000 -106.09558 -100.95224 5.14334 2.54992 -100.48967 940.88077
6745.0000 -105.34915 -99.81584 5.53331 2.54804 -100.51347 939.69673
6750.0000 -106.36663 -101.15344 5.21319 2.56139 -100.34456 967.92092
MELTING PROCESS: loop number 28 T-loop= 1007.0000000000000
main_MD> interactions number 28 at Temperature= 1007.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 5.75174 -2.97101 -1.22237
force_rgl> df(natom) -2.11037 -3.24457 1.79440
6755.0000 -106.20598 -100.18968 6.01631 2.50503 -101.05767 927.35711
6760.0000 -105.59014 -100.49496 5.09518 2.60554 -99.78607 1019.52700
6765.0000 -105.64919 -98.57990 7.06930 2.59689 -99.89548 1017.15883
6770.0000 -105.22423 -98.94926 6.27498 2.66710 -99.00717 1057.21264
6775.0000 -105.12349 -98.96024 6.16325 2.65166 -99.20260 988.03918
6780.0000 -103.81985 -98.14363 5.67623 2.70137 -98.57362 1044.86207
6785.0000 -104.81458 -99.57424 5.24034 2.63868 -99.36680 1019.94060
6790.0000 -105.37464 -100.76048 4.61416 2.58527 -100.04248 960.62331
6795.0000 -105.84170 -100.25778 5.58392 2.59422 -99.92926 979.72405
6800.0000 -105.03158 -98.60955 6.42202 2.59725 -99.89094 1000.47058
6805.0000 -104.57587 -99.66456 4.91131 2.64481 -99.28920 1046.08259
6810.0000 -105.29613 -98.90519 6.39094 2.59095 -99.97059 944.84090
6815.0000 -104.75662 -99.58616 5.17047 2.62432 -99.54839 1034.41716
6820.0000 -106.45367 -101.00107 5.45260 2.59944 -99.86327 956.47768
6825.0000 -106.56183 -101.17817 5.38366 2.54456 -100.55750 950.16836
6830.0000 -107.38429 -101.03092 6.35337 2.52983 -100.74393 952.72993
6835.0000 -104.96019 -100.32246 4.63773 2.52165 -100.84732 935.42650
6840.0000 -106.00928 -100.09603 5.91325 2.60539 -99.78789 1019.88292
6845.0000 -104.11574 -98.80219 5.31356 2.67424 -98.91682 1057.07161
6850.0000 -105.54111 -99.89958 5.64152 2.64303 -99.31173 1025.69301
6855.0000 -106.81233 -99.56467 7.24765 2.53491 -100.67962 963.41879
6860.0000 -106.42396 -100.33770 6.08626 2.59905 -99.86818 989.07301
6865.0000 -106.66070 -101.51016 5.15054 2.53815 -100.63865 926.28738
6870.0000 -106.95689 -101.47629 5.48060 2.42754 -102.03794 899.44388
6875.0000 -107.63706 -101.92938 5.70768 2.45101 -101.74112 906.94292
6880.0000 -106.94798 -100.88899 6.05900 2.48688 -101.28728 897.24831
6885.0000 -103.94685 -98.65156 5.29529 2.63631 -99.39679 1026.53659
6890.0000 -105.83483 -99.18440 6.65043 2.64613 -99.27249 1053.86675
6895.0000 -106.14208 -100.32116 5.82092 2.64618 -99.27183 1027.03422
6900.0000 -105.25754 -100.41353 4.84401 2.57365 -100.18952 978.58875
6905.0000 -105.33840 -100.14108 5.19732 2.61336 -99.68711 991.54420
6910.0000 -105.65810 -99.85307 5.80503 2.62577 -99.53006 1039.24070
6915.0000 -106.90240 -101.01476 5.88764 2.58146 -100.09066 1007.24394
6920.0000 -106.53512 -100.65973 5.87539 2.54920 -100.49887 934.92458
6925.0000 -106.47356 -101.04170 5.43186 2.49471 -101.18815 858.48414
6930.0000 -106.50466 -101.15072 5.35394 2.47685 -101.41422 898.78681
6935.0000 -105.65321 -99.14891 6.50430 2.60637 -99.77559 1003.35926
6940.0000 -107.26815 -102.28896 4.97919 2.53517 -100.67634 977.87431
6945.0000 -105.85487 -100.83986 5.01500 2.46158 -101.60740 881.54355
6950.0000 -105.75821 -100.02877 5.72945 2.61430 -99.67523 1006.07988
6955.0000 -104.94179 -98.61963 6.32216 2.56828 -100.25737 921.65611
6960.0000 -104.96209 -99.05483 5.90727 2.67595 -98.89519 1028.05285
6965.0000 -104.42015 -98.74811 5.67204 2.67274 -98.93592 1020.69877
6970.0000 -104.93038 -98.07820 6.85217 2.65131 -99.20693 1001.45108
6975.0000 -104.97499 -98.53793 6.43706 2.68668 -98.75947 1101.92229
6980.0000 -105.73289 -99.36520 6.36769 2.67671 -98.88557 1079.20443
6985.0000 -106.24768 -100.55999 5.68769 2.54288 -100.57882 975.57168
6990.0000 -104.48358 -98.66964 5.81394 2.62844 -99.49626 996.39301
6995.0000 -104.47590 -97.96710 6.50880 2.75645 -97.87683 1129.30220
7000.0000 -104.63808 -98.49663 6.14145 2.71042 -98.45919 1058.27011
MELTING PROCESS: loop number 29 T-loop= 1032.0000000000000
main_MD> interactions number 29 at Temperature= 1032.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.38114 -0.75566 0.07045
force_rgl> df(natom) 0.65983 7.86824 -1.35391
7005.0000 -104.26024 -98.49523 5.76501 2.73099 -98.19891 1113.25596
7010.0000 -106.48204 -100.22427 6.25777 2.65230 -99.19443 1037.78780
7015.0000 -105.97397 -99.42070 6.55327 2.67575 -98.89773 1003.56372
7020.0000 -105.07302 -98.70757 6.36545 2.62995 -99.47727 994.45099
7025.0000 -104.82322 -100.12089 4.70233 2.69713 -98.62733 1101.38755
7030.0000 -104.74554 -99.66503 5.08051 2.59896 -99.86931 964.62944
7035.0000 -103.61843 -97.63588 5.98256 2.76897 -97.71847 1087.03972
7040.0000 -106.23377 -100.23526 5.99851 2.67250 -98.93889 1045.50405
7045.0000 -106.55431 -100.08394 6.47037 2.54316 -100.57522 985.84210
7050.0000 -105.65642 -100.92799 4.72842 2.55503 -100.42510 985.35983
7055.0000 -106.66335 -102.03811 4.62525 2.48293 -101.33726 896.90261
7060.0000 -106.80681 -100.23678 6.57003 2.49527 -101.18112 944.57751
7065.0000 -107.01361 -100.98158 6.03203 2.55071 -100.47969 968.28565
7070.0000 -106.97473 -101.78478 5.18995 2.50443 -101.06517 942.05856
7075.0000 -106.58900 -101.29355 5.29545 2.56522 -100.29615 979.26877
7080.0000 -106.87666 -100.98899 5.88766 2.51105 -100.98153 962.05282
7085.0000 -107.02708 -101.95415 5.07293 2.52597 -100.79273 951.66564
7090.0000 -106.98814 -101.68928 5.29886 2.45433 -101.69911 826.22706
7095.0000 -105.31264 -99.18533 6.12730 2.56692 -100.27466 987.45104
7100.0000 -104.37482 -99.24192 5.13291 2.67796 -98.86976 1070.46677
7105.0000 -105.79935 -99.50314 6.29621 2.59030 -99.97879 941.43491
7110.0000 -105.85966 -99.15987 6.69978 2.67822 -98.86652 1004.46645
7115.0000 -105.05069 -99.45636 5.59433 2.63650 -99.39433 985.86996
7120.0000 -105.38679 -100.06719 5.31961 2.58511 -100.04450 979.86114
7125.0000 -105.37635 -98.26225 7.11410 2.63291 -99.43979 980.12828
7130.0000 -104.69310 -100.01151 4.68158 2.71437 -98.40912 1110.65080
7135.0000 -106.41199 -99.96176 6.45023 2.59161 -99.96229 967.62577
7140.0000 -105.87174 -100.14775 5.72400 2.59351 -99.93824 966.46443
7145.0000 -104.18670 -98.56314 5.62356 2.66309 -99.05796 1033.36421
7150.0000 -104.70580 -99.07644 5.62936 2.65938 -99.10492 1039.62512
7155.0000 -105.40955 -98.86164 6.54791 2.76962 -97.71012 1151.91823
7160.0000 -106.03508 -99.41130 6.62378 2.67086 -98.95958 1056.79167
7165.0000 -104.01574 -96.97846 7.03728 2.78614 -97.50113 1128.39656
7170.0000 -106.00785 -100.63549 5.37236 2.64458 -99.29217 1011.66457
7175.0000 -105.05605 -100.97085 4.08519 2.50687 -101.03442 889.21289
7180.0000 -105.13271 -99.90798 5.22473 2.58186 -100.08560 980.18883
7185.0000 -105.50706 -100.27641 5.23065 2.60079 -99.84616 1045.49151
7190.0000 -104.51601 -99.58340 4.93262 2.60215 -99.82896 951.02056
7195.0000 -104.58819 -99.15242 5.43577 2.60660 -99.77259 945.54093
7200.0000 -106.84626 -100.86940 5.97686 2.50481 -101.06041 928.64721
7205.0000 -107.53310 -101.52566 6.00744 2.49555 -101.17757 940.05397
7210.0000 -106.38046 -101.39921 4.98125 2.52469 -100.80893 957.77718
7215.0000 -105.00433 -99.52091 5.48342 2.59155 -99.96297 992.85621
7220.0000 -103.89897 -98.02111 5.87786 2.69460 -98.65931 1055.85561
7225.0000 -105.08356 -98.05115 7.03241 2.69976 -98.59400 1077.22331
7230.0000 -105.03980 -98.58906 6.45074 2.75063 -97.95038 1076.58056
7235.0000 -105.52652 -100.46420 5.06232 2.65834 -99.11804 1036.24128
7240.0000 -105.16188 -97.86914 7.29274 2.67023 -98.96765 1048.83754
7245.0000 -103.93225 -97.68079 6.25146 2.77543 -97.63664 1156.50415
7250.0000 -106.15128 -98.42472 7.72655 2.67703 -98.88156 1068.31091
MELTING PROCESS: loop number 30 T-loop= 1057.0000000000000
main_MD> interactions number 30 at Temperature= 1057.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -2.36412 -1.27593 1.41055
force_rgl> df(natom) -0.85745 -4.19471 -5.50871
7255.0000 -104.85642 -100.48874 4.36768 2.62349 -99.55892 1058.43580
7260.0000 -105.85316 -99.29905 6.55410 2.57664 -100.15168 975.26867
7265.0000 -105.84070 -99.80360 6.03711 2.63904 -99.36215 1077.82672
7270.0000 -105.32713 -99.63040 5.69672 2.64358 -99.30477 1023.71211
7275.0000 -105.31053 -99.13777 6.17275 2.63641 -99.39552 1039.24706
7280.0000 -105.44589 -99.12413 6.32176 2.65441 -99.16771 1063.16023
7285.0000 -104.82957 -97.27269 7.55688 2.71431 -98.40997 1114.25137
7290.0000 -104.52489 -98.39349 6.13140 2.71545 -98.39548 1089.48426
7295.0000 -103.83242 -97.72947 6.10295 2.66951 -98.97671 1057.64030
7300.0000 -105.66037 -99.95691 5.70346 2.61420 -99.67643 1005.67967
7305.0000 -102.73978 -97.88593 4.85386 2.68184 -98.82069 1055.50256
7310.0000 -104.47215 -97.45274 7.01941 2.79064 -97.44427 1150.27746
7315.0000 -104.53535 -97.16501 7.37034 2.77754 -97.61003 1145.58567
7320.0000 -104.70377 -97.84499 6.85878 2.80130 -97.30942 1138.10119
7325.0000 -106.23612 -100.10603 6.13009 2.66868 -98.98725 1049.05733
7330.0000 -104.60788 -97.80372 6.80417 2.71273 -98.42988 1109.20990
7335.0000 -103.02970 -96.68938 6.34032 2.80965 -97.20375 1139.14247
7340.0000 -103.51908 -96.23649 7.28259 2.82585 -96.99878 1195.50670
7345.0000 -103.50908 -96.68038 6.82870 2.88495 -96.25108 1214.16375
7350.0000 -103.33899 -97.12510 6.21389 2.84923 -96.70303 1203.61036
7355.0000 -105.74430 -99.76680 5.97750 2.68091 -98.83254 1061.97228
7360.0000 -106.33840 -98.10001 8.23839 2.69008 -98.71645 1087.31896
7365.0000 -105.70813 -100.15549 5.55264 2.69857 -98.60902 1085.22575
7370.0000 -105.79022 -99.32276 6.46747 2.62781 -99.50430 1042.05988
7375.0000 -106.18300 -100.39266 5.79034 2.62550 -99.53352 979.23683
7380.0000 -105.40477 -99.48414 5.92063 2.58323 -100.06828 981.82726
7385.0000 -106.84965 -101.09552 5.75412 2.56963 -100.24036 975.59024
7390.0000 -105.80967 -99.89105 5.91862 2.53046 -100.73592 942.82249
7395.0000 -106.46712 -101.07655 5.39056 2.56478 -100.30166 1012.04986
7400.0000 -104.94306 -98.33784 6.60522 2.58700 -100.02065 995.63398
7405.0000 -104.40843 -98.69460 5.71383 2.67981 -98.84644 1083.67959
7410.0000 -105.09620 -99.58201 5.51419 2.66635 -99.01674 1056.73412
7415.0000 -105.55620 -100.10859 5.44760 2.63349 -99.43237 1011.97066
7420.0000 -105.18519 -99.93163 5.25356 2.60120 -99.84090 982.67943
7425.0000 -106.23345 -99.97918 6.25427 2.55703 -100.39976 965.19841
7430.0000 -106.95724 -100.66445 6.29279 2.57169 -100.21429 952.08204
7435.0000 -105.66843 -98.87177 6.79666 2.56867 -100.25250 981.26429
7440.0000 -104.23358 -98.06419 6.16939 2.69384 -98.66895 1074.50492
7445.0000 -104.31469 -97.92523 6.38946 2.72823 -98.23388 1120.99717
7450.0000 -105.00966 -99.65776 5.35190 2.68110 -98.83013 1085.15008
7455.0000 -103.94723 -97.52958 6.41765 2.71785 -98.36518 1112.72740
7460.0000 -103.33959 -97.50308 5.83651 2.82931 -96.95496 1186.54148
7465.0000 -106.01039 -98.73275 7.27764 2.76892 -97.71900 1111.68425
7470.0000 -105.41226 -98.80366 6.60860 2.72164 -98.31722 1122.38913
7475.0000 -104.90448 -99.50559 5.39888 2.69253 -98.68551 1061.95774
7480.0000 -106.67588 -101.59365 5.08223 2.57885 -100.12368 984.20580
7485.0000 -106.76171 -101.63607 5.12563 2.49252 -101.21593 912.99008
7490.0000 -105.68024 -100.29795 5.38229 2.56408 -100.31057 896.49223
7495.0000 -104.78835 -99.70190 5.08645 2.58882 -99.99762 967.23940
7500.0000 -105.55739 -99.17932 6.37808 2.67703 -98.88155 1053.55210
MELTING PROCESS: loop number 31 T-loop= 1082.0000000000000
main_MD> interactions number 31 at Temperature= 1082.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 4.46375 4.29974 2.94044
force_rgl> df(natom) -5.33223 2.83501 -6.84961
7505.0000 -105.60195 -99.98324 5.61871 2.60751 -99.76108 982.54475
7510.0000 -104.26491 -98.21437 6.05054 2.64565 -99.27858 1005.05846
7515.0000 -105.25285 -99.47961 5.77323 2.65394 -99.17364 1029.12053
7520.0000 -104.04361 -97.04874 6.99487 2.74411 -98.03286 1110.36121
7525.0000 -104.14067 -97.01479 7.12588 2.78409 -97.52707 1156.11484
7530.0000 -102.81382 -96.18634 6.62748 2.81963 -97.07753 1176.98719
7535.0000 -103.89198 -97.00612 6.88587 2.86384 -96.51819 1254.39369
7540.0000 -104.59060 -96.49914 8.09146 2.90274 -96.02604 1207.74697
7545.0000 -104.12305 -97.49168 6.63137 2.86026 -96.56341 1192.68188
7550.0000 -104.90828 -97.05424 7.85404 2.79147 -97.43378 1146.42020
7555.0000 -104.52195 -98.72620 5.79575 2.71998 -98.33817 1119.59544
7560.0000 -105.83181 -99.33710 6.49471 2.66367 -99.05057 1043.03381
7565.0000 -105.23143 -99.52190 5.70953 2.62589 -99.52863 1005.32244
7570.0000 -105.32100 -99.59232 5.72868 2.61103 -99.71660 1026.51310
7575.0000 -104.33432 -100.30805 4.02627 2.56043 -100.35673 973.94849
7580.0000 -103.75498 -97.71564 6.03934 2.65685 -99.13686 1058.92012
7585.0000 -105.91767 -98.99202 6.92566 2.71285 -98.42840 1081.93683
7590.0000 -105.90421 -99.07205 6.83216 2.67005 -98.96985 1047.42187
7595.0000 -104.25861 -98.64790 5.61072 2.64383 -99.30166 1009.84608
7600.0000 -105.93301 -98.40111 7.53190 2.73066 -98.20314 1121.54189
7605.0000 -106.67512 -101.16059 5.51453 2.53834 -100.63621 981.33377
7610.0000 -104.20690 -96.36399 7.84291 2.73229 -98.18243 1106.48743
7615.0000 -104.03532 -96.66967 7.36564 2.85968 -96.57081 1188.39343
7620.0000 -105.91766 -98.77583 7.14183 2.75226 -97.92986 1133.14013
7625.0000 -104.85128 -97.34899 7.50229 2.74336 -98.04236 1087.81767
7630.0000 -105.05080 -98.28032 6.77047 2.72766 -98.24102 1105.25148
7635.0000 -104.73979 -98.56863 6.17117 2.67057 -98.96337 1032.61300
7640.0000 -105.53737 -99.97117 5.56620 2.61874 -99.61906 1003.64927
7645.0000 -103.87130 -98.23787 5.63343 2.65406 -99.17223 985.39801
7650.0000 -105.39991 -97.99297 7.40694 2.70854 -98.48287 1087.85041
7655.0000 -102.64606 -95.87585 6.77021 2.82178 -97.05029 1175.74048
7660.0000 -104.38899 -98.00465 6.38434 2.85548 -96.62393 1259.84059
7665.0000 -104.77489 -98.41410 6.36079 2.73562 -98.14031 1120.31849
7670.0000 -105.34968 -99.48189 5.86778 2.64373 -99.30293 1065.41724
7675.0000 -105.94905 -97.65315 8.29590 2.73206 -98.18535 1146.71558
7680.0000 -104.70905 -98.97620 5.73284 2.73916 -98.09558 1123.64729
7685.0000 -103.83722 -97.27822 6.55900 2.69994 -98.59170 1075.04178
7690.0000 -103.57386 -98.36263 5.21122 2.82456 -97.01516 1151.18636
7695.0000 -104.68821 -99.14486 5.54335 2.71262 -98.43136 1100.29277
7700.0000 -104.55425 -98.33285 6.22140 2.69556 -98.64720 1078.21192
7705.0000 -103.78455 -98.30525 5.47930 2.73493 -98.14902 1087.27416
7710.0000 -104.82948 -98.10280 6.72668 2.73203 -98.18581 1110.53994
7715.0000 -104.66631 -98.41661 6.24970 2.74383 -98.03650 1114.45565
7720.0000 -103.23218 -97.51194 5.72025 2.75055 -97.95147 1103.23984
7725.0000 -104.94758 -96.76132 8.18626 2.76271 -97.79755 1151.80493
7730.0000 -104.21103 -98.07764 6.13339 2.70631 -98.51115 1083.57035
7735.0000 -103.85774 -97.49137 6.36637 2.78620 -97.50040 1125.53193
7740.0000 -102.30820 -94.90647 7.40173 2.94589 -95.48008 1298.88412
7745.0000 -102.93836 -96.49648 6.44189 2.94914 -95.43903 1183.92687
7750.0000 -104.44720 -96.97075 7.47645 2.87920 -96.32381 1163.79225
MELTING PROCESS: loop number 32 T-loop= 1107.0000000000000
main_MD> interactions number 32 at Temperature= 1107.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.80299 -0.16371 0.04093
force_rgl> df(natom) -0.15784 0.49780 3.31650
7755.0000 -104.72707 -96.96456 7.76251 2.86150 -96.54772 1204.63694
7760.0000 -104.28004 -98.11858 6.16146 2.81605 -97.12282 1142.22731
7765.0000 -104.42579 -97.60313 6.82266 2.70593 -98.51592 1096.60573
7770.0000 -104.80926 -96.70059 8.10868 2.81403 -97.14830 1177.69119
7775.0000 -105.10447 -99.23308 5.87139 2.73788 -98.11172 1104.63533
7780.0000 -103.90436 -96.95752 6.94684 2.74534 -98.01735 1112.81933
7785.0000 -103.24367 -96.62791 6.61576 2.76636 -97.75143 1081.43070
7790.0000 -105.26959 -99.18180 6.08779 2.72061 -98.33022 1096.70685
7795.0000 -103.82892 -96.81588 7.01303 2.73026 -98.20810 1161.85905
7800.0000 -104.42418 -98.21035 6.21383 2.75853 -97.85046 1133.55681
7805.0000 -103.80695 -96.23024 7.57671 2.78126 -97.56288 1117.88280
7810.0000 -103.68697 -97.93946 5.74751 2.72014 -98.33615 1080.57754
7815.0000 -104.03936 -98.05433 5.98502 2.73541 -98.14304 1126.34587
7820.0000 -104.64928 -97.97219 6.67708 2.76038 -97.82709 1114.96707
7825.0000 -103.97624 -97.78159 6.19465 2.72053 -98.33120 1071.32872
7830.0000 -102.85459 -96.90936 5.94523 2.84342 -96.77655 1165.63394
7835.0000 -106.16738 -99.62039 6.54698 2.74616 -98.00698 1094.24222
7840.0000 -105.07700 -99.42616 5.65084 2.55747 -100.39418 978.58775
7845.0000 -104.44144 -97.86049 6.58095 2.64825 -99.24566 1041.03355
7850.0000 -104.94969 -97.90972 7.03997 2.73431 -98.15693 1092.42746
7855.0000 -105.01262 -99.36037 5.65224 2.67666 -98.88624 1032.03242
7860.0000 -105.26848 -99.30489 5.96360 2.66618 -99.01883 1077.84150
7865.0000 -105.00685 -97.55419 7.45266 2.67374 -98.92318 1093.14125
7870.0000 -102.36163 -96.29000 6.07164 2.79151 -97.43328 1164.88545
7875.0000 -105.49489 -99.64931 5.84558 2.74248 -98.05349 1057.46349
7880.0000 -105.04567 -98.63606 6.40961 2.67671 -98.88561 1061.79741
7885.0000 -104.66434 -97.95277 6.71157 2.69194 -98.69290 1049.41380
7890.0000 -103.89281 -97.33611 6.55670 2.84042 -96.81449 1160.86723
7895.0000 -103.60361 -96.24056 7.36305 2.83611 -96.86893 1176.36205
7900.0000 -103.90958 -97.22762 6.68196 2.85165 -96.67239 1206.31344
7905.0000 -102.51874 -96.00836 6.51038 2.84755 -96.72419 1176.82216
7910.0000 -103.27323 -96.51056 6.76268 2.91216 -95.90690 1257.78080
7915.0000 -101.65953 -95.33459 6.32493 2.86307 -96.52795 1203.72468
7920.0000 -104.38305 -97.64782 6.73522 2.83889 -96.83382 1100.78343
7925.0000 -105.31004 -99.30029 6.00975 2.73253 -98.17943 1086.77965
7930.0000 -104.34026 -97.65953 6.68073 2.71498 -98.40142 1140.98775
7935.0000 -104.61818 -97.97684 6.64135 2.76147 -97.81330 1098.53656
7940.0000 -105.75238 -99.45873 6.29365 2.64344 -99.30650 1077.44095
7945.0000 -104.52199 -98.75329 5.76870 2.66538 -99.02902 1074.75038
7950.0000 -107.03413 -100.69593 6.33820 2.66491 -99.03486 1062.27177
7955.0000 -106.69793 -99.74082 6.95711 2.56362 -100.31633 1001.93846
7960.0000 -106.00831 -100.09947 5.90884 2.61126 -99.71371 997.60243
7965.0000 -104.75156 -97.93410 6.81746 2.63048 -99.47052 1015.94980
7970.0000 -104.66226 -99.15781 5.50446 2.71114 -98.45007 1092.27471
7975.0000 -107.37226 -101.45252 5.91974 2.58953 -99.98858 994.03662
7980.0000 -103.34878 -97.16641 6.18236 2.68941 -98.72493 1069.95647
7985.0000 -102.99271 -96.37429 6.61842 2.75546 -97.88926 1095.14808
7990.0000 -105.43339 -97.54683 7.88656 2.77424 -97.65177 1094.07784
7995.0000 -105.54809 -99.02125 6.52684 2.76295 -97.79460 1124.16404
8000.0000 -105.67300 -99.17394 6.49905 2.69610 -98.64037 1068.29255
MELTING PROCESS: loop number 33 T-loop= 1132.0000000000000
main_MD> interactions number 33 at Temperature= 1132.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.57182 -0.26885 4.80314
force_rgl> df(natom) -2.62455 -0.27021 -0.57981
8005.0000 -105.76092 -99.51071 6.25022 2.66333 -99.05486 1025.59088
8010.0000 -105.03658 -99.12552 5.91105 2.65153 -99.20413 1024.23611
8015.0000 -105.60763 -98.39753 7.21010 2.72032 -98.33393 1103.74897
8020.0000 -104.09648 -97.23461 6.86187 2.77832 -97.60013 1129.56196
8025.0000 -102.69593 -95.06314 7.63279 2.84497 -96.75686 1208.43280
8030.0000 -101.91184 -95.52894 6.38290 3.01884 -94.55715 1286.12224
8035.0000 -105.06980 -98.10074 6.96907 2.79582 -97.37869 1139.41705
8040.0000 -105.91035 -98.84449 7.06586 2.64196 -99.32526 1102.42441
8045.0000 -103.25399 -96.19596 7.05803 2.75224 -97.93007 1185.41329
8050.0000 -103.25814 -96.67393 6.58421 2.85966 -96.57109 1185.30037
8055.0000 -103.16033 -97.01548 6.14485 2.82672 -96.98773 1144.79864
8060.0000 -105.95396 -97.85556 8.09840 2.81151 -97.18016 1146.19210
8065.0000 -104.91579 -97.67451 7.24128 2.71254 -98.43229 1079.41884
8070.0000 -103.95458 -98.20587 5.74871 2.68545 -98.77506 1096.81701
8075.0000 -105.29291 -98.96298 6.32993 2.74071 -98.07589 1085.25218
8080.0000 -103.94407 -98.04217 5.90190 2.73119 -98.19642 1099.80157
8085.0000 -104.84528 -98.70742 6.13787 2.75001 -97.95823 1119.55896
8090.0000 -102.96204 -97.47206 5.48998 2.75001 -97.95824 1139.30679
8095.0000 -105.02718 -98.91565 6.11153 2.66464 -99.03832 1029.03076
8100.0000 -104.11779 -97.60219 6.51560 2.75013 -97.95677 1141.05891
8105.0000 -104.29794 -97.39132 6.90662 2.79154 -97.43285 1163.47890
8110.0000 -105.91512 -98.91552 6.99960 2.79649 -97.37028 1162.79870
8115.0000 -104.34840 -97.16683 7.18157 2.82409 -97.02112 1151.69090
8120.0000 -103.53902 -97.02223 6.51679 2.83331 -96.90436 1143.01744
8125.0000 -104.66360 -98.41198 6.25162 2.78913 -97.46329 1140.18233
8130.0000 -104.48939 -96.83684 7.65255 2.78672 -97.49378 1130.52322
8135.0000 -104.81467 -98.80623 6.00845 2.74474 -98.02490 1124.72209
8140.0000 -105.58957 -98.87151 6.71807 2.64185 -99.32664 1029.89518
8145.0000 -105.31849 -97.68753 7.63096 2.72108 -98.32432 1138.24881
8150.0000 -103.62824 -97.50177 6.12647 2.80335 -97.28346 1170.81189
8155.0000 -102.60641 -96.98399 5.62242 2.89167 -96.16603 1189.05990
8160.0000 -103.32537 -96.85458 6.47079 2.79630 -97.37270 1160.52986
8165.0000 -103.46067 -96.64964 6.81103 2.89361 -96.14156 1224.00428
8170.0000 -104.31219 -97.98508 6.32710 2.83453 -96.88901 1193.23262
8175.0000 -105.76607 -98.65547 7.11059 2.68370 -98.79722 1054.74639
8180.0000 -106.53909 -98.65553 7.88356 2.73385 -98.16275 1118.40408
8185.0000 -105.46116 -97.39151 8.06964 2.79327 -97.41098 1148.43062
8190.0000 -104.86304 -96.54307 8.31997 2.80590 -97.25119 1177.79165
8195.0000 -103.66456 -97.65387 6.01070 2.79693 -97.36467 1154.61657
8200.0000 -103.84883 -96.81157 7.03726 2.82939 -96.95395 1143.59512
8205.0000 -103.14239 -96.79537 6.34701 2.80402 -97.27493 1153.01751
8210.0000 -104.99664 -98.17304 6.82359 2.84224 -96.79149 1138.77022
8215.0000 -104.72533 -100.23447 4.49085 2.66355 -99.05208 1021.44426
8220.0000 -104.52310 -99.01929 5.50381 2.65762 -99.12709 1036.30171
8225.0000 -104.26839 -97.55064 6.71775 2.72711 -98.24800 1072.98412
8230.0000 -103.54303 -96.11111 7.43192 2.84924 -96.70288 1127.84988
8235.0000 -104.05179 -97.83538 6.21640 2.87845 -96.33334 1116.66969
8240.0000 -103.44891 -96.66652 6.78238 2.80790 -97.22588 1116.47797
8245.0000 -104.80266 -98.18736 6.61531 2.79378 -97.40455 1123.10662
8250.0000 -103.99530 -97.84764 6.14765 2.74405 -98.03364 1084.15098
MELTING PROCESS: loop number 34 T-loop= 1157.0000000000000
main_MD> interactions number 34 at Temperature= 1157.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.84645 -0.33847 4.22405
force_rgl> df(natom) -0.96367 2.52905 -1.54962
8255.0000 -103.73029 -97.69967 6.03062 2.76291 -97.79509 1126.62244
8260.0000 -105.30770 -98.73353 6.57417 2.71793 -98.36418 1127.06104
8265.0000 -104.59657 -97.90237 6.69420 2.72237 -98.30791 1136.63326
8270.0000 -103.39331 -97.64793 5.74538 2.73638 -98.13075 1127.95022
8275.0000 -101.61183 -93.97140 7.64044 2.91217 -95.90675 1234.85892
8280.0000 -104.35349 -95.88608 8.46741 2.92521 -95.74176 1260.07345
8285.0000 -103.88563 -96.55955 7.32609 2.83096 -96.93411 1252.37221
8290.0000 -104.27420 -96.83347 7.44072 2.86833 -96.46136 1210.59395
8295.0000 -104.37304 -97.56694 6.80610 2.78023 -97.57599 1143.78898
8300.0000 -103.37464 -96.49480 6.87983 2.82161 -97.05243 1142.50991
8305.0000 -102.85583 -96.81551 6.04032 2.85997 -96.56716 1179.72345
8310.0000 -103.74320 -95.79421 7.94899 2.86309 -96.52763 1167.59928
8315.0000 -104.07533 -96.59356 7.48177 2.93149 -95.66230 1216.15069
8320.0000 -103.66974 -97.91694 5.75280 2.75249 -97.92686 1104.20130
8325.0000 -104.69794 -98.35293 6.34501 2.70967 -98.46865 1106.86242
8330.0000 -101.69731 -95.46104 6.23628 2.78195 -97.55420 1128.88789
8335.0000 -102.40651 -96.94105 5.46547 2.95789 -95.32831 1286.32137
8340.0000 -104.11544 -96.89669 7.21875 2.82155 -97.05320 1130.90753
8345.0000 -102.59267 -95.23553 7.35715 2.87206 -96.41417 1211.63509
8350.0000 -104.45433 -95.96333 8.49100 2.89101 -96.17441 1269.50234
8355.0000 -103.26433 -97.34277 5.92155 2.91895 -95.82098 1282.64737
8360.0000 -104.03178 -96.77017 7.26161 2.78308 -97.53988 1125.70140
8365.0000 -105.06525 -99.22078 5.84448 2.78303 -97.54052 1173.27075
8370.0000 -105.75859 -98.22419 7.53440 2.69003 -98.71716 1080.49901
8375.0000 -106.51480 -99.84261 6.67219 2.70861 -98.48202 1093.96540
8380.0000 -104.82636 -98.99434 5.83202 2.59498 -99.91970 1009.27691
8385.0000 -104.18675 -98.40586 5.78089 2.66489 -99.03521 1053.17955
8390.0000 -104.53667 -97.64969 6.88699 2.75690 -97.87110 1114.78964
8395.0000 -100.98499 -94.73601 6.24899 2.84912 -96.70441 1180.37364
8400.0000 -103.50180 -96.23526 7.26654 3.01139 -94.65141 1296.20159
8405.0000 -103.74447 -95.86849 7.87598 2.94635 -95.47433 1230.15251
8410.0000 -101.87428 -94.07614 7.79814 2.87456 -96.38248 1176.79660
8415.0000 -104.27527 -96.35920 7.91606 2.91254 -95.90200 1245.75139
8420.0000 -104.27115 -98.71634 5.55481 2.88701 -96.22504 1222.88760
8425.0000 -104.38982 -97.76708 6.62273 2.73511 -98.14677 1121.21233
8430.0000 -103.49069 -96.37902 7.11167 2.80913 -97.21027 1135.51200
8435.0000 -104.59064 -98.39166 6.19897 2.76147 -97.81331 1120.67045
8440.0000 -104.98691 -99.39256 5.59435 2.71395 -98.41452 1056.97394
8445.0000 -105.99897 -99.92624 6.07272 2.61567 -99.65792 1010.33450
8450.0000 -103.82746 -97.65725 6.17021 2.68659 -98.76061 1038.90871
8455.0000 -104.09519 -97.43120 6.66399 2.75754 -97.86304 1127.80324
8460.0000 -106.21279 -98.78235 7.43044 2.72089 -98.32672 1070.92864
8465.0000 -105.01584 -96.95729 8.05854 2.71322 -98.42369 1102.71247
8470.0000 -105.06196 -97.31912 7.74284 2.78141 -97.56107 1178.07259
8475.0000 -104.58926 -97.98963 6.59963 2.78370 -97.53205 1154.83581
8480.0000 -104.43630 -97.89760 6.53870 2.74551 -98.01525 1134.55823
8485.0000 -104.80757 -99.04664 5.76093 2.68863 -98.73484 1042.98710
8490.0000 -104.40775 -97.91317 6.49458 2.71221 -98.43656 1104.30864
8495.0000 -104.21615 -95.97927 8.23688 2.83485 -96.88490 1159.75711
8500.0000 -103.48105 -95.51847 7.96257 2.87609 -96.36317 1211.17066
MELTING PROCESS: loop number 35 T-loop= 1182.0000000000000
main_MD> interactions number 35 at Temperature= 1182.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.48139 0.52765 -0.49346
force_rgl> df(natom) -1.37005 -3.06806 0.78064
8505.0000 -101.84451 -93.38105 8.46345 3.02818 -94.43895 1342.11877
8510.0000 -104.08934 -93.69270 10.39664 3.08689 -93.69622 1373.64022
8515.0000 -103.17556 -96.46623 6.70933 2.99957 -94.80092 1293.66194
8520.0000 -104.83617 -98.22525 6.61092 2.85653 -96.61070 1184.03910
8525.0000 -104.25459 -98.28181 5.97278 2.76928 -97.71453 1145.29581
8530.0000 -105.50529 -98.61898 6.88631 2.59436 -99.92754 996.95086
8535.0000 -104.85583 -97.61011 7.24571 2.78068 -97.57025 1129.20683
8540.0000 -103.94562 -96.47184 7.47378 2.80258 -97.29320 1127.01389
8545.0000 -104.25521 -97.07244 7.18276 2.89841 -96.08075 1241.79572
8550.0000 -104.13308 -96.81569 7.31740 2.81210 -97.17273 1175.13738
8555.0000 -103.75734 -97.09654 6.66080 2.88564 -96.24235 1224.15232
8560.0000 -104.77802 -96.24572 8.53229 2.89534 -96.11963 1270.56660
8565.0000 -103.69746 -97.05571 6.64175 2.82209 -97.04640 1188.35509
8570.0000 -104.97766 -96.35775 8.61991 2.89785 -96.08784 1261.95640
8575.0000 -104.02478 -97.07628 6.94850 2.81803 -97.09768 1160.84203
8580.0000 -104.99344 -96.36755 8.62589 2.82695 -96.98488 1138.80102
8585.0000 -102.42126 -95.24351 7.17775 2.95400 -95.37750 1251.81353
8590.0000 -104.66841 -97.07236 7.59605 2.89766 -96.09025 1217.16801
8595.0000 -103.58405 -97.06004 6.52401 2.82202 -97.04725 1168.71672
8600.0000 -103.79006 -97.76624 6.02383 2.79387 -97.40341 1121.84664
8605.0000 -105.52390 -98.24663 7.27726 2.73327 -98.17001 1064.32702
8610.0000 -104.20281 -97.47607 6.72673 2.74552 -98.01504 1114.23507
8615.0000 -103.44843 -95.86747 7.58096 2.86335 -96.52435 1174.08601
8620.0000 -102.42755 -94.95903 7.46852 2.98942 -94.92935 1255.94142
8625.0000 -103.74753 -96.16004 7.58749 2.92209 -95.78122 1228.73460
8630.0000 -104.87943 -97.39352 7.48591 2.86245 -96.53568 1210.43039
8635.0000 -102.78052 -96.84486 5.93566 2.75555 -97.88823 1107.35307
8640.0000 -103.41191 -96.45026 6.96165 2.84620 -96.74132 1194.55689
8645.0000 -103.59527 -97.20612 6.38915 2.75680 -97.87240 1098.78490
8650.0000 -105.32028 -98.58777 6.73251 2.73199 -98.18621 1102.33394
8655.0000 -104.30337 -98.17757 6.12581 2.71570 -98.39237 1076.08999
8660.0000 -104.00543 -97.83489 6.17054 2.77503 -97.64168 1097.64163
8665.0000 -105.73342 -97.86483 7.86859 2.77594 -97.63027 1139.50423
8670.0000 -104.10437 -97.55354 6.55084 2.75874 -97.84778 1125.73465
8675.0000 -104.94045 -99.00821 5.93224 2.73042 -98.20616 1080.51213
8680.0000 -103.97162 -96.65276 7.31887 2.80260 -97.29290 1113.46902
8685.0000 -103.55495 -95.64089 7.91405 2.88841 -96.20727 1232.67949
8690.0000 -103.85459 -97.91228 5.94231 2.81980 -97.07527 1138.81096
8695.0000 -104.27566 -97.08467 7.19100 2.77167 -97.68425 1194.61966
8700.0000 -104.64478 -98.52514 6.11964 2.83276 -96.91136 1209.83333
8705.0000 -102.65449 -96.13550 6.51899 2.83949 -96.82628 1200.67286
8710.0000 -103.21015 -96.84397 6.36618 2.90220 -96.03289 1200.12269
8715.0000 -103.45472 -97.66333 5.79139 2.76807 -97.72980 1102.12368
8720.0000 -104.34243 -97.45787 6.88457 2.72022 -98.33510 1069.51483
8725.0000 -106.74100 -99.37669 7.36430 2.73900 -98.09754 1122.29147
8730.0000 -104.60662 -98.57420 6.03243 2.63545 -99.40762 1035.58780
8735.0000 -103.49571 -97.41582 6.07989 2.74133 -98.06804 1084.71464
8740.0000 -102.49446 -95.83312 6.66134 2.82670 -96.98808 1150.15965
8745.0000 -103.36762 -97.92452 5.44310 2.87607 -96.36342 1140.45680
8750.0000 -104.46059 -97.65967 6.80092 2.76161 -97.81157 1120.61904
main_MD> EXECUTION TIME: 0 [day], 0 [hour], 7 [min], 34.6218481 [s].
main_MD> Deallocating global variables
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