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nanoparticlesims/growth_Melting_Silver_ICO_2451/meltingSims/run_48/melt.log

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main_MD> Reading input file
read_input> Process type: melting
Read_input> Process caloric with a T-change of 25.000000000000000 [K] and a rate of 9.9999999999999992E+022 [K/ns]
read_input> Input for metadynamics has been read
read_input> Metadynamics has not been chosen.
read_input> Reading initial positions fromtoMelt_48.xyz
read_input> Finish reading initial positions
read_input> Validating positions
read_input> Initializing random number generator
read_input> Checking program
read_rgl> START READING FILE ../pot.pot
read_rgl>> END READING FILE ../pot.pot
READ_RGL>> atomic speciesAgAg imet1 4 imet2 4
READ_RGL>> atomic radius 1.4450000999999999 1.4450000999999999
read_rgl> PARAMETERS SELECTION
FOR IMET1 :: Ag 4
ECOH :: 2.9500000000000002 A :: 0.10308871000000000 QSI :: 1.1895434899999999
p :: 10.850000000000000 q :: 3.1800000000000002
ATOMIC RADIUS :: 1.4450000999999999
choice_pot> values:
frac = 0.12062503764379931 arete = 4.0870774781009569
choice_pot> mass is== 108.00000000000000 for elem1=
read_input> ntipo1 = 48 ntipo2 = 0
read_input> Finish reading input
main_MD> Allocating global variables
main_MD> Number of outputs that will be created: 1750
main_MD> Size of nv and nvoiz: 48 4800
main_MD> Size of nv and nvoiz: 48 4800
main_MD> Number of time-steps (npas) = 50000
main_MD> Number of CVs (num_cv) = 1
main_MD> Max allowed number of atoms = 2900
main_MD> Max number of atoms = 48
main_MD> Consider changing parameter nsiz in module_parameters.f90 for performance
main_MD> collvar_wanted = F
main_MD> INPUT AND POTENTIAL FILE READING IS DONE
main_MD> THERMALIZATION IS STARTING
init> -3.2584270031920916E-002 -0.12272998591386160 -0.10730413536794241 initial drift of cluster / NP1 for coalescence
init> 0.37971728699502688 0.35349028078657402 0.32767508529063039 scaling for velocity /for coalescence NP1
init.f90 > facguy = 1.9085614812365279E-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) -3.19855 -0.16858 0.73087
force_rgl> df(natom) 1.31362 0.33275 -2.97136
preparo> THERMALIZATION PROCESS AT 316.42007745427827
preparo> TOTAL ENERGY, KINETIC EN., POT. ENERGY, DELTA
5000 -119.02173162686384 2.0220103147129120 -121.04374194157676 3.7011671035198668E-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= 341.00000000000000
main_MD> interactions number 1 at Temperature= 341.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.84241 0.87565 0.46579
force_rgl> df(natom) 0.77056 -0.27585 -0.24001
5.0000 -120.76672 -118.89941 1.86731 1.71888 -118.89759 297.62257
10.0000 -120.83651 -118.55638 2.28013 1.72627 -118.79988 304.33259
15.0000 -120.97547 -119.40839 1.56707 1.71232 -118.98412 288.76797
20.0000 -120.69438 -118.43052 2.26386 1.72487 -118.81846 297.60609
25.0000 -120.11072 -117.94536 2.16536 1.76760 -118.25400 347.21578
30.0000 -120.25212 -118.31695 1.93517 1.78017 -118.08804 368.33324
35.0000 -120.68532 -118.64771 2.03761 1.73353 -118.70401 312.12224
40.0000 -120.92779 -118.85921 2.06858 1.72632 -118.79921 299.60979
45.0000 -120.81836 -118.90853 1.90983 1.72063 -118.87443 302.30202
50.0000 -120.80330 -118.81131 1.99199 1.72012 -118.88113 292.94870
55.0000 -120.14363 -118.24698 1.89665 1.76883 -118.23786 339.57008
60.0000 -120.26477 -118.66383 1.60094 1.73246 -118.71818 310.15260
65.0000 -120.56799 -118.69695 1.87104 1.74575 -118.54260 328.22738
70.0000 -120.53135 -118.61928 1.91207 1.72789 -118.77848 312.02683
75.0000 -120.69545 -118.56118 2.13427 1.72141 -118.86414 296.56405
80.0000 -120.25701 -118.06741 2.18960 1.75578 -118.41015 333.68849
85.0000 -119.86867 -117.80998 2.05869 1.78484 -118.02638 358.48536
90.0000 -120.28567 -118.29165 1.99402 1.78344 -118.04488 354.66175
95.0000 -120.96436 -118.84213 2.12223 1.74826 -118.50945 325.97937
100.0000 -120.68544 -118.76945 1.91600 1.74205 -118.59150 323.20262
105.0000 -120.77211 -118.63963 2.13248 1.72721 -118.78754 307.87200
110.0000 -120.70783 -118.55636 2.15147 1.73527 -118.68108 320.30896
115.0000 -120.79107 -118.89299 1.89809 1.74029 -118.61482 323.02967
120.0000 -120.95253 -118.76461 2.18793 1.72946 -118.75783 313.86238
125.0000 -120.48704 -118.51355 1.97349 1.74952 -118.49285 331.69281
130.0000 -120.65896 -118.75272 1.90624 1.75362 -118.43863 340.74786
135.0000 -120.14565 -118.08598 2.05967 1.74684 -118.52824 336.46751
140.0000 -120.51717 -118.68582 1.83135 1.76074 -118.34461 342.37003
145.0000 -119.96215 -117.93998 2.02217 1.76294 -118.31558 345.31543
150.0000 -120.10432 -117.88489 2.21944 1.79455 -117.89812 375.65689
155.0000 -120.42624 -118.09555 2.33069 1.77884 -118.10564 364.41970
160.0000 -119.95687 -117.87655 2.08032 1.77579 -118.14584 355.42593
165.0000 -120.46457 -118.08464 2.37993 1.78885 -117.97342 372.00920
170.0000 -120.56465 -118.13974 2.42491 1.79463 -117.89706 377.52593
175.0000 -120.66415 -118.55749 2.10666 1.73830 -118.64098 321.34125
180.0000 -120.37557 -118.02968 2.34590 1.75089 -118.47480 326.62754
185.0000 -119.75630 -117.40573 2.35057 1.78779 -117.98734 356.51976
190.0000 -120.51611 -117.85427 2.66184 1.80507 -117.75920 373.51191
195.0000 -119.98503 -117.91093 2.07410 1.79946 -117.83332 368.30610
200.0000 -120.26231 -118.26261 1.99971 1.77250 -118.18934 343.52845
205.0000 -120.67176 -118.42983 2.24193 1.77073 -118.21276 349.24185
210.0000 -120.34845 -118.31009 2.03835 1.75691 -118.39524 339.15895
215.0000 -120.62378 -119.08153 1.54225 1.73021 -118.74790 314.95636
220.0000 -120.56421 -118.50697 2.05725 1.72593 -118.80448 311.94585
225.0000 -120.14866 -117.82553 2.32313 1.80135 -117.80825 385.08236
230.0000 -120.82240 -118.58846 2.23393 1.78118 -118.07467 361.14329
235.0000 -120.70884 -118.65679 2.05205 1.74872 -118.50335 333.68614
240.0000 -120.87186 -118.48627 2.38559 1.71057 -119.00731 293.35296
245.0000 -119.97078 -117.65208 2.31870 1.76831 -118.24466 352.17452
250.0000 -120.43911 -118.32388 2.11522 1.78265 -118.05532 368.51181
MELTING PROCESS: loop number 2 T-loop= 366.00000000000000
main_MD> interactions number 2 at Temperature= 366.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -3.01363 4.74627 -0.62369
force_rgl> df(natom) -0.89671 -0.04394 -1.01244
255.0000 -120.11823 -117.39228 2.72595 1.81117 -117.67853 399.50217
260.0000 -119.99618 -118.03614 1.96004 1.82512 -117.49433 408.57139
265.0000 -120.73643 -118.55431 2.18212 1.76077 -118.34428 347.70728
270.0000 -120.90902 -118.53084 2.37818 1.74638 -118.53431 334.23972
275.0000 -120.65898 -118.23415 2.42483 1.78745 -117.99183 380.06659
280.0000 -120.12611 -117.84139 2.28472 1.77217 -118.19369 356.22572
285.0000 -120.90045 -118.35869 2.54177 1.78782 -117.98704 368.92507
290.0000 -120.32317 -117.72354 2.59964 1.77574 -118.14653 357.91911
295.0000 -120.51455 -117.89256 2.62199 1.79421 -117.90263 383.10408
300.0000 -120.41988 -118.28968 2.13020 1.77632 -118.13889 357.58804
305.0000 -120.40041 -117.91614 2.48428 1.78277 -118.05371 366.91484
310.0000 -120.50028 -118.04360 2.45668 1.78540 -118.01895 367.60259
315.0000 -120.05441 -117.82241 2.23200 1.79476 -117.89538 374.28999
320.0000 -120.55872 -118.02355 2.53517 1.79720 -117.86306 375.04836
325.0000 -120.36025 -118.12186 2.23839 1.77024 -118.21920 345.69320
330.0000 -120.23109 -117.73207 2.49901 1.79486 -117.89405 374.03367
335.0000 -120.66839 -118.56089 2.10750 1.79252 -117.92486 376.45605
340.0000 -120.50331 -117.99822 2.50509 1.76933 -118.23120 352.61664
345.0000 -120.50257 -118.40118 2.10139 1.77113 -118.20747 356.79361
350.0000 -120.93644 -118.36737 2.56907 1.75067 -118.47765 332.27886
355.0000 -120.33349 -117.97694 2.35655 1.79999 -117.82626 387.81216
360.0000 -120.49372 -118.21525 2.27846 1.79281 -117.92115 376.06244
365.0000 -120.59950 -118.06167 2.53783 1.77323 -118.17973 356.78959
370.0000 -120.68634 -118.00614 2.68020 1.77514 -118.15448 354.46997
375.0000 -120.10380 -117.99455 2.10925 1.77905 -118.10284 368.43790
380.0000 -120.15081 -117.40128 2.74953 1.79607 -117.87800 384.14153
385.0000 -120.28340 -117.31115 2.97225 1.83202 -117.40322 411.64141
390.0000 -120.08329 -117.04322 3.04007 1.85557 -117.09218 436.83422
395.0000 -119.85886 -117.63131 2.22755 1.83244 -117.39764 412.80595
400.0000 -120.21987 -117.50380 2.71606 1.83840 -117.31893 416.61790
405.0000 -119.60710 -117.71929 1.88781 1.80686 -117.73550 391.76334
410.0000 -120.43486 -117.85225 2.58261 1.79522 -117.88925 380.78521
415.0000 -120.71581 -118.45201 2.26380 1.75780 -118.38347 348.99722
420.0000 -120.26798 -118.04547 2.22251 1.76283 -118.31708 348.94204
425.0000 -120.54443 -118.29868 2.24576 1.76699 -118.26214 354.49031
430.0000 -120.50608 -117.88944 2.61664 1.78170 -118.06783 362.90229
435.0000 -120.64209 -118.13231 2.50978 1.79907 -117.83843 380.82888
440.0000 -120.58782 -118.38804 2.19979 1.76088 -118.34280 340.43582
445.0000 -119.68836 -117.35521 2.33314 1.81557 -117.62052 387.90959
450.0000 -120.09337 -117.36410 2.72928 1.83110 -117.41542 405.07896
455.0000 -120.46752 -118.56446 1.90305 1.79065 -117.94960 371.89046
460.0000 -120.54172 -118.06563 2.47609 1.76181 -118.33047 346.31118
465.0000 -120.11347 -117.59393 2.51954 1.78340 -118.04531 363.25179
470.0000 -119.79171 -117.54614 2.24558 1.80168 -117.80395 375.35921
475.0000 -120.61289 -118.09344 2.51945 1.78041 -118.08483 357.04544
480.0000 -120.61797 -117.64441 2.97356 1.79542 -117.88664 373.58720
485.0000 -120.14958 -117.75783 2.39174 1.79171 -117.93565 368.61916
490.0000 -120.06368 -117.99854 2.06514 1.78755 -117.99059 370.25537
495.0000 -120.39532 -118.21944 2.17589 1.75712 -118.39249 342.41401
500.0000 -120.34270 -117.82333 2.51936 1.77929 -118.09966 355.01778
MELTING PROCESS: loop number 3 T-loop= 391.00000000000000
main_MD> interactions number 3 at Temperature= 391.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.29019 -0.73751 2.50385
force_rgl> df(natom) -0.15065 1.47901 1.52914
505.0000 -119.57084 -117.03782 2.53302 1.83144 -117.41081 416.52431
510.0000 -119.45876 -116.77954 2.67922 1.88847 -116.65761 458.94044
515.0000 -120.03807 -117.62180 2.41627 1.85404 -117.11237 435.15317
520.0000 -119.68941 -117.05569 2.63371 1.81560 -117.62006 404.26691
525.0000 -120.59972 -118.05585 2.54387 1.83850 -117.31762 424.63640
530.0000 -119.97222 -117.43301 2.53921 1.80057 -117.81863 384.12835
535.0000 -120.18338 -117.62615 2.55723 1.82204 -117.53499 410.36538
540.0000 -119.90815 -117.38384 2.52431 1.82233 -117.53115 407.82820
545.0000 -120.44077 -117.53026 2.91051 1.82538 -117.49086 401.75725
550.0000 -119.71061 -117.53498 2.17563 1.81121 -117.67806 396.58686
555.0000 -120.16263 -118.20383 1.95880 1.80292 -117.78749 383.04764
560.0000 -120.53543 -118.08989 2.44555 1.81409 -117.64000 397.21124
565.0000 -120.53594 -117.94739 2.58855 1.78720 -117.99517 368.73804
570.0000 -120.10738 -117.91641 2.19097 1.78737 -117.99295 365.64466
575.0000 -120.01412 -116.95313 3.06099 1.83665 -117.34201 410.26082
580.0000 -119.54314 -117.23957 2.30357 1.84923 -117.17585 429.86565
585.0000 -120.04292 -117.57598 2.46694 1.83061 -117.42180 414.86487
590.0000 -120.26262 -118.02492 2.23770 1.80152 -117.80604 385.77730
595.0000 -119.90459 -117.65771 2.24688 1.80381 -117.77574 387.69821
600.0000 -119.98861 -117.61511 2.37350 1.81064 -117.68555 388.45583
605.0000 -119.94031 -118.11210 1.82821 1.80374 -117.77678 378.02581
610.0000 -119.73108 -116.70932 3.02176 1.83868 -117.31525 413.24699
615.0000 -119.39432 -116.40688 2.98744 1.90515 -116.43731 485.37859
620.0000 -119.54797 -116.67354 2.87443 1.87585 -116.82431 454.62248
625.0000 -120.15682 -117.70263 2.45419 1.84347 -117.25205 418.71825
630.0000 -119.90309 -117.45412 2.44896 1.82036 -117.55721 396.34433
635.0000 -119.59870 -117.26752 2.33118 1.82781 -117.45879 411.66719
640.0000 -120.23491 -117.74833 2.48657 1.80656 -117.73953 387.39225
645.0000 -119.88981 -117.52305 2.36676 1.80228 -117.79595 388.50109
650.0000 -119.87097 -117.49442 2.37655 1.81550 -117.62137 397.57937
655.0000 -120.03575 -117.83203 2.20372 1.82330 -117.51844 399.06525
660.0000 -120.73157 -118.12860 2.60297 1.80449 -117.76677 393.54029
665.0000 -120.39838 -118.07887 2.31951 1.77507 -118.15545 360.94632
670.0000 -120.32345 -117.37841 2.94504 1.83011 -117.42844 419.44735
675.0000 -119.95524 -117.04902 2.90622 1.83151 -117.41001 421.64046
680.0000 -119.26941 -116.79605 2.47336 1.86195 -117.00797 440.75943
685.0000 -119.62464 -117.65501 1.96963 1.85142 -117.14701 430.80328
690.0000 -120.57581 -118.28644 2.28936 1.78621 -118.00821 362.22864
695.0000 -119.92034 -117.94909 1.97125 1.77108 -118.20813 352.74542
700.0000 -120.57292 -118.31559 2.25733 1.78339 -118.04556 357.19605
705.0000 -119.70240 -117.23021 2.47219 1.81078 -117.68371 395.98027
710.0000 -120.02787 -116.80089 3.22698 1.86144 -117.01461 447.07086
715.0000 -119.34430 -116.73413 2.61018 1.88690 -116.67839 463.24811
720.0000 -119.84559 -117.58104 2.26455 1.85380 -117.11554 435.80829
725.0000 -120.14926 -117.99775 2.15150 1.80991 -117.69527 392.13001
730.0000 -120.46441 -117.97323 2.49118 1.82239 -117.53043 407.68661
735.0000 -119.85296 -117.72200 2.13096 1.80207 -117.79879 367.33470
740.0000 -119.89384 -117.54516 2.34868 1.81335 -117.64974 399.18724
745.0000 -120.63178 -118.19072 2.44106 1.78473 -118.02774 369.87371
750.0000 -120.03606 -117.76382 2.27224 1.77934 -118.09906 366.30478
MELTING PROCESS: loop number 4 T-loop= 416.00000000000000
main_MD> interactions number 4 at Temperature= 416.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.25391 -1.91732 -0.93151
force_rgl> df(natom) -0.30340 1.99093 0.33044
755.0000 -119.95024 -116.97703 2.97322 1.83659 -117.34285 419.13861
760.0000 -119.97410 -117.77941 2.19469 1.85051 -117.15894 420.40677
765.0000 -120.03460 -117.61479 2.41981 1.82352 -117.51548 409.66590
770.0000 -119.85636 -117.58055 2.27581 1.82321 -117.51956 408.92895
775.0000 -120.15622 -118.07522 2.08100 1.80135 -117.80831 381.47014
780.0000 -119.88696 -117.69300 2.19396 1.80820 -117.71776 393.78385
785.0000 -119.99328 -117.45879 2.53450 1.84014 -117.29595 423.94176
790.0000 -120.23418 -117.79742 2.43676 1.82782 -117.45874 413.88246
795.0000 -119.32845 -116.72954 2.59891 1.85430 -117.10891 435.97745
800.0000 -120.59175 -117.77411 2.81764 1.84343 -117.25250 425.36830
805.0000 -120.14982 -118.11192 2.03789 1.80305 -117.78578 383.72880
810.0000 -119.68459 -116.99264 2.69195 1.82296 -117.52293 400.42118
815.0000 -120.09746 -117.53215 2.56531 1.83801 -117.32409 416.40724
820.0000 -119.76852 -117.26403 2.50448 1.83942 -117.30554 421.83579
825.0000 -120.29352 -117.65560 2.63791 1.82961 -117.43502 414.32750
830.0000 -119.55040 -116.99520 2.55520 1.82507 -117.49504 414.34876
835.0000 -119.77787 -117.08448 2.69339 1.85884 -117.04901 433.41617
840.0000 -119.69855 -116.82592 2.87263 1.85739 -117.06812 421.62545
845.0000 -119.50647 -116.91173 2.59474 1.86746 -116.93519 434.30624
850.0000 -120.16903 -117.65625 2.51278 1.82534 -117.49141 399.57679
855.0000 -120.06534 -117.43768 2.62765 1.82754 -117.46236 401.96099
860.0000 -119.39957 -117.05498 2.34458 1.82798 -117.45655 401.79191
865.0000 -120.12059 -117.20665 2.91394 1.84906 -117.17822 432.83620
870.0000 -119.59563 -117.61106 1.98458 1.83887 -117.31273 413.96745
875.0000 -120.05540 -117.72995 2.32544 1.79681 -117.86827 372.59794
880.0000 -119.95371 -117.38386 2.56984 1.82950 -117.43647 408.74453
885.0000 -119.60240 -116.93929 2.66311 1.83901 -117.31089 415.76437
890.0000 -120.21412 -117.28299 2.93112 1.86798 -116.92828 445.17482
895.0000 -120.37579 -117.93486 2.44093 1.83551 -117.35712 409.23840
900.0000 -119.72697 -117.22299 2.50398 1.82652 -117.47584 413.47917
905.0000 -119.65034 -117.51006 2.14027 1.83638 -117.34560 416.82596
910.0000 -119.84391 -117.33254 2.51137 1.84989 -117.16717 429.11147
915.0000 -120.31281 -117.76578 2.54703 1.82798 -117.45655 410.98033
920.0000 -120.14174 -117.60339 2.53835 1.83738 -117.33237 411.81067
925.0000 -119.25142 -117.20190 2.04952 1.85406 -117.11209 393.26355
930.0000 -119.84118 -116.89338 2.94780 1.85438 -117.10783 388.31478
935.0000 -119.79414 -116.72383 3.07031 1.89224 -116.60789 429.93059
940.0000 -119.40952 -116.60424 2.80529 1.88035 -116.76493 446.91984
945.0000 -119.62675 -117.18428 2.44248 1.87642 -116.81675 451.38737
950.0000 -119.83842 -116.64835 3.19008 1.86330 -116.99009 422.54062
955.0000 -119.58792 -117.03510 2.55282 1.87578 -116.82519 453.62204
960.0000 -119.70827 -117.69183 2.01644 1.81685 -117.60358 400.26980
965.0000 -119.86436 -116.92193 2.94243 1.83796 -117.32481 418.33168
970.0000 -118.94244 -116.10172 2.84071 1.88625 -116.68689 460.60135
975.0000 -119.23999 -116.69970 2.54029 1.90438 -116.44755 469.74994
980.0000 -120.36244 -118.06510 2.29733 1.84812 -117.19051 421.44969
985.0000 -120.51563 -118.12460 2.39104 1.77477 -118.15930 356.99778
990.0000 -120.03569 -117.42390 2.61180 1.80454 -117.76612 386.92900
995.0000 -120.27195 -117.70889 2.56306 1.80988 -117.69569 397.06868
1000.0000 -120.66956 -118.37089 2.29867 1.78463 -118.02908 371.98370
MELTING PROCESS: loop number 5 T-loop= 441.00000000000000
main_MD> interactions number 5 at Temperature= 441.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.68728 -0.75587 0.99348
force_rgl> df(natom) -0.39834 0.09935 0.16643
1005.0000 -119.70178 -117.01113 2.69065 1.79315 -117.91657 381.50001
1010.0000 -120.11277 -117.40420 2.70858 1.84762 -117.19723 433.49292
1015.0000 -119.90920 -116.73493 3.17427 1.85386 -117.11473 433.33666
1020.0000 -119.76453 -116.60169 3.16283 1.88418 -116.71434 460.00610
1025.0000 -119.37386 -116.63342 2.74044 1.89124 -116.62110 466.64726
1030.0000 -119.99598 -117.13627 2.85971 1.85832 -117.05588 434.83572
1035.0000 -120.15495 -117.32999 2.82496 1.86585 -116.95638 443.77456
1040.0000 -120.50195 -117.85829 2.64365 1.83423 -117.37402 421.37407
1045.0000 -119.23040 -116.48663 2.74377 1.83848 -117.31790 416.21062
1050.0000 -119.45938 -116.99316 2.46622 1.88185 -116.74512 452.18777
1055.0000 -119.85304 -117.28384 2.56920 1.87480 -116.83821 450.88570
1060.0000 -119.92359 -117.17529 2.74829 1.85029 -117.16189 426.76130
1065.0000 -119.56483 -117.44220 2.12263 1.83351 -117.38357 419.09505
1070.0000 -119.43480 -116.63795 2.79685 1.83322 -117.38730 420.62568
1075.0000 -119.87766 -116.95981 2.91785 1.87334 -116.85753 458.37147
1080.0000 -120.09013 -117.29942 2.79071 1.84566 -117.22311 427.19466
1085.0000 -119.75602 -117.12762 2.62841 1.84829 -117.18832 422.73171
1090.0000 -119.83029 -116.89141 2.93888 1.86298 -116.99436 438.07555
1095.0000 -119.63556 -117.07277 2.56279 1.85171 -117.14318 432.22088
1100.0000 -119.27385 -116.76034 2.51351 1.87260 -116.86723 447.50246
1105.0000 -120.11777 -117.63602 2.48174 1.85990 -117.03497 436.55941
1110.0000 -120.17549 -117.31743 2.85806 1.84890 -117.18030 427.81907
1115.0000 -119.67061 -116.35775 3.31286 1.87754 -116.80196 452.53310
1120.0000 -119.89369 -116.92040 2.97329 1.91574 -116.29744 490.51183
1125.0000 -119.53728 -116.25849 3.27879 1.88345 -116.72392 458.48166
1130.0000 -119.44189 -116.57406 2.86784 1.87901 -116.78253 461.41875
1135.0000 -119.44502 -117.05862 2.38639 1.87327 -116.85841 440.30969
1140.0000 -119.62657 -116.46481 3.16176 1.85193 -117.14027 438.53549
1145.0000 -119.68473 -117.33706 2.34768 1.90689 -116.41436 459.26372
1150.0000 -120.14205 -117.24678 2.89527 1.85002 -117.16553 410.80311
1155.0000 -119.63682 -117.39310 2.24372 1.88371 -116.72057 465.09933
1160.0000 -119.57080 -116.84533 2.72547 1.85141 -117.14716 436.22164
1165.0000 -119.56893 -116.71747 2.85146 1.88869 -116.65475 473.53062
1170.0000 -119.82078 -116.84741 2.97336 1.87869 -116.78682 452.34426
1175.0000 -119.38521 -116.97035 2.41486 1.83909 -117.30983 431.82996
1180.0000 -119.65835 -117.14663 2.51172 1.87430 -116.84479 447.34242
1185.0000 -118.95076 -116.18026 2.77051 1.87023 -116.89856 448.04707
1190.0000 -120.20397 -117.28078 2.92318 1.87270 -116.86598 461.80086
1195.0000 -119.80774 -116.83989 2.96785 1.86213 -117.00557 443.95783
1200.0000 -119.38869 -116.05766 3.33103 1.89653 -116.55112 470.25510
1205.0000 -119.01448 -116.51874 2.49574 1.91376 -116.32367 481.67953
1210.0000 -119.37223 -116.54260 2.82963 1.89944 -116.51280 447.48068
1215.0000 -119.01802 -115.97502 3.04300 1.89870 -116.52249 461.77223
1220.0000 -119.18880 -116.39519 2.79361 1.92516 -116.17306 460.16523
1225.0000 -119.96791 -117.02110 2.94681 1.89304 -116.59728 431.90006
1230.0000 -119.13653 -116.63033 2.50620 1.88545 -116.69749 424.62647
1235.0000 -119.70926 -116.77290 2.93636 1.89779 -116.53448 445.05859
1240.0000 -119.09624 -116.37586 2.72038 1.90061 -116.49728 433.66595
1245.0000 -119.09281 -116.62618 2.46663 1.89928 -116.51490 427.41207
1250.0000 -119.10172 -116.43953 2.66219 1.90054 -116.49825 441.68130
MELTING PROCESS: loop number 6 T-loop= 466.00000000000000
main_MD> interactions number 6 at Temperature= 466.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.37100 0.53030 0.63171
force_rgl> df(natom) 0.80296 1.08078 -0.52528
1255.0000 -119.28353 -116.46153 2.82200 1.89966 -116.50986 452.45749
1260.0000 -119.14654 -116.39342 2.75313 1.91145 -116.35407 444.64382
1265.0000 -118.80636 -115.59539 3.21097 1.92201 -116.21463 475.91170
1270.0000 -118.63442 -116.07262 2.56180 1.96147 -115.69352 488.85372
1275.0000 -118.78786 -116.05981 2.72805 1.93432 -116.05202 434.76352
1280.0000 -118.69267 -115.64447 3.04820 1.97227 -115.55090 478.38222
1285.0000 -118.46596 -115.45263 3.01333 1.96625 -115.63036 477.61425
1290.0000 -118.04995 -115.74395 2.30600 1.97041 -115.57542 478.19873
1295.0000 -118.73799 -115.75844 2.97955 1.97660 -115.49362 471.26506
1300.0000 -118.62985 -115.55338 3.07647 1.95953 -115.71903 457.25146
1305.0000 -118.35249 -115.04494 3.30755 1.98403 -115.39545 457.21452
1310.0000 -118.73971 -115.43168 3.30803 1.98524 -115.37957 466.94629
1315.0000 -118.70790 -115.46063 3.24727 1.97345 -115.53522 479.96939
1320.0000 -119.11344 -115.48004 3.63340 1.94179 -115.95339 465.22588
1325.0000 -119.19189 -115.79823 3.39367 1.98249 -115.41588 511.64997
1330.0000 -118.63970 -115.92875 2.71095 1.94713 -115.88288 466.67212
1335.0000 -119.05467 -116.24577 2.80889 1.94658 -115.89011 462.48906
1340.0000 -119.34413 -116.86335 2.48079 1.90333 -116.46142 423.98415
1345.0000 -118.49686 -115.99032 2.50654 1.88731 -116.67295 413.12954
1350.0000 -119.09088 -116.27848 2.81240 1.93634 -116.02537 455.55496
1355.0000 -118.22413 -115.58959 2.63454 1.94171 -115.95444 460.39220
1360.0000 -118.24634 -115.41583 2.83051 1.93217 -116.08040 434.90388
1365.0000 -118.62350 -115.32352 3.29998 1.96751 -115.61367 489.68074
1370.0000 -118.53166 -114.79800 3.73366 2.01609 -114.97206 513.26042
1375.0000 -118.39713 -114.80499 3.59214 2.03330 -114.74478 533.57601
1380.0000 -119.03002 -115.82855 3.20148 2.01499 -114.98666 545.24261
1385.0000 -118.65327 -115.17934 3.47393 1.98814 -115.34128 518.75902
1390.0000 -118.83913 -116.25929 2.57984 1.97012 -115.57920 507.24236
1395.0000 -119.57708 -116.52858 3.04850 1.90862 -116.39154 441.89884
1400.0000 -118.70126 -115.22274 3.47852 1.91255 -116.33953 442.62555
1405.0000 -118.81866 -115.25344 3.56522 2.02665 -114.83262 558.18652
1410.0000 -118.21193 -115.78662 2.42531 1.96558 -115.63918 499.22669
1415.0000 -118.52154 -115.70830 2.81324 1.98789 -115.34452 529.90975
1420.0000 -119.26350 -116.32248 2.94102 1.91497 -116.30767 451.80551
1425.0000 -118.89215 -115.65539 3.23676 1.95209 -115.81737 501.27101
1430.0000 -119.02887 -115.96525 3.06362 1.96387 -115.66176 505.37024
1435.0000 -118.91462 -116.27633 2.63829 1.95952 -115.71918 499.65794
1440.0000 -118.99542 -116.03663 2.95878 1.91893 -116.25540 459.39260
1445.0000 -119.21215 -116.53721 2.67494 1.90938 -116.38153 441.45315
1450.0000 -119.16010 -116.68482 2.47529 1.90953 -116.37949 443.62016
1455.0000 -119.12792 -116.69473 2.43319 1.89584 -116.56034 432.51475
1460.0000 -118.89885 -116.15117 2.74768 1.90507 -116.43839 438.92358
1465.0000 -119.35131 -116.29443 3.05688 1.92812 -116.13397 478.34735
1470.0000 -118.35633 -115.89583 2.46050 1.92577 -116.16502 453.91235
1475.0000 -119.34099 -116.11762 3.22337 1.93840 -115.99818 480.54986
1480.0000 -119.40881 -116.25770 3.15111 1.89878 -116.52144 467.28981
1485.0000 -119.84465 -116.60208 3.24257 1.92208 -116.21378 482.74747
1490.0000 -118.71617 -115.99194 2.72424 1.90500 -116.43929 466.04188
1495.0000 -118.75480 -115.95004 2.80477 1.94216 -115.94849 496.14211
1500.0000 -119.82231 -117.05665 2.76566 1.91170 -116.35087 471.16477
MELTING PROCESS: loop number 7 T-loop= 491.00000000000000
main_MD> interactions number 7 at Temperature= 491.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.25728 -0.29494 0.17701
force_rgl> df(natom) 3.58981 -2.37456 -0.68231
1505.0000 -119.76283 -116.61217 3.15067 1.87467 -116.83990 461.40971
1510.0000 -119.08494 -115.57597 3.50897 1.93483 -116.04527 505.99074
1515.0000 -118.62256 -115.66457 2.95799 1.95715 -115.75051 504.49168
1520.0000 -118.53909 -115.68173 2.85736 1.92827 -116.13195 482.02962
1525.0000 -118.32073 -115.12142 3.19931 1.98922 -115.32691 527.59420
1530.0000 -118.85785 -114.68409 4.17376 2.02583 -114.84342 530.12783
1535.0000 -119.04810 -115.71113 3.33697 1.98615 -115.36745 512.71214
1540.0000 -118.98922 -115.86026 3.12896 1.95479 -115.78168 513.66367
1545.0000 -119.22391 -116.63505 2.58886 1.91535 -116.30259 479.59368
1550.0000 -119.64317 -117.27794 2.36523 1.85470 -117.10362 416.87018
1555.0000 -119.84479 -117.04621 2.79858 1.87625 -116.81904 434.06698
1560.0000 -119.40450 -117.36679 2.03770 1.86050 -117.02701 424.00113
1565.0000 -119.72252 -117.33729 2.38522 1.85088 -117.15413 412.03795
1570.0000 -119.49402 -117.12739 2.36662 1.84433 -117.24068 399.33283
1575.0000 -118.77617 -115.97737 2.79879 1.87945 -116.77677 401.24791
1580.0000 -118.65302 -116.10270 2.55032 1.92860 -116.12756 435.81373
1585.0000 -118.61877 -116.01280 2.60597 1.94065 -115.96852 435.72520
1590.0000 -118.13666 -114.93638 3.20028 1.99090 -115.30473 509.67322
1595.0000 -118.81765 -115.86805 2.94960 2.02868 -114.80580 547.56032
1600.0000 -118.99710 -115.61971 3.37738 1.94135 -115.95920 470.20875
1605.0000 -119.30478 -115.95665 3.34813 1.94052 -115.97017 463.86447
1610.0000 -119.53156 -116.83478 2.69678 1.90548 -116.43297 440.33212
1615.0000 -119.17548 -116.32319 2.85229 1.91318 -116.33126 428.29997
1620.0000 -118.19997 -115.76839 2.43158 1.91535 -116.30259 431.61376
1625.0000 -118.27718 -115.28457 2.99261 1.93308 -116.06851 456.63375
1630.0000 -118.83959 -115.02393 3.81566 1.99326 -115.27364 501.05451
1635.0000 -118.77915 -116.22893 2.55022 1.96040 -115.70763 472.68156
1640.0000 -118.37884 -115.25832 3.12052 1.98788 -115.34462 497.09017
1645.0000 -118.08163 -114.88023 3.20140 2.00904 -115.06513 527.23417
1650.0000 -117.91904 -114.61081 3.30823 1.99733 -115.21978 510.52276
1655.0000 -118.37786 -115.42287 2.95499 1.99981 -115.18703 499.37282
1660.0000 -119.31360 -116.04984 3.26376 1.98594 -115.37028 508.04804
1665.0000 -119.33037 -116.59469 2.73568 1.94513 -115.90933 489.92006
1670.0000 -118.54716 -115.89548 2.65168 1.91272 -116.33734 442.08483
1675.0000 -118.71206 -114.74334 3.96871 1.97260 -115.54643 494.16691
1680.0000 -117.99936 -115.23720 2.76216 2.00426 -115.12828 510.50906
1685.0000 -118.37093 -115.89284 2.47808 1.95723 -115.74947 462.19705
1690.0000 -119.08493 -115.82136 3.26357 1.96272 -115.67702 474.28647
1695.0000 -119.77366 -116.06699 3.70667 1.92950 -116.11577 460.45680
1700.0000 -118.56068 -115.24963 3.31105 1.95997 -115.71334 492.69099
1705.0000 -119.08045 -116.21680 2.86364 1.98250 -115.41566 491.48363
1710.0000 -118.45544 -115.00323 3.45221 1.98070 -115.43953 485.05212
1715.0000 -118.55696 -115.36504 3.19192 2.00492 -115.11959 500.90099
1720.0000 -118.87597 -116.13345 2.74252 1.95368 -115.79637 487.11347
1725.0000 -118.63830 -115.78118 2.85711 1.95410 -115.79086 465.46680
1730.0000 -118.23425 -115.33051 2.90375 1.96791 -115.60846 469.51819
1735.0000 -118.37508 -114.63416 3.74092 2.04153 -114.63609 539.82986
1740.0000 -118.35312 -115.46819 2.88493 2.03019 -114.78589 534.45109
1745.0000 -119.90295 -116.89418 3.00878 1.91410 -116.31918 454.80002
1750.0000 -118.44770 -116.05794 2.38976 1.90905 -116.38584 450.45884
MELTING PROCESS: loop number 8 T-loop= 516.00000000000000
main_MD> interactions number 8 at Temperature= 516.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.47579 -0.80443 0.07565
force_rgl> df(natom) -0.48647 -0.78594 -0.62311
1755.0000 -118.63781 -116.14256 2.49525 1.93640 -116.02454 468.56771
1760.0000 -119.15526 -115.76159 3.39367 1.93886 -115.99204 478.10879
1765.0000 -118.14562 -114.99861 3.14702 1.96718 -115.61808 489.11039
1770.0000 -118.67068 -115.65402 3.01666 1.99636 -115.23264 516.07120
1775.0000 -118.13088 -115.32351 2.80737 1.98135 -115.43093 490.60326
1780.0000 -118.94475 -115.24720 3.69755 1.99047 -115.31042 499.89131
1785.0000 -118.06676 -115.08390 2.98287 1.99735 -115.21956 521.13365
1790.0000 -118.43362 -115.19756 3.23605 1.98876 -115.33306 516.01594
1795.0000 -118.10098 -115.04845 3.05253 1.98753 -115.34925 509.83448
1800.0000 -118.43654 -115.17999 3.25655 2.01013 -115.05084 532.15159
1805.0000 -117.98951 -114.95493 3.03458 2.01797 -114.94717 527.34919
1810.0000 -118.31009 -114.64498 3.66512 2.02518 -114.85200 535.72389
1815.0000 -118.24047 -115.18975 3.05073 1.99780 -115.21364 505.53491
1820.0000 -118.56378 -115.74948 2.81430 1.97039 -115.57572 504.97025
1825.0000 -118.85630 -115.34183 3.51448 2.01785 -114.94880 570.15889
1830.0000 -118.68359 -115.96258 2.72101 1.96659 -115.62589 521.53663
1835.0000 -118.06343 -114.46346 3.59997 2.02748 -114.82169 547.63141
1840.0000 -118.34275 -115.35884 2.98391 2.00661 -115.09728 536.10210
1845.0000 -118.47171 -115.38906 3.08265 1.96936 -115.58922 482.38375
1850.0000 -118.58785 -115.39392 3.19393 1.97938 -115.45690 488.04782
1855.0000 -118.31682 -115.29762 3.01921 1.97879 -115.46470 501.47478
1860.0000 -118.70261 -115.56217 3.14044 1.97044 -115.57496 483.85182
1865.0000 -118.64993 -115.86756 2.78236 1.95296 -115.80583 470.09321
1870.0000 -117.82559 -114.36120 3.46438 1.99957 -115.19028 507.12241
1875.0000 -117.51024 -113.78277 3.72747 2.09766 -113.89469 590.90111
1880.0000 -117.85296 -113.61237 4.24059 2.13042 -113.46201 626.91121
1885.0000 -117.47464 -114.03180 3.44284 2.10248 -113.83110 583.24506
1890.0000 -117.66524 -114.88690 2.77834 2.04397 -114.60388 531.36226
1895.0000 -118.94565 -115.77801 3.16764 1.99561 -115.24255 505.40560
1900.0000 -118.02519 -114.71629 3.30891 1.98801 -115.34290 486.13314
1905.0000 -117.91775 -114.47493 3.44283 2.05868 -114.40958 573.79393
1910.0000 -117.98170 -114.88483 3.09687 2.04501 -114.59006 548.82906
1915.0000 -118.51802 -114.99339 3.52463 2.02086 -114.90907 532.61599
1920.0000 -117.93476 -114.84135 3.09341 1.99256 -115.28286 518.28986
1925.0000 -118.58741 -115.53333 3.05408 1.95988 -115.71447 499.91895
1930.0000 -118.34546 -115.19386 3.15160 1.98584 -115.37162 500.64729
1935.0000 -118.56932 -114.98372 3.58560 1.98959 -115.32203 511.50783
1940.0000 -117.95221 -114.86841 3.08381 2.04633 -114.57262 535.55998
1945.0000 -118.44918 -114.90816 3.54102 2.01590 -114.97463 508.84094
1950.0000 -118.64381 -115.52311 3.12070 2.01459 -114.99186 536.51593
1955.0000 -118.41952 -115.47701 2.94250 1.97249 -115.54797 487.15645
1960.0000 -118.51722 -115.96089 2.55632 1.94513 -115.90935 457.82247
1965.0000 -118.07040 -114.96422 3.10618 1.98526 -115.37923 484.59485
1970.0000 -118.13167 -114.37194 3.75973 2.05404 -114.47080 559.07023
1975.0000 -118.08390 -114.69521 3.38869 2.01862 -114.93866 531.61013
1980.0000 -117.93545 -114.93411 3.00134 1.99841 -115.20557 510.92033
1985.0000 -118.21036 -115.07675 3.13361 2.01920 -114.93103 527.60806
1990.0000 -117.73255 -114.47159 3.26096 2.02413 -114.86589 535.03042
1995.0000 -118.49654 -115.78175 2.71479 1.99453 -115.25682 500.99442
2000.0000 -118.57696 -115.23604 3.34093 1.99138 -115.29845 492.13616
MELTING PROCESS: loop number 9 T-loop= 541.00000000000000
main_MD> interactions number 9 at Temperature= 541.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.95100 -0.61870 0.17063
force_rgl> df(natom) -0.01133 1.26353 0.89987
2005.0000 -118.39807 -115.26014 3.13793 1.97708 -115.48736 492.71021
2010.0000 -119.35080 -116.31454 3.03626 1.94514 -115.90921 480.01654
2015.0000 -119.40162 -116.00267 3.39896 1.90610 -116.42474 478.02235
2020.0000 -119.25300 -116.32407 2.92894 1.94945 -115.85218 515.80977
2025.0000 -119.68180 -116.54173 3.14008 1.91317 -116.33140 479.34967
2030.0000 -118.92076 -116.00932 2.91143 1.93827 -115.99986 495.37146
2035.0000 -118.80785 -115.53929 3.26856 1.95755 -115.74520 521.56757
2040.0000 -117.93832 -114.58804 3.35028 2.01932 -114.92947 534.43789
2045.0000 -118.21554 -114.59522 3.62031 2.05622 -114.44199 557.64022
2050.0000 -118.55705 -115.90288 2.65416 1.98108 -115.43444 490.78777
2055.0000 -118.08494 -114.61109 3.47385 2.01633 -114.96887 549.63411
2060.0000 -117.45764 -113.84497 3.61267 2.08763 -114.02722 600.43572
2065.0000 -117.94536 -113.58547 4.35989 2.10947 -113.73875 591.90627
2070.0000 -117.34064 -113.77935 3.56129 2.08996 -113.99643 586.85336
2075.0000 -117.60855 -114.80850 2.80005 2.09269 -113.96041 582.95808
2080.0000 -118.78222 -115.77040 3.01182 2.00783 -115.08120 499.85157
2085.0000 -118.53958 -114.88365 3.65592 2.00947 -115.05946 548.43676
2090.0000 -118.57867 -115.72711 2.85156 1.97615 -115.49960 516.94944
2095.0000 -117.59221 -114.25621 3.33600 2.04015 -114.65428 560.87038
2100.0000 -118.36486 -114.83575 3.52911 2.02547 -114.84819 536.04678
2105.0000 -118.21454 -115.78883 2.42572 1.99814 -115.20911 508.68900
2110.0000 -117.94108 -114.99353 2.94755 1.97811 -115.47374 470.47855
2115.0000 -117.61330 -113.82233 3.79097 2.04293 -114.61754 516.63377
2120.0000 -117.15317 -114.19873 2.95444 2.07781 -114.15685 572.45140
2125.0000 -117.92955 -114.96772 2.96183 2.01833 -114.94244 529.18733
2130.0000 -118.24711 -115.10415 3.14296 2.03048 -114.78199 544.53443
2135.0000 -117.80818 -114.86177 2.94640 1.99614 -115.23559 526.34611
2140.0000 -118.24171 -114.70711 3.53460 2.02585 -114.84318 539.46347
2145.0000 -118.94482 -115.13903 3.80579 2.00791 -115.08008 502.79909
2150.0000 -117.64426 -114.81377 2.83049 1.98474 -115.38608 480.87644
2155.0000 -118.20192 -114.66537 3.53654 2.04271 -114.62050 545.94420
2160.0000 -118.38488 -115.00327 3.38161 2.01834 -114.94237 532.62612
2165.0000 -118.21608 -114.96658 3.24950 2.00318 -115.14262 526.16751
2170.0000 -118.08294 -114.83379 3.24915 2.00521 -115.11572 514.70442
2175.0000 -117.92217 -114.39024 3.53193 2.04232 -114.62561 519.14925
2180.0000 -118.43160 -114.86085 3.57075 2.03053 -114.78138 522.46303
2185.0000 -117.57680 -114.20094 3.37586 2.02853 -114.80779 514.66361
2190.0000 -117.97761 -114.88186 3.09575 2.01892 -114.93466 548.07082
2195.0000 -118.18735 -115.18447 3.00288 2.02947 -114.79533 537.02634
2200.0000 -118.03440 -114.37175 3.66265 2.01044 -115.04675 513.64762
2205.0000 -117.84155 -115.19365 2.64790 2.02454 -114.86042 513.22544
2210.0000 -118.87637 -115.59454 3.28183 2.00657 -115.09780 534.73552
2215.0000 -119.30751 -116.06223 3.24528 1.97008 -115.57980 556.12762
2220.0000 -119.95404 -115.84559 4.10845 1.93636 -116.02513 513.26884
2225.0000 -118.30789 -114.99359 3.31429 1.96207 -115.68561 513.52254
2230.0000 -118.50824 -114.29122 4.21702 2.02905 -114.80088 546.48391
2235.0000 -118.23177 -115.21856 3.01321 2.02733 -114.82366 545.54828
2240.0000 -118.70914 -115.34716 3.36198 1.97355 -115.53393 484.10040
2245.0000 -118.27753 -115.31706 2.96046 2.01404 -114.99920 550.48661
2250.0000 -118.46959 -115.30968 3.15991 2.00364 -115.13657 557.42566
MELTING PROCESS: loop number 10 T-loop= 566.00000000000000
main_MD> interactions number 10 at Temperature= 566.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.48869 -3.32714 -1.52163
force_rgl> df(natom) -1.19961 1.04681 -0.81825
2255.0000 -119.77565 -116.17188 3.60378 1.99443 -115.25820 557.70786
2260.0000 -118.88259 -115.31388 3.56871 2.00645 -115.09945 574.92699
2265.0000 -118.97122 -114.99593 3.97530 2.02721 -114.82526 586.78930
2270.0000 -119.55150 -115.78802 3.76348 1.96585 -115.63568 547.36164
2275.0000 -118.67273 -115.92824 2.74449 1.98094 -115.43633 556.52311
2280.0000 -119.47806 -116.00098 3.47708 1.91832 -116.26333 485.75447
2285.0000 -119.61965 -116.75690 2.86275 1.91402 -116.32016 481.03892
2290.0000 -119.15016 -115.82301 3.32715 1.91999 -116.24134 483.70236
2295.0000 -118.66330 -115.22959 3.43371 1.95753 -115.74548 532.02696
2300.0000 -118.68809 -114.62118 4.06690 2.01962 -114.92539 558.71351
2305.0000 -118.61561 -115.05101 3.56460 2.04353 -114.60963 595.86367
2310.0000 -118.42289 -114.75935 3.66355 2.01423 -114.99658 535.90834
2315.0000 -118.20475 -114.82182 3.38293 2.05600 -114.44491 554.23887
2320.0000 -118.21783 -114.83398 3.38385 2.06238 -114.36064 584.85597
2325.0000 -117.76158 -114.53133 3.23025 2.03375 -114.73877 531.95108
2330.0000 -118.20984 -114.88190 3.32795 2.09181 -113.97195 604.25150
2335.0000 -118.66395 -115.50467 3.15928 1.98334 -115.40468 542.45651
2340.0000 -118.60989 -115.54387 3.06602 1.96990 -115.58219 511.52780
2345.0000 -119.30690 -115.96462 3.34228 1.98014 -115.44684 532.67426
2350.0000 -118.03342 -114.68670 3.34672 1.98670 -115.36024 530.97701
2355.0000 -118.56073 -115.07686 3.48387 2.02990 -114.78961 566.84104
2360.0000 -118.90215 -115.80440 3.09774 2.00804 -115.07835 551.15931
2365.0000 -118.49026 -115.05246 3.43779 2.00426 -115.12838 541.18116
2370.0000 -117.62929 -114.46789 3.16139 2.00663 -115.09703 542.83118
2375.0000 -118.16261 -114.39766 3.76495 2.04119 -114.64051 563.62555
2380.0000 -117.67154 -114.04905 3.62249 2.07980 -114.13058 596.33125
2385.0000 -118.56620 -113.98037 4.58583 2.10144 -113.84485 627.10124
2390.0000 -118.09823 -114.77944 3.31879 2.04776 -114.55376 539.66012
2395.0000 -117.77179 -113.78773 3.98406 2.08841 -114.01690 568.56525
2400.0000 -118.55822 -115.17791 3.38031 2.05600 -114.44500 549.19895
2405.0000 -117.71612 -114.12965 3.58647 2.06599 -114.31307 568.16037
2410.0000 -116.87512 -113.18826 3.68686 2.13095 -113.45506 611.89392
2415.0000 -117.13179 -113.90175 3.23004 2.09763 -113.89509 585.76888
2420.0000 -117.92459 -114.87616 3.04843 2.07328 -114.21667 582.31688
2425.0000 -117.91078 -114.23025 3.68053 2.03121 -114.77235 551.98157
2430.0000 -117.57426 -113.94193 3.63234 2.09813 -113.88850 608.30339
2435.0000 -117.20416 -114.29374 2.91042 2.06367 -114.34363 587.58077
2440.0000 -118.34621 -114.85845 3.48776 2.05874 -114.40880 569.84592
2445.0000 -117.78130 -114.73792 3.04337 2.02720 -114.82538 547.25280
2450.0000 -117.92140 -114.57089 3.35051 2.05953 -114.39832 585.27412
2455.0000 -117.20996 -113.65463 3.55533 2.07287 -114.22219 575.42745
2460.0000 -118.03361 -115.32641 2.70720 2.03985 -114.65820 579.77695
2465.0000 -118.91399 -115.63639 3.27760 1.98456 -115.38850 527.82965
2470.0000 -119.25191 -115.80698 3.44493 1.95448 -115.78577 507.87355
2475.0000 -118.99667 -115.58510 3.41157 1.97809 -115.47395 560.64426
2480.0000 -118.86571 -115.95740 2.90830 1.93733 -116.01234 533.23400
2485.0000 -119.72325 -116.94621 2.77704 1.90080 -116.49478 494.79702
2490.0000 -118.25445 -115.31732 2.93713 1.93635 -116.02531 518.13844
2495.0000 -118.46999 -115.08026 3.38972 1.98785 -115.34502 530.89605
2500.0000 -117.50701 -114.17850 3.32851 2.07480 -114.19663 597.15572
MELTING PROCESS: loop number 11 T-loop= 591.00000000000000
main_MD> interactions number 11 at Temperature= 591.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.69136 1.01980 0.60200
force_rgl> df(natom) -2.34988 -2.42464 0.50386
2505.0000 -117.59439 -113.61626 3.97812 2.09456 -113.93566 598.58985
2510.0000 -117.18386 -113.20877 3.97509 2.13322 -113.42501 636.13328
2515.0000 -117.38829 -112.98354 4.40474 2.14151 -113.31559 633.19003
2520.0000 -118.13381 -114.71211 3.42170 2.13924 -113.34548 619.72077
2525.0000 -117.83376 -115.06820 2.76556 2.05099 -114.51113 565.60035
2530.0000 -118.47205 -114.17290 4.29915 2.04972 -114.52788 558.10645
2535.0000 -117.82653 -114.35107 3.47546 2.03569 -114.71325 533.26396
2540.0000 -118.04655 -114.25895 3.78760 2.07404 -114.20671 557.85971
2545.0000 -116.82277 -112.96752 3.85526 2.11840 -113.62078 593.98062
2550.0000 -117.15789 -113.46603 3.69186 2.13427 -113.41116 614.89039
2555.0000 -117.14874 -113.56336 3.58538 2.12871 -113.48456 592.92923
2560.0000 -117.93563 -114.05345 3.88218 2.14673 -113.24663 597.96623
2565.0000 -117.72682 -114.71411 3.01272 2.04875 -114.54076 545.22233
2570.0000 -117.03004 -113.43665 3.59340 2.09656 -113.90931 575.78391
2575.0000 -118.86729 -114.84376 4.02353 2.09941 -113.87161 593.98408
2580.0000 -117.52164 -113.62082 3.90082 2.08363 -114.08004 601.96055
2585.0000 -117.02879 -113.23158 3.79721 2.13621 -113.38556 608.45696
2590.0000 -116.56559 -113.25226 3.31333 2.15764 -113.10247 595.57852
2595.0000 -116.73052 -113.11626 3.61426 2.13638 -113.38334 566.04365
2600.0000 -116.94894 -112.98707 3.96187 2.15996 -113.07182 602.69501
2605.0000 -117.81419 -113.90238 3.91181 2.14054 -113.32834 619.97371
2610.0000 -117.57545 -113.65987 3.91558 2.08549 -114.05544 592.96340
2615.0000 -116.58308 -113.57711 3.00597 2.12838 -113.48894 599.75932
2620.0000 -117.35802 -113.15438 4.20364 2.12960 -113.47290 620.52414
2625.0000 -117.08367 -114.23222 2.85144 2.15042 -113.19783 584.64178
2630.0000 -117.86783 -114.36018 3.50765 2.10006 -113.86308 578.72825
2635.0000 -117.26366 -113.85188 3.41178 2.08544 -114.05606 570.71919
2640.0000 -117.78970 -114.22839 3.56131 2.05246 -114.49167 540.40833
2645.0000 -118.51272 -114.88970 3.62301 2.02702 -114.82768 538.93537
2650.0000 -116.99354 -113.95855 3.03499 2.06189 -114.36711 571.76608
2655.0000 -118.05759 -113.95706 4.10053 2.08982 -113.99825 580.56155
2660.0000 -117.96906 -114.15031 3.81875 2.11409 -113.67767 626.57559
2665.0000 -118.11637 -115.18909 2.92729 2.05582 -114.44727 563.10982
2670.0000 -118.03938 -114.93087 3.10851 2.00967 -115.05682 533.18271
2675.0000 -118.19297 -115.12819 3.06478 2.01750 -114.95349 541.21065
2680.0000 -118.35243 -114.73960 3.61283 2.01656 -114.96585 566.57595
2685.0000 -118.13314 -114.37088 3.76227 2.05715 -114.42981 614.21175
2690.0000 -118.45050 -115.76772 2.68278 2.02809 -114.81356 564.44684
2695.0000 -119.28066 -115.63079 3.64987 1.97912 -115.46041 500.42341
2700.0000 -117.75617 -114.42076 3.33541 2.00360 -115.13709 540.36010
2705.0000 -117.56558 -113.51575 4.04983 2.10383 -113.81320 623.21356
2710.0000 -117.65155 -113.70003 3.95151 2.11176 -113.70854 617.30565
2715.0000 -117.23973 -114.25671 2.98302 2.11381 -113.68140 611.79741
2720.0000 -118.14969 -114.58068 3.56901 2.05246 -114.49167 584.74956
2725.0000 -118.06011 -115.03329 3.02682 2.06276 -114.35566 552.34811
2730.0000 -118.48446 -114.48650 3.99796 2.05860 -114.41063 546.55523
2735.0000 -118.19281 -114.74999 3.44282 2.11074 -113.72200 601.79881
2740.0000 -118.16348 -115.11982 3.04366 2.03740 -114.69067 525.91497
2745.0000 -117.54321 -114.54858 2.99463 2.02575 -114.84445 533.43173
2750.0000 -118.02733 -114.31830 3.70903 2.08900 -114.00913 581.09397
MELTING PROCESS: loop number 12 T-loop= 616.00000000000000
main_MD> interactions number 12 at Temperature= 616.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.35323 4.47769 -1.48189
force_rgl> df(natom) 0.37365 0.67031 -2.26178
2755.0000 -117.29080 -113.69233 3.59847 2.09663 -113.90826 559.80946
2760.0000 -117.77962 -114.06487 3.71475 2.09886 -113.87889 603.58928
2765.0000 -117.00970 -113.14977 3.85993 2.11046 -113.72566 595.42084
2770.0000 -117.30347 -112.97329 4.33018 2.15257 -113.16952 640.76642
2775.0000 -116.02226 -112.58172 3.44054 2.20690 -112.45193 672.80415
2780.0000 -117.26652 -113.07636 4.19016 2.18204 -112.78019 655.90859
2785.0000 -115.96278 -112.00669 3.95610 2.22452 -112.21920 722.08163
2790.0000 -116.22126 -112.11243 4.10883 2.24389 -111.96337 707.23279
2795.0000 -116.42526 -112.27061 4.15465 2.25715 -111.78822 715.08831
2800.0000 -116.93875 -112.33762 4.60113 2.21071 -112.40161 670.33751
2805.0000 -116.87380 -112.08968 4.78412 2.19888 -112.55781 676.99636
2810.0000 -116.26518 -111.79669 4.46849 2.26971 -111.62238 733.78360
2815.0000 -116.77706 -113.15971 3.61734 2.19245 -112.64280 645.23124
2820.0000 -115.84611 -111.62178 4.22434 2.19120 -112.65930 673.90813
2825.0000 -116.41706 -111.82889 4.58817 2.27501 -111.55239 719.54954
2830.0000 -116.67597 -113.33136 3.34461 2.19091 -112.66316 638.28584
2835.0000 -116.71501 -111.57385 5.14116 2.20567 -112.46814 643.85056
2840.0000 -116.24533 -113.56431 2.68103 2.20448 -112.48384 667.31515
2845.0000 -117.84472 -114.02365 3.82106 2.11638 -113.64749 577.57691
2850.0000 -117.04935 -113.38922 3.66014 2.10834 -113.75370 597.69858
2855.0000 -117.88041 -113.74498 4.13544 2.14379 -113.28539 625.14621
2860.0000 -118.62260 -114.22830 4.39430 2.09796 -113.89081 610.82301
2865.0000 -117.92802 -113.55095 4.37707 2.10765 -113.76274 616.71987
2870.0000 -117.57333 -113.63411 3.93922 2.10285 -113.82614 590.36668
2875.0000 -117.99346 -114.16088 3.83258 2.11156 -113.71109 617.68996
2880.0000 -117.77335 -113.45652 4.31684 2.12417 -113.54457 627.03264
2885.0000 -118.07022 -113.38471 4.68551 2.14328 -113.29222 637.43100
2890.0000 -116.61417 -113.07896 3.53521 2.15244 -113.17117 671.60524
2895.0000 -116.42056 -112.35241 4.06816 2.20189 -112.51812 669.88873
2900.0000 -117.42632 -113.56088 3.86544 2.15354 -113.15673 644.30766
2905.0000 -117.63736 -113.36802 4.26934 2.12071 -113.59030 611.75419
2910.0000 -117.67798 -113.95744 3.72054 2.14776 -113.23297 639.05310
2915.0000 -117.29406 -113.23221 4.06185 2.10057 -113.85624 594.47892
2920.0000 -117.00529 -113.42261 3.58269 2.11445 -113.67296 603.18548
2925.0000 -117.90250 -114.25871 3.64379 2.11465 -113.67031 605.44813
2930.0000 -117.14256 -113.88503 3.25753 2.07450 -114.20065 552.44038
2935.0000 -117.54529 -114.07478 3.47051 2.09025 -113.99263 579.88777
2940.0000 -117.14788 -112.62199 4.52589 2.13768 -113.36610 615.45294
2945.0000 -116.61810 -113.37245 3.24565 2.17267 -112.90405 657.10948
2950.0000 -116.66341 -111.83654 4.82687 2.18627 -112.72442 614.29781
2955.0000 -117.40180 -113.34534 4.05647 2.15993 -113.07232 657.94129
2960.0000 -117.53998 -113.17440 4.36557 2.09563 -113.92159 590.16991
2965.0000 -117.81766 -114.61495 3.20270 2.13601 -113.38826 629.34840
2970.0000 -117.36186 -113.41487 3.94699 2.06772 -114.29018 570.84355
2975.0000 -117.55121 -114.44851 3.10270 2.09695 -113.90405 568.09264
2980.0000 -117.61472 -114.23007 3.38466 2.05679 -114.43456 550.71015
2985.0000 -117.18632 -112.90657 4.27975 2.12534 -113.52910 620.81505
2990.0000 -116.69501 -112.81550 3.87951 2.19223 -112.64561 686.70844
2995.0000 -117.24431 -113.72827 3.51604 2.13795 -113.36256 630.05467
3000.0000 -117.75052 -113.83879 3.91172 2.10071 -113.85444 612.80166
MELTING PROCESS: loop number 13 T-loop= 641.00000000000000
main_MD> interactions number 13 at Temperature= 641.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.28228 -0.52054 -1.21297
force_rgl> df(natom) -2.97562 1.68441 -0.11975
3005.0000 -116.71671 -112.65711 4.05961 2.11501 -113.66553 608.63893
3010.0000 -116.26455 -112.59159 3.67296 2.17826 -112.83012 650.67303
3015.0000 -116.59286 -113.24304 3.34982 2.20322 -112.50055 657.03505
3020.0000 -117.17995 -113.20417 3.97577 2.13289 -113.42945 609.14638
3025.0000 -116.67757 -112.51718 4.16039 2.15527 -113.13377 623.88318
3030.0000 -116.60458 -112.13877 4.46581 2.13832 -113.35769 613.88374
3035.0000 -116.83862 -112.73049 4.10813 2.19332 -112.63130 678.24921
3040.0000 -117.03548 -113.63301 3.40247 2.14496 -113.27000 623.45909
3045.0000 -117.72896 -113.67970 4.04925 2.15721 -113.10823 634.62081
3050.0000 -116.48927 -112.19103 4.29824 2.18219 -112.77824 675.27639
3055.0000 -116.75012 -112.59324 4.15688 2.19846 -112.56334 663.72128
3060.0000 -116.84519 -112.74629 4.09889 2.16526 -113.00191 618.43320
3065.0000 -116.45911 -112.62093 3.83819 2.19096 -112.66239 637.96799
3070.0000 -115.77515 -111.40492 4.37022 2.25416 -111.82765 675.86557
3075.0000 -116.90961 -112.36621 4.54340 2.27683 -111.52835 688.22304
3080.0000 -116.23739 -112.70574 3.53165 2.21978 -112.28182 696.18016
3085.0000 -117.73828 -113.62203 4.11625 2.15934 -113.08013 630.04310
3090.0000 -117.54042 -113.93892 3.60150 2.10862 -113.74999 585.62452
3095.0000 -116.35433 -112.32157 4.03276 2.16460 -113.01062 655.54366
3100.0000 -117.02686 -113.35908 3.66779 2.17102 -112.92581 655.26357
3105.0000 -115.56114 -111.63143 3.92971 2.22155 -112.25836 683.21670
3110.0000 -118.43107 -113.27081 5.16026 2.18007 -112.80626 624.39747
3115.0000 -116.24044 -113.00909 3.23135 2.20375 -112.49352 668.27180
3120.0000 -117.24650 -113.04108 4.20541 2.13466 -113.40610 657.65177
3125.0000 -117.13439 -113.68005 3.45434 2.11885 -113.61487 616.58843
3130.0000 -117.40951 -113.47100 3.93851 2.13819 -113.35939 634.38287
3135.0000 -116.42180 -112.93724 3.48457 2.14666 -113.24750 643.08265
3140.0000 -116.44118 -112.37294 4.06824 2.20923 -112.42114 670.64783
3145.0000 -116.88480 -112.85222 4.03258 2.19731 -112.57855 683.65215
3150.0000 -117.18941 -113.36436 3.82505 2.15994 -113.07216 625.59140
3155.0000 -116.78930 -112.97154 3.81776 2.16520 -113.00265 646.62135
3160.0000 -116.29336 -113.08053 3.21283 2.17027 -112.93575 639.64144
3165.0000 -117.17934 -113.01662 4.16272 2.15307 -113.16286 608.60354
3170.0000 -116.96348 -112.38780 4.57568 2.16421 -113.01577 610.59097
3175.0000 -117.39972 -113.43470 3.96502 2.17642 -112.85447 652.17937
3180.0000 -117.69735 -113.54294 4.15441 2.10586 -113.78644 603.75832
3185.0000 -116.92046 -113.72473 3.19573 2.11471 -113.66954 617.70961
3190.0000 -117.85067 -113.19206 4.65861 2.14872 -113.22037 650.66802
3195.0000 -117.26733 -112.57862 4.68871 2.19698 -112.58292 697.04876
3200.0000 -116.24750 -112.16616 4.08135 2.22035 -112.27422 695.05526
3205.0000 -116.19535 -111.89925 4.29610 2.21107 -112.39678 666.28306
3210.0000 -116.77596 -112.69986 4.07610 2.20143 -112.52418 666.50598
3215.0000 -115.82815 -111.19218 4.63597 2.26665 -111.66274 696.87962
3220.0000 -116.51706 -112.50607 4.01099 2.24931 -111.89177 723.89826
3225.0000 -117.69637 -113.30626 4.39011 2.17556 -112.86581 654.14266
3230.0000 -116.83978 -112.86703 3.97275 2.15107 -113.18928 640.23816
3235.0000 -116.47470 -111.49632 4.97838 2.21869 -112.29613 678.95725
3240.0000 -116.21534 -111.66807 4.54726 2.29013 -111.35261 732.46899
3245.0000 -116.57243 -113.01094 3.56149 2.23901 -112.02775 716.47839
3250.0000 -116.88265 -113.68059 3.20206 2.12127 -113.58290 596.58611
MELTING PROCESS: loop number 14 T-loop= 666.00000000000000
main_MD> interactions number 14 at Temperature= 666.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.88573 -1.88636 -0.44821
force_rgl> df(natom) -3.89978 6.44242 -4.74109
3255.0000 -117.60707 -113.85060 3.75648 2.09079 -113.98552 576.22824
3260.0000 -117.80939 -113.78649 4.02290 2.09225 -113.96613 620.37101
3265.0000 -116.22317 -111.81341 4.40976 2.15806 -113.09699 644.18879
3270.0000 -116.14930 -112.27585 3.87345 2.26777 -111.64795 711.87380
3275.0000 -116.70752 -112.66197 4.04555 2.19486 -112.61095 672.15658
3280.0000 -117.04006 -113.21175 3.82830 2.15588 -113.12575 621.33357
3285.0000 -117.28850 -113.02463 4.26387 2.12971 -113.47136 588.65741
3290.0000 -116.83745 -112.72848 4.10896 2.22803 -112.17282 677.13717
3295.0000 -116.82348 -113.17934 3.64415 2.21922 -112.28919 671.59964
3300.0000 -116.90048 -113.86878 3.03170 2.13771 -113.36576 641.99776
3305.0000 -117.13748 -114.09891 3.03857 2.10276 -113.82732 594.99864
3310.0000 -117.45617 -114.28893 3.16723 2.10103 -113.85016 598.78620
3315.0000 -117.46310 -113.57488 3.88821 2.10220 -113.83474 589.81549
3320.0000 -117.39353 -114.40024 2.99330 2.09222 -113.96660 596.07078
3325.0000 -117.09756 -113.25567 3.84189 2.08556 -114.05448 559.95017
3330.0000 -116.13761 -111.97416 4.16344 2.21892 -112.29317 693.94186
3335.0000 -116.64228 -113.31201 3.33027 2.20120 -112.52720 650.37106
3340.0000 -116.72740 -112.74933 3.97807 2.16155 -113.05086 619.89146
3345.0000 -115.85711 -111.85548 4.00163 2.19556 -112.60174 674.37635
3350.0000 -116.95066 -112.09406 4.85660 2.21677 -112.32161 660.84801
3355.0000 -117.79724 -113.38116 4.41608 2.19658 -112.58821 677.50121
3360.0000 -117.09797 -112.26714 4.83083 2.16276 -113.03490 635.16193
3365.0000 -116.18678 -111.46817 4.71862 2.24091 -112.00270 681.77818
3370.0000 -115.49933 -110.49060 5.00874 2.30800 -111.11659 759.41336
3375.0000 -114.73573 -111.42899 3.30673 2.30421 -111.16669 737.03561
3380.0000 -117.07987 -112.14250 4.93738 2.25011 -111.88126 664.05844
3385.0000 -116.20863 -112.10744 4.10119 2.22491 -112.21399 696.79523
3390.0000 -117.43459 -112.93386 4.50072 2.15968 -113.07556 639.33501
3395.0000 -116.42636 -112.48225 3.94412 2.16125 -113.05479 648.05781
3400.0000 -116.89741 -113.20944 3.68798 2.19982 -112.54539 679.26901
3405.0000 -116.46559 -112.20088 4.26471 2.17303 -112.89923 659.98130
3410.0000 -117.33015 -112.91286 4.41729 2.17988 -112.80880 661.52956
3415.0000 -117.10457 -113.41345 3.69111 2.15779 -113.10054 627.68887
3420.0000 -116.64015 -112.79017 3.84998 2.16385 -113.02055 613.41801
3425.0000 -116.77732 -111.81362 4.96370 2.22344 -112.23351 696.08721
3430.0000 -117.91504 -114.26985 3.64519 2.14286 -113.29772 622.17439
3435.0000 -118.70130 -115.03217 3.66913 2.02427 -114.86398 545.23191
3440.0000 -118.71691 -114.85836 3.85855 2.01762 -114.95181 544.50355
3445.0000 -117.09707 -113.47767 3.61940 2.10407 -113.81002 612.57559
3450.0000 -116.93166 -112.63668 4.29498 2.13123 -113.45127 632.87733
3455.0000 -117.43455 -114.19035 3.24420 2.12344 -113.55427 612.81837
3460.0000 -117.39869 -112.76846 4.63023 2.10898 -113.74518 606.76748
3465.0000 -116.99963 -113.30231 3.69732 2.12110 -113.58508 605.29535
3470.0000 -116.53779 -112.00635 4.53144 2.20942 -112.41856 684.47324
3475.0000 -116.42758 -112.25898 4.16860 2.23595 -112.06817 713.85076
3480.0000 -116.22298 -112.01968 4.20330 2.25623 -111.80039 743.10779
3485.0000 -117.23580 -113.83693 3.39887 2.16983 -112.94150 637.03327
3490.0000 -116.42945 -112.12683 4.30261 2.19631 -112.59183 683.13388
3495.0000 -115.94909 -111.45740 4.49169 2.23190 -112.12175 664.16897
3500.0000 -116.31158 -112.17596 4.13561 2.25938 -111.75874 692.55067
MELTING PROCESS: loop number 15 T-loop= 691.00000000000000
main_MD> interactions number 15 at Temperature= 691.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.46554 2.06492 0.97661
force_rgl> df(natom) 1.03070 -0.89442 -0.43062
3505.0000 -115.72377 -111.36679 4.35698 2.26411 -111.69623 696.46737
3510.0000 -115.63730 -111.22261 4.41469 2.32046 -110.95201 758.54416
3515.0000 -115.77772 -112.15744 3.62028 2.24004 -112.01427 674.49106
3520.0000 -116.58934 -111.96648 4.62286 2.23779 -112.04396 684.27423
3525.0000 -116.03655 -112.67662 3.35994 2.19162 -112.65371 649.92746
3530.0000 -117.39087 -112.58500 4.80587 2.20603 -112.46340 653.02974
3535.0000 -115.52261 -110.82050 4.70211 2.28474 -111.42377 753.24587
3540.0000 -114.70396 -110.67805 4.02591 2.34906 -110.57424 799.74470
3545.0000 -115.08818 -109.98455 5.10363 2.37437 -110.24007 805.43892
3550.0000 -115.13636 -111.05247 4.08390 2.31611 -111.00945 758.23094
3555.0000 -116.00984 -112.16907 3.84077 2.25566 -111.80790 684.53930
3560.0000 -115.82720 -111.16977 4.65744 2.26821 -111.64217 719.03280
3565.0000 -115.74964 -111.01513 4.73452 2.31852 -110.97771 745.66450
3570.0000 -115.50449 -110.92140 4.58309 2.34597 -110.61513 779.15564
3575.0000 -115.02074 -110.64255 4.37819 2.30732 -111.12559 768.25417
3580.0000 -117.46948 -112.01698 5.45249 2.34727 -110.59800 775.31690
3585.0000 -117.57901 -113.29860 4.28041 2.15081 -113.19267 647.40931
3590.0000 -116.70536 -112.43375 4.27161 2.17092 -112.92706 648.63185
3595.0000 -115.63827 -111.10186 4.53642 2.26671 -111.66190 723.02551
3600.0000 -116.77496 -112.76626 4.00870 2.25203 -111.85587 696.83250
3605.0000 -117.29295 -112.84542 4.44753 2.14853 -113.22285 629.67591
3610.0000 -116.91682 -112.85800 4.05882 2.18227 -112.77717 640.06310
3615.0000 -116.17366 -111.94309 4.23057 2.19085 -112.66383 654.61612
3620.0000 -115.71067 -112.22396 3.48670 2.27625 -111.53598 698.77572
3625.0000 -115.95507 -111.49863 4.45644 2.28911 -111.36606 696.38588
3630.0000 -115.07125 -110.78647 4.28478 2.29454 -111.29432 715.56235
3635.0000 -115.94745 -112.06041 3.88704 2.31481 -111.02672 735.20867
3640.0000 -115.36256 -111.33056 4.03200 2.26837 -111.63998 710.59712
3645.0000 -116.53186 -112.07298 4.45888 2.29202 -111.32771 770.76367
3650.0000 -116.10595 -111.26612 4.83983 2.23732 -112.05010 693.22583
3655.0000 -115.92643 -112.11936 3.80708 2.24243 -111.98267 673.02847
3660.0000 -116.28172 -112.91217 3.36955 2.21018 -112.40860 645.75558
3665.0000 -115.85543 -112.17336 3.68207 2.24248 -111.98196 721.22861
3670.0000 -116.33254 -112.64421 3.68834 2.26384 -111.69982 721.25910
3675.0000 -115.88828 -112.52869 3.35959 2.24009 -112.01359 718.61686
3680.0000 -116.00947 -111.76838 4.24109 2.24033 -112.01043 711.80457
3685.0000 -115.97583 -112.41632 3.55950 2.23007 -112.14595 685.69414
3690.0000 -116.47127 -113.08203 3.38923 2.20863 -112.42910 640.31972
3695.0000 -116.86025 -112.85560 4.00465 2.22708 -112.18540 677.40326
3700.0000 -116.27306 -111.15995 5.11312 2.22990 -112.14808 673.88441
3705.0000 -116.70517 -112.27184 4.43333 2.22113 -112.26391 678.26656
3710.0000 -116.95344 -112.42354 4.52990 2.17897 -112.82082 640.07587
3715.0000 -116.99987 -112.74908 4.25080 2.21663 -112.32343 678.40959
3720.0000 -117.05524 -112.39550 4.65974 2.18834 -112.69706 666.52264
3725.0000 -116.63453 -112.18556 4.44896 2.21738 -112.31355 696.04376
3730.0000 -117.49172 -113.81772 3.67400 2.15155 -113.18289 646.38383
3735.0000 -116.86489 -112.59101 4.27388 2.14546 -113.26333 635.81975
3740.0000 -116.26029 -112.18406 4.07624 2.21308 -112.37025 718.38490
3745.0000 -116.85402 -112.54151 4.31251 2.23178 -112.12331 713.21653
3750.0000 -116.51873 -112.69074 3.82798 2.20829 -112.43351 675.91342
MELTING PROCESS: loop number 16 T-loop= 716.00000000000000
main_MD> interactions number 16 at Temperature= 716.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.48992 -0.88123 1.48710
force_rgl> df(natom) -1.55253 -4.21382 -2.24250
3755.0000 -116.86699 -112.14986 4.71713 2.16308 -113.03062 632.59858
3760.0000 -116.31488 -111.91505 4.39982 2.21136 -112.39303 663.86719
3765.0000 -115.33443 -111.62223 3.71219 2.25269 -111.84708 736.39793
3770.0000 -116.71518 -112.29816 4.41702 2.22663 -112.19128 688.24433
3775.0000 -116.03516 -112.46532 3.56984 2.18598 -112.72816 669.59617
3780.0000 -116.93357 -112.28717 4.64641 2.21828 -112.30158 693.99580
3785.0000 -116.10716 -112.16667 3.94049 2.23149 -112.12719 683.11292
3790.0000 -116.15098 -111.30970 4.84127 2.22156 -112.25831 647.30662
3795.0000 -117.18442 -111.68332 5.50109 2.26314 -111.70905 717.93505
3800.0000 -114.73915 -110.74789 3.99126 2.29107 -111.34020 751.93397
3805.0000 -116.06691 -111.37158 4.69533 2.34296 -110.65481 778.74275
3810.0000 -116.90316 -112.75914 4.14403 2.23853 -112.03412 700.52949
3815.0000 -117.52770 -112.68326 4.84444 2.20791 -112.43861 693.70235
3820.0000 -116.78944 -112.54145 4.24800 2.20834 -112.43285 650.33180
3825.0000 -117.58483 -113.39910 4.18572 2.20551 -112.47032 677.99878
3830.0000 -116.36140 -111.69573 4.66567 2.21287 -112.37299 673.05195
3835.0000 -117.18749 -111.69915 5.48834 2.27365 -111.57024 736.38992
3840.0000 -116.76864 -111.37368 5.39496 2.29687 -111.26366 734.35532
3845.0000 -116.43287 -112.24459 4.18829 2.29823 -111.24568 745.45582
3850.0000 -116.72765 -112.41605 4.31161 2.23698 -112.05468 696.31716
3855.0000 -116.33284 -111.90652 4.42632 2.27118 -111.60287 728.95754
3860.0000 -117.15004 -112.21114 4.93889 2.25682 -111.79253 716.27446
3865.0000 -116.52848 -112.25816 4.27031 2.22903 -112.15965 708.77014
3870.0000 -116.59297 -112.54355 4.04942 2.19621 -112.59309 698.64468
3875.0000 -116.09209 -111.53528 4.55681 2.21219 -112.38210 708.39393
3880.0000 -117.75472 -112.59559 5.15914 2.19099 -112.66203 676.85616
3885.0000 -117.62864 -113.95394 3.67470 2.15333 -113.15939 652.86980
3890.0000 -116.99889 -113.35414 3.64475 2.12120 -113.58374 599.71829
3895.0000 -115.52247 -111.37845 4.14402 2.23725 -112.05111 661.66645
3900.0000 -115.67558 -110.90611 4.76947 2.31868 -110.97558 728.50505
3905.0000 -115.42693 -110.45310 4.97384 2.35266 -110.52670 778.62268
3910.0000 -115.20907 -110.84110 4.36797 2.33005 -110.82543 757.92860
3915.0000 -116.12936 -110.08768 6.04168 2.37934 -110.17442 807.03365
3920.0000 -115.37219 -110.36081 5.01138 2.37847 -110.18585 791.91856
3925.0000 -115.80320 -111.55396 4.24924 2.31618 -111.00854 761.93481
3930.0000 -116.88212 -111.59335 5.28877 2.28474 -111.42379 744.18773
3935.0000 -115.46620 -110.95181 4.51439 2.28882 -111.36987 723.27350
3940.0000 -115.20638 -110.77134 4.43504 2.28400 -111.43357 746.52789
3945.0000 -116.60278 -112.00534 4.59744 2.25319 -111.84054 677.49828
3950.0000 -115.81082 -111.54727 4.26354 2.23329 -112.10339 727.50785
3955.0000 -115.59477 -111.72766 3.86710 2.26997 -111.61886 732.84358
3960.0000 -114.75617 -110.37348 4.38270 2.32054 -110.95105 732.45522
3965.0000 -116.27469 -111.62581 4.64888 2.27792 -111.51386 712.44543
3970.0000 -116.93871 -112.49673 4.44198 2.22212 -112.25095 680.43670
3975.0000 -117.06376 -112.42095 4.64281 2.23128 -112.12987 690.44199
3980.0000 -116.69886 -112.71121 3.98765 2.21438 -112.35313 683.01612
3985.0000 -116.79706 -113.27251 3.52455 2.14993 -113.20436 648.93284
3990.0000 -116.86074 -112.67413 4.18661 2.19773 -112.57305 687.97520
3995.0000 -115.43122 -111.84733 3.58389 2.23200 -112.12042 722.48954
4000.0000 -117.28864 -113.44943 3.83921 2.23514 -112.07894 720.97982
MELTING PROCESS: loop number 17 T-loop= 741.00000000000000
main_MD> interactions number 17 at Temperature= 741.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.87381 -0.64676 3.08131
force_rgl> df(natom) -2.96982 -3.36460 0.72125
4005.0000 -117.02715 -112.11120 4.91594 2.20284 -112.50549 686.57285
4010.0000 -116.17205 -112.24483 3.92722 2.24342 -111.96961 699.52384
4015.0000 -116.96259 -112.46406 4.49853 2.22247 -112.24626 697.19138
4020.0000 -116.62819 -112.97981 3.64838 2.18204 -112.78025 673.64122
4025.0000 -116.60202 -111.20993 5.39209 2.23788 -112.04276 673.73854
4030.0000 -114.80924 -110.90145 3.90779 2.29913 -111.23382 748.50798
4035.0000 -115.53950 -111.47843 4.06107 2.26142 -111.73185 727.24555
4040.0000 -116.02181 -112.53386 3.48796 2.27331 -111.57479 719.03969
4045.0000 -115.84827 -110.53834 5.30993 2.29387 -111.30319 750.35585
4050.0000 -115.39196 -110.28444 5.10751 2.35746 -110.46342 777.90865
4055.0000 -116.34251 -110.55584 5.78667 2.39003 -110.03315 834.14517
4060.0000 -115.28899 -110.66952 4.61947 2.34038 -110.68898 774.04863
4065.0000 -114.70349 -110.14526 4.55823 2.37229 -110.26752 812.35046
4070.0000 -114.06953 -109.43586 4.63366 2.38910 -110.04542 798.46512
4075.0000 -115.23376 -109.90962 5.32414 2.41894 -109.65136 834.11524
4080.0000 -115.74245 -111.40538 4.33706 2.37362 -110.24993 833.05625
4085.0000 -116.95500 -112.58502 4.36998 2.23802 -112.04086 688.14767
4090.0000 -115.50801 -111.00093 4.50708 2.26218 -111.72180 730.96819
4095.0000 -114.93713 -110.62096 4.31616 2.31014 -111.08838 745.71889
4100.0000 -115.86187 -110.45578 5.40609 2.36913 -110.30925 792.64516
4105.0000 -115.41079 -110.05407 5.35671 2.40339 -109.85666 812.97763
4110.0000 -115.37342 -110.38994 4.98348 2.37042 -110.29216 838.67234
4115.0000 -117.49825 -110.74703 6.75121 2.35161 -110.54065 799.98839
4120.0000 -115.81435 -111.18494 4.62941 2.31087 -111.07876 760.79002
4125.0000 -116.87477 -113.09590 3.77887 2.24114 -111.99972 696.88253
4130.0000 -116.03766 -111.17617 4.86150 2.21119 -112.39520 689.05277
4135.0000 -115.99893 -111.20138 4.79755 2.31272 -111.05420 759.02379
4140.0000 -116.41549 -111.09276 5.32274 2.33048 -110.81964 757.07691
4145.0000 -115.87698 -111.05639 4.82059 2.35444 -110.50324 801.89966
4150.0000 -115.79405 -111.23752 4.55654 2.27935 -111.49507 731.18655
4155.0000 -114.39294 -110.28408 4.10885 2.28905 -111.36694 747.56769
4160.0000 -115.74883 -110.57945 5.16939 2.40014 -109.89960 820.14125
4165.0000 -114.56155 -109.71429 4.84725 2.40568 -109.82652 832.62745
4170.0000 -115.59010 -110.47455 5.11555 2.40057 -109.89397 827.23659
4175.0000 -115.77574 -110.50360 5.27214 2.36627 -110.34701 799.59490
4180.0000 -115.97010 -111.68258 4.28753 2.31288 -111.05216 760.15370
4185.0000 -115.44412 -110.39378 5.05035 2.33162 -110.80458 755.37302
4190.0000 -116.05984 -110.55110 5.50875 2.39968 -109.90567 833.02680
4195.0000 -115.69173 -110.79944 4.89228 2.38456 -110.10548 825.67934
4200.0000 -114.36701 -109.47825 4.88876 2.35828 -110.45252 787.86604
4205.0000 -115.27812 -111.29245 3.98568 2.39149 -110.01394 798.36893
4210.0000 -116.00333 -111.55347 4.44986 2.30047 -111.21611 762.60232
4215.0000 -115.80639 -110.78467 5.02173 2.31703 -110.99736 724.31812
4220.0000 -114.98097 -110.08162 4.89935 2.40244 -109.86922 801.03426
4225.0000 -115.78601 -110.61456 5.17145 2.30360 -111.17473 744.57013
4230.0000 -116.90765 -112.57448 4.33317 2.24417 -111.95971 705.06618
4235.0000 -116.20524 -111.84735 4.35789 2.23222 -112.11754 708.62870
4240.0000 -116.48749 -112.36730 4.12019 2.26093 -111.73825 721.44290
4245.0000 -116.07645 -112.31827 3.75818 2.21943 -112.28637 684.20609
4250.0000 -115.86770 -111.40246 4.46524 2.26229 -111.72039 708.08986
MELTING PROCESS: loop number 18 T-loop= 766.00000000000000
main_MD> interactions number 18 at Temperature= 766.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.88386 -0.72999 -0.53082
force_rgl> df(natom) 2.50586 1.17501 0.40152
4255.0000 -115.74792 -111.05415 4.69377 2.30312 -111.18101 717.15286
4260.0000 -116.51234 -112.39323 4.11911 2.26547 -111.67829 727.96672
4265.0000 -114.83687 -110.21912 4.61775 2.29703 -111.26152 727.71018
4270.0000 -115.19835 -109.85523 5.34312 2.41570 -109.69419 828.34724
4275.0000 -115.14747 -110.61835 4.52912 2.39925 -109.91134 831.08520
4280.0000 -115.32674 -110.84460 4.48214 2.29085 -111.34319 719.79050
4285.0000 -116.04586 -112.03775 4.00810 2.31363 -111.04221 792.86862
4290.0000 -116.77772 -112.86873 3.90900 2.24793 -111.91004 694.08961
4295.0000 -115.98443 -111.99781 3.98662 2.23019 -112.14425 692.13828
4300.0000 -116.27025 -111.89306 4.37720 2.27077 -111.60834 718.39126
4305.0000 -116.30552 -112.06624 4.23927 2.26392 -111.69879 726.97900
4310.0000 -115.25505 -110.53889 4.71617 2.30011 -111.22081 716.80925
4315.0000 -116.85439 -110.98951 5.86488 2.33050 -110.81948 787.64103
4320.0000 -116.80465 -111.65681 5.14785 2.25849 -111.77051 723.29414
4325.0000 -116.66974 -111.98593 4.68381 2.26321 -111.70824 707.91630
4330.0000 -115.75657 -112.30860 3.44797 2.24046 -112.00861 664.45713
4335.0000 -114.94594 -110.68963 4.25631 2.28319 -111.44432 736.32450
4340.0000 -113.92824 -109.36963 4.55861 2.41667 -109.68130 819.98350
4345.0000 -115.56987 -110.52804 5.04183 2.40146 -109.88218 776.80528
4350.0000 -116.28880 -111.21503 5.07376 2.35055 -110.55462 838.11949
4355.0000 -115.82946 -111.01396 4.81550 2.30302 -111.18242 766.97437
4360.0000 -116.95527 -112.25161 4.70367 2.23149 -112.12712 720.32707
4365.0000 -116.58557 -112.29142 4.29415 2.20939 -112.41901 702.88343
4370.0000 -116.77985 -112.20014 4.57972 2.21800 -112.30535 695.02203
4375.0000 -116.67883 -111.99195 4.68689 2.29487 -111.29008 740.61225
4380.0000 -115.55012 -111.72810 3.82202 2.22674 -112.18983 693.56314
4385.0000 -115.59474 -110.87366 4.72108 2.32023 -110.95503 729.70382
4390.0000 -114.70015 -110.60166 4.09849 2.35861 -110.44822 783.41837
4395.0000 -115.01233 -109.14012 5.87221 2.35751 -110.46263 811.19415
4400.0000 -115.51490 -110.89912 4.61578 2.36782 -110.32649 806.25811
4405.0000 -114.74388 -110.36704 4.37684 2.37786 -110.19397 785.95466
4410.0000 -113.62762 -109.52437 4.10325 2.43030 -109.50129 843.08786
4415.0000 -115.82504 -109.61543 6.20961 2.44609 -109.29272 863.84852
4420.0000 -116.20116 -110.93222 5.26894 2.37642 -110.21299 798.11466
4425.0000 -116.05070 -111.67088 4.37982 2.30588 -111.14454 762.98131
4430.0000 -116.18481 -110.93346 5.25135 2.26717 -111.65584 752.44942
4435.0000 -114.19114 -109.12506 5.06608 2.36601 -110.35041 779.88040
4440.0000 -115.04686 -109.92247 5.12440 2.40745 -109.80307 837.54801
4445.0000 -115.27921 -109.52643 5.75278 2.41397 -109.71693 838.10256
4450.0000 -115.80754 -110.90948 4.89806 2.36222 -110.40046 772.19600
4455.0000 -115.20745 -110.45655 4.75090 2.32848 -110.84616 754.51587
4460.0000 -115.09308 -110.30048 4.79261 2.36150 -110.40996 815.74441
4465.0000 -116.10029 -111.91247 4.18782 2.29163 -111.33277 729.10344
4470.0000 -114.91104 -110.62876 4.28228 2.30536 -111.15150 740.09985
4475.0000 -114.53040 -109.60402 4.92639 2.37991 -110.16684 799.25950
4480.0000 -114.07932 -108.95444 5.12488 2.42798 -109.53192 838.05467
4485.0000 -115.16332 -109.31784 5.84548 2.46437 -109.05131 877.66059
4490.0000 -115.29938 -110.93552 4.36386 2.40292 -109.86293 808.53556
4495.0000 -115.66299 -111.15233 4.51066 2.30801 -111.11647 756.90622
4500.0000 -115.55600 -110.24584 5.31016 2.35676 -110.47256 802.83241
MELTING PROCESS: loop number 19 T-loop= 791.00000000000000
main_MD> interactions number 19 at Temperature= 791.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.02220 -2.48884 0.43030
force_rgl> df(natom) -2.04119 1.11195 -0.79996
4505.0000 -115.39874 -110.06847 5.33027 2.34851 -110.58151 823.07008
4510.0000 -114.72633 -110.88575 3.84058 2.38361 -110.11791 803.39795
4515.0000 -115.81868 -110.86731 4.95137 2.33862 -110.71214 765.16575
4520.0000 -114.92299 -110.52474 4.39825 2.38312 -110.12443 777.40183
4525.0000 -115.73801 -111.16422 4.57379 2.33104 -110.81225 771.21371
4530.0000 -115.18947 -109.68695 5.50252 2.31679 -111.00047 762.40847
4535.0000 -115.38663 -110.45497 4.93167 2.41088 -109.75779 800.31605
4540.0000 -114.90404 -111.03706 3.86698 2.36359 -110.38234 802.77785
4545.0000 -115.39705 -110.67040 4.72666 2.35257 -110.52791 806.50479
4550.0000 -115.26823 -110.20050 5.06773 2.37368 -110.24914 775.06977
4555.0000 -114.27559 -109.06353 5.21206 2.40963 -109.77433 812.57971
4560.0000 -115.09021 -108.94795 6.14226 2.45896 -109.12281 871.73644
4565.0000 -115.57622 -111.22569 4.35053 2.40296 -109.86246 818.79974
4570.0000 -116.06170 -111.26372 4.79798 2.32598 -110.87914 762.26051
4575.0000 -115.72563 -111.38280 4.34283 2.29598 -111.27537 742.47134
4580.0000 -115.75645 -109.82107 5.93538 2.33678 -110.73654 771.03866
4585.0000 -114.30052 -109.20806 5.09246 2.37795 -110.19279 816.41056
4590.0000 -114.90211 -109.24040 5.66171 2.42495 -109.57201 874.45062
4595.0000 -114.82554 -110.13834 4.68720 2.36448 -110.37059 793.77748
4600.0000 -114.46263 -110.10066 4.36197 2.39401 -109.98062 811.00899
4605.0000 -115.77632 -111.20411 4.57221 2.33525 -110.75663 755.50962
4610.0000 -116.49679 -112.13117 4.36562 2.25993 -111.75157 714.50049
4615.0000 -117.17653 -112.52419 4.65234 2.20735 -112.44603 683.08464
4620.0000 -115.55676 -110.09353 5.46323 2.27753 -111.51909 720.06563
4625.0000 -114.54626 -109.44411 5.10215 2.39989 -109.90301 810.47548
4630.0000 -116.05748 -110.75732 5.30016 2.39120 -110.01768 824.53777
4635.0000 -114.77868 -110.53621 4.24247 2.32124 -110.94178 769.26396
4640.0000 -115.72244 -110.88169 4.84074 2.36182 -110.40581 817.58617
4645.0000 -115.36831 -110.49956 4.86875 2.36013 -110.42804 824.56665
4650.0000 -115.77323 -111.27065 4.50259 2.34503 -110.62749 780.74864
4655.0000 -115.97920 -110.88321 5.09599 2.30277 -111.18572 727.88825
4660.0000 -115.60069 -111.69535 3.90534 2.28216 -111.45787 745.03234
4665.0000 -115.33022 -111.17505 4.15516 2.28663 -111.39881 733.89189
4670.0000 -115.70085 -110.84713 4.85371 2.30967 -111.09452 743.53127
4675.0000 -115.26719 -110.27506 4.99213 2.32389 -110.90671 776.04474
4680.0000 -116.07357 -111.40008 4.67349 2.36123 -110.41360 791.04170
4685.0000 -115.60643 -109.43486 6.17157 2.36130 -110.41270 803.75380
4690.0000 -115.63828 -111.39389 4.24438 2.40902 -109.78235 790.92299
4695.0000 -115.20216 -110.12017 5.08199 2.35458 -110.50142 760.21895
4700.0000 -114.71153 -110.06230 4.64923 2.34301 -110.65420 788.55596
4705.0000 -115.31456 -110.03439 5.28017 2.38200 -110.13918 799.40535
4710.0000 -116.18017 -110.76310 5.41708 2.36975 -110.30100 766.06829
4715.0000 -115.70178 -109.35188 6.34990 2.38980 -110.03618 793.51026
4720.0000 -114.94621 -110.26514 4.68107 2.39692 -109.94212 825.91801
4725.0000 -115.92227 -111.16013 4.76214 2.32933 -110.83491 774.97365
4730.0000 -115.16679 -110.16907 4.99772 2.35780 -110.45891 805.74384
4735.0000 -114.69962 -110.34465 4.35497 2.36369 -110.38112 784.00550
4740.0000 -115.05451 -110.89477 4.15974 2.33006 -110.82521 751.37213
4745.0000 -115.27080 -110.66562 4.60519 2.34838 -110.58331 778.02732
4750.0000 -114.53077 -109.27269 5.25807 2.39762 -109.93295 809.03601
MELTING PROCESS: loop number 20 T-loop= 816.00000000000000
main_MD> interactions number 20 at Temperature= 816.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.64673 0.29244 -4.79165
force_rgl> df(natom) 0.36690 1.88147 -0.78295
4755.0000 -114.72561 -109.89714 4.82847 2.37751 -110.19852 780.33251
4760.0000 -114.72621 -109.16466 5.56155 2.41138 -109.75114 799.86563
4765.0000 -115.30815 -110.46823 4.83992 2.43219 -109.47631 831.32974
4770.0000 -112.75976 -107.00823 5.75153 2.46361 -109.06132 843.54036
4775.0000 -113.36478 -108.11654 5.24824 2.57977 -107.52716 966.09004
4780.0000 -113.42066 -107.86835 5.55231 2.55287 -107.88247 954.19438
4785.0000 -114.61160 -108.55289 6.05871 2.53879 -108.06843 904.45556
4790.0000 -114.14977 -109.52175 4.62802 2.43328 -109.46191 858.23337
4795.0000 -113.49719 -107.40181 6.09538 2.52020 -108.31387 924.21068
4800.0000 -113.30826 -108.29703 5.01123 2.49953 -108.58690 887.07489
4805.0000 -114.32231 -109.53743 4.78488 2.50611 -108.50008 924.37773
4810.0000 -114.66231 -109.15241 5.50990 2.46883 -108.99242 877.62253
4815.0000 -114.30876 -108.82224 5.48653 2.47865 -108.86271 884.89107
4820.0000 -115.76532 -110.21769 5.54762 2.45866 -109.12674 859.77806
4825.0000 -115.66389 -110.67951 4.98438 2.34247 -110.66140 767.71467
4830.0000 -115.96504 -111.61838 4.34666 2.33172 -110.80334 773.56584
4835.0000 -114.38596 -109.47605 4.90992 2.34116 -110.67861 783.98760
4840.0000 -115.64520 -110.72409 4.92111 2.39623 -109.95126 810.60320
4845.0000 -115.50348 -110.22678 5.27670 2.33818 -110.71798 789.04331
4850.0000 -115.25868 -109.10367 6.15502 2.40453 -109.84169 791.91595
4855.0000 -115.46670 -110.13847 5.32822 2.43772 -109.40326 872.06103
4860.0000 -116.53525 -112.36225 4.17300 2.32997 -110.82648 765.67204
4865.0000 -113.53784 -108.94800 4.58984 2.35623 -110.47964 795.53226
4870.0000 -113.24491 -107.65008 5.59483 2.46413 -109.05451 845.62272
4875.0000 -113.38441 -108.05949 5.32492 2.54050 -108.04584 896.99770
4880.0000 -114.23656 -108.61829 5.61826 2.49997 -108.58114 893.67709
4885.0000 -115.62041 -110.67157 4.94883 2.45197 -109.21515 835.20621
4890.0000 -115.37241 -110.48616 4.88625 2.35817 -110.45396 752.94483
4895.0000 -115.61371 -110.61596 4.99775 2.36739 -110.33222 783.29634
4900.0000 -114.57305 -109.81430 4.75875 2.38332 -110.12175 815.57648
4905.0000 -113.71339 -108.51440 5.19899 2.49883 -108.59616 858.56555
4910.0000 -115.64766 -110.88549 4.76217 2.40284 -109.86395 806.72065
4915.0000 -113.96390 -108.20339 5.76051 2.43455 -109.44523 847.44926
4920.0000 -114.42876 -108.19611 6.23265 2.49997 -108.58108 909.80882
4925.0000 -114.94216 -110.22449 4.71767 2.39939 -109.90958 846.79401
4930.0000 -115.51897 -110.41089 5.10808 2.39024 -110.03037 804.92828
4935.0000 -115.23372 -110.33284 4.90088 2.36288 -110.39177 845.40856
4940.0000 -114.98977 -109.20491 5.78486 2.45013 -109.23938 903.66274
4945.0000 -114.40650 -108.91502 5.49148 2.41119 -109.75370 857.09391
4950.0000 -116.04548 -111.99648 4.04900 2.32282 -110.92086 762.51440
4955.0000 -116.34336 -111.52936 4.81400 2.26474 -111.68792 722.94178
4960.0000 -115.19386 -110.35996 4.83390 2.36660 -110.34266 788.57790
4965.0000 -113.75114 -108.74815 5.00300 2.46921 -108.98743 863.38028
4970.0000 -114.64093 -109.18513 5.45579 2.49163 -108.69132 877.93068
4975.0000 -115.45387 -110.07853 5.37534 2.42929 -109.51467 875.48781
4980.0000 -114.09223 -108.47175 5.62048 2.43930 -109.38247 844.76791
4985.0000 -113.40144 -108.27519 5.12625 2.51258 -108.41459 882.91948
4990.0000 -115.42395 -110.41755 5.00640 2.44336 -109.32884 834.86981
4995.0000 -116.08977 -109.78031 6.30946 2.44539 -109.30203 839.94428
5000.0000 -114.16130 -109.96677 4.19452 2.41217 -109.74071 834.38070
MELTING PROCESS: loop number 21 T-loop= 841.00000000000000
main_MD> interactions number 21 at Temperature= 841.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -7.02073 1.24096 -2.13901
force_rgl> df(natom) -0.95656 -2.04546 -2.70873
5005.0000 -115.40272 -111.00915 4.39356 2.33419 -110.77072 761.71573
5010.0000 -114.94766 -109.48990 5.45776 2.37229 -110.26753 778.18714
5015.0000 -113.41208 -107.86708 5.54500 2.45987 -109.11074 877.16686
5020.0000 -115.24833 -109.46786 5.78047 2.50083 -108.56981 944.07412
5025.0000 -113.86807 -108.45972 5.40836 2.46487 -109.04476 857.07148
5030.0000 -114.28142 -109.23052 5.05090 2.47053 -108.97001 874.22476
5035.0000 -114.68151 -109.96605 4.71546 2.36729 -110.33353 795.24963
5040.0000 -114.89037 -109.59803 5.29234 2.39146 -110.01425 784.21582
5045.0000 -113.77647 -108.18047 5.59600 2.44951 -109.24758 853.98149
5050.0000 -113.46518 -106.74666 6.71852 2.57102 -107.64267 974.30670
5055.0000 -113.69995 -107.57177 6.12818 2.66747 -106.36884 998.81097
5060.0000 -115.24244 -108.84278 6.39966 2.51687 -108.35792 905.27404
5065.0000 -114.09281 -109.06839 5.02442 2.45611 -109.16045 862.21169
5070.0000 -114.97931 -110.00859 4.97072 2.48654 -108.75854 889.32104
5075.0000 -115.73111 -111.18981 4.54130 2.30857 -111.10913 746.87512
5080.0000 -113.20411 -107.67424 5.52986 2.45301 -109.20140 865.39785
5085.0000 -114.93497 -108.58194 6.35304 2.54295 -108.01341 939.13949
5090.0000 -114.05633 -108.80948 5.24686 2.45862 -109.12722 884.95555
5095.0000 -113.97745 -109.11427 4.86317 2.47117 -108.96154 894.25574
5100.0000 -115.35289 -109.46211 5.89077 2.46608 -109.02871 892.40194
5105.0000 -115.37569 -109.65063 5.72506 2.44567 -109.29835 861.81857
5110.0000 -114.24907 -110.19487 4.05420 2.39962 -109.90654 857.04850
5115.0000 -114.54176 -109.09301 5.44875 2.37993 -110.16658 815.51347
5120.0000 -114.93980 -109.98330 4.95649 2.43735 -109.40822 862.66195
5125.0000 -114.45504 -110.38979 4.06524 2.41754 -109.66983 854.61178
5130.0000 -115.98496 -110.77662 5.20835 2.32758 -110.85795 739.79710
5135.0000 -114.88637 -110.24141 4.64496 2.36248 -110.39707 805.90095
5140.0000 -115.08763 -110.70777 4.37986 2.41088 -109.75778 811.54415
5145.0000 -115.93325 -111.24923 4.68403 2.32878 -110.84217 770.73610
5150.0000 -115.24025 -110.23578 5.00447 2.37589 -110.21995 793.44315
5155.0000 -115.19449 -110.68611 4.50838 2.42053 -109.63033 851.00855
5160.0000 -115.89318 -111.27919 4.61399 2.32168 -110.93598 772.72655
5165.0000 -114.68636 -110.10922 4.57714 2.34745 -110.59562 783.59145
5170.0000 -115.38644 -110.88579 4.50064 2.34863 -110.57993 795.09491
5175.0000 -113.37463 -108.18453 5.19009 2.41785 -109.66573 859.21413
5180.0000 -115.55010 -109.40793 6.14216 2.40298 -109.86217 840.69044
5185.0000 -114.86872 -108.82410 6.04462 2.45265 -109.20606 868.22947
5190.0000 -115.46543 -110.95101 4.51443 2.41217 -109.74075 856.66856
5195.0000 -115.42173 -110.09678 5.32495 2.38251 -110.13256 826.97619
5200.0000 -115.15397 -108.95182 6.20215 2.43435 -109.44784 842.31709
5205.0000 -112.55602 -107.03290 5.52312 2.56579 -107.71173 948.82077
5210.0000 -115.30050 -110.32723 4.97327 2.46242 -109.07704 851.59426
5215.0000 -113.88312 -108.94436 4.93876 2.46980 -108.97958 903.51246
5220.0000 -114.74894 -109.38477 5.36417 2.45060 -109.23312 819.32894
5225.0000 -113.99169 -108.77323 5.21846 2.48448 -108.78573 893.13891
5230.0000 -115.37079 -110.34896 5.02183 2.39225 -110.00381 835.08408
5235.0000 -114.66360 -109.57537 5.08823 2.39804 -109.92745 828.56716
5240.0000 -114.44242 -109.01127 5.43115 2.44233 -109.34235 873.02925
5245.0000 -115.49281 -111.29101 4.20180 2.42766 -109.53623 829.18258
5250.0000 -116.02748 -111.40672 4.62076 2.27670 -111.53003 708.46402
MELTING PROCESS: loop number 22 T-loop= 866.00000000000000
main_MD> interactions number 22 at Temperature= 866.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.46838 -0.70939 0.48398
force_rgl> df(natom) 2.22556 1.93678 -1.38595
5255.0000 -114.09129 -109.31357 4.77772 2.33530 -110.75604 769.80328
5260.0000 -113.98705 -108.72251 5.26455 2.47251 -108.94378 897.59747
5265.0000 -115.13885 -109.13891 5.99994 2.50347 -108.53495 882.17747
5270.0000 -114.39148 -108.87792 5.51356 2.42940 -109.51318 851.68887
5275.0000 -114.57703 -109.75468 4.82236 2.40452 -109.84176 828.03096
5280.0000 -114.37876 -110.67242 3.70634 2.40540 -109.83017 768.94478
5285.0000 -116.44889 -111.59240 4.85649 2.30418 -111.16709 750.45082
5290.0000 -115.19500 -110.83156 4.36344 2.32041 -110.95266 747.38964
5295.0000 -115.07980 -110.03755 5.04225 2.40459 -109.84088 827.86681
5300.0000 -115.13158 -110.17490 4.95669 2.41065 -109.76087 834.35017
5305.0000 -115.44023 -110.21673 5.22350 2.35901 -110.44294 804.78151
5310.0000 -114.29549 -109.00106 5.29442 2.41181 -109.74555 843.62237
5315.0000 -114.13350 -108.50974 5.62376 2.51922 -108.32687 895.94619
5320.0000 -113.22582 -107.88200 5.34381 2.57851 -107.54373 910.87596
5325.0000 -115.24329 -108.91926 6.32403 2.52242 -108.28457 923.61371
5330.0000 -115.03576 -109.81620 5.21956 2.46085 -109.09779 848.55872
5335.0000 -114.56604 -109.61414 4.95190 2.40369 -109.85277 809.72803
5340.0000 -115.04323 -109.81509 5.22814 2.35941 -110.43762 825.77988
5345.0000 -117.04490 -111.18259 5.86230 2.39024 -110.03044 811.46736
5350.0000 -113.95633 -109.08862 4.86770 2.36816 -110.32210 817.76581
5355.0000 -115.51803 -109.47201 6.04602 2.45655 -109.15457 866.84401
5360.0000 -115.41213 -109.04974 6.36240 2.48522 -108.77594 907.86648
5365.0000 -114.57847 -109.07080 5.50767 2.41845 -109.65784 844.64246
5370.0000 -113.75829 -108.57714 5.18114 2.45420 -109.18562 857.49646
5375.0000 -114.46242 -108.83487 5.62754 2.47721 -108.88172 891.80806
5380.0000 -114.61064 -108.63334 5.97730 2.45797 -109.13587 868.24597
5385.0000 -113.55105 -107.85038 5.70067 2.53947 -108.05939 905.66105
5390.0000 -116.40964 -111.32553 5.08410 2.49655 -108.62636 888.55037
5395.0000 -114.45421 -110.42098 4.03322 2.33414 -110.77139 798.17257
5400.0000 -114.08582 -109.09697 4.98885 2.39597 -109.95467 792.04593
5405.0000 -114.04091 -107.99399 6.04692 2.49621 -108.63078 888.75359
5410.0000 -114.83561 -109.66414 5.17147 2.48189 -108.81986 885.58327
5415.0000 -114.33359 -109.43155 4.90203 2.39452 -109.97391 822.26287
5420.0000 -114.24270 -109.46629 4.77641 2.45432 -109.18407 866.54510
5425.0000 -115.15167 -108.87040 6.28127 2.47918 -108.85573 901.31748
5430.0000 -113.40794 -108.34346 5.06449 2.48318 -108.80287 895.03968
5435.0000 -114.42149 -108.30705 6.11444 2.50982 -108.45107 907.63976
5440.0000 -114.61888 -109.02134 5.59754 2.49546 -108.64070 900.12341
5445.0000 -113.75130 -108.58801 5.16329 2.49643 -108.62784 900.66040
5450.0000 -115.58009 -109.75321 5.82688 2.47258 -108.94291 847.65274
5455.0000 -114.79359 -110.36229 4.43129 2.39150 -110.01377 811.38273
5460.0000 -116.39185 -111.24805 5.14380 2.32891 -110.84041 755.46936
5465.0000 -114.89466 -110.11424 4.78042 2.37272 -110.26182 811.14889
5470.0000 -114.88429 -110.40886 4.47543 2.37119 -110.28205 773.03535
5475.0000 -114.40999 -109.92859 4.48140 2.40676 -109.81223 809.83590
5480.0000 -114.99004 -110.04473 4.94531 2.42712 -109.54325 825.54927
5485.0000 -115.94466 -109.80573 6.13893 2.38349 -110.11957 779.86674
5490.0000 -114.48007 -109.34910 5.13096 2.42304 -109.59722 844.47201
5495.0000 -114.53333 -109.20404 5.32929 2.43153 -109.48508 842.19748
5500.0000 -113.99080 -109.26575 4.72506 2.45650 -109.15529 836.30546
MELTING PROCESS: loop number 23 T-loop= 891.00000000000000
main_MD> interactions number 23 at Temperature= 891.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.37572 1.10569 1.29035
force_rgl> df(natom) -2.87106 2.05876 -0.26425
5505.0000 -112.82937 -107.62224 5.20713 2.56039 -107.78305 964.68552
5510.0000 -113.86259 -108.16607 5.69651 2.54745 -107.95406 953.41453
5515.0000 -115.54978 -108.64355 6.90623 2.51106 -108.43462 911.63990
5520.0000 -113.64521 -107.75470 5.89051 2.50365 -108.53255 875.71006
5525.0000 -113.83737 -109.08890 4.74847 2.49072 -108.70327 872.87908
5530.0000 -114.83423 -109.59948 5.23475 2.39068 -110.02462 790.02554
5535.0000 -115.58361 -110.61723 4.96638 2.41747 -109.67079 841.02751
5540.0000 -114.15909 -108.52655 5.63253 2.45635 -109.15729 849.19630
5545.0000 -114.50373 -109.91820 4.58554 2.47377 -108.92710 909.62178
5550.0000 -112.90657 -107.98795 4.91862 2.45738 -109.14366 862.92227
5555.0000 -113.72705 -107.65973 6.06733 2.53020 -108.18179 926.72297
5560.0000 -113.86583 -110.03471 3.83112 2.50236 -108.54962 905.94695
5565.0000 -115.05502 -109.78611 5.26891 2.38818 -110.05767 814.62311
5570.0000 -113.71458 -108.06294 5.65164 2.43935 -109.38183 851.26493
5575.0000 -112.82661 -107.31877 5.50785 2.54363 -108.00444 950.76920
5580.0000 -112.69297 -107.28313 5.40984 2.62340 -106.95091 954.18720
5585.0000 -114.69880 -108.78176 5.91703 2.54883 -107.93586 986.12031
5590.0000 -113.69939 -108.93731 4.76208 2.45411 -109.18685 853.77785
5595.0000 -115.01173 -109.11225 5.89948 2.47466 -108.91543 844.80965
5600.0000 -115.48537 -110.96145 4.52392 2.38709 -110.07197 799.81658
5605.0000 -113.46621 -108.37771 5.08850 2.41696 -109.67750 813.81752
5610.0000 -115.43366 -108.69014 6.74351 2.52627 -108.23380 888.97058
5615.0000 -112.39330 -106.94562 5.44768 2.55642 -107.83560 973.78265
5620.0000 -113.82154 -107.26245 6.55909 2.56701 -107.69564 945.67262
5625.0000 -112.89591 -107.18736 5.70855 2.56893 -107.67031 955.53718
5630.0000 -114.57875 -109.23221 5.34654 2.49376 -108.66314 881.67894
5635.0000 -114.23668 -107.99127 6.24541 2.48687 -108.75410 862.64483
5640.0000 -113.58482 -108.67910 4.90572 2.53662 -108.09702 945.87913
5645.0000 -113.97929 -108.34389 5.63540 2.55501 -107.85419 898.82263
5650.0000 -114.23238 -108.27389 5.95849 2.51959 -108.32202 925.50709
5655.0000 -113.73305 -107.70001 6.03305 2.52170 -108.29407 903.30534
5660.0000 -113.43284 -108.32439 5.10845 2.55024 -107.91711 924.83471
5665.0000 -112.84529 -106.36412 6.48116 2.61565 -107.05322 970.67515
5670.0000 -112.45277 -106.35586 6.09691 2.67170 -106.31290 1037.55044
5675.0000 -112.96760 -106.56221 6.40539 2.67204 -106.30841 1044.74177
5680.0000 -114.11619 -109.10531 5.01088 2.54733 -107.95556 913.10511
5685.0000 -113.86996 -108.62147 5.24849 2.50226 -108.55092 883.52369
5690.0000 -114.27302 -107.96488 6.30814 2.51128 -108.43172 894.98867
5695.0000 -113.70842 -108.04562 5.66280 2.53182 -108.16051 936.29195
5700.0000 -114.89644 -108.49799 6.39845 2.59866 -107.27767 997.45175
5705.0000 -114.16415 -108.87566 5.28849 2.48080 -108.83425 932.75360
5710.0000 -112.86014 -106.66380 6.19633 2.50125 -108.56415 889.54787
5715.0000 -113.18681 -107.74083 5.44598 2.65190 -106.57451 1000.04890
5720.0000 -113.85450 -109.41855 4.43595 2.49935 -108.58933 828.24883
5725.0000 -114.59530 -109.86599 4.72931 2.42302 -109.59751 836.36805
5730.0000 -115.90387 -110.78394 5.11992 2.38895 -110.04739 825.69850
5735.0000 -115.21876 -110.03648 5.18228 2.34550 -110.62132 766.27018
5740.0000 -115.73044 -109.99014 5.74031 2.39217 -110.00497 831.76275
5745.0000 -115.96765 -111.10557 4.86208 2.34121 -110.67795 791.01657
5750.0000 -115.73902 -109.85620 5.88282 2.36872 -110.31468 794.82202
MELTING PROCESS: loop number 24 T-loop= 916.00000000000000
main_MD> interactions number 24 at Temperature= 916.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.10028 -0.79592 1.04308
force_rgl> df(natom) -1.37290 -1.38073 -1.82928
5755.0000 -115.09032 -110.28119 4.80912 2.44622 -109.29105 842.26399
5760.0000 -115.39126 -109.58638 5.80488 2.40924 -109.77947 827.10492
5765.0000 -113.79254 -108.57315 5.21939 2.49124 -108.69642 884.05589
5770.0000 -113.80950 -108.15005 5.65945 2.53518 -108.11609 918.91265
5775.0000 -113.70327 -107.69149 6.01178 2.55504 -107.85381 933.59504
5780.0000 -114.07290 -108.39072 5.68218 2.55041 -107.91497 939.39204
5785.0000 -114.42096 -108.96565 5.45531 2.55196 -107.89448 909.83655
5790.0000 -114.20803 -109.21076 4.99726 2.42605 -109.55741 798.75258
5795.0000 -114.31308 -109.80309 4.50998 2.47092 -108.96476 880.67324
5800.0000 -113.46705 -108.28038 5.18667 2.47902 -108.85779 870.80585
5805.0000 -114.21760 -107.17873 7.03888 2.58954 -107.39807 934.18075
5810.0000 -112.16446 -106.42554 5.73892 2.59090 -107.38020 985.11403
5815.0000 -114.47750 -107.58927 6.88823 2.54282 -108.01521 938.60078
5820.0000 -112.65634 -107.79788 4.85847 2.54673 -107.96347 949.41430
5825.0000 -114.02460 -108.25582 5.76878 2.51499 -108.38277 867.64714
5830.0000 -115.31174 -110.36024 4.95151 2.41904 -109.65003 824.97912
5835.0000 -114.22552 -108.13626 6.08926 2.49037 -108.70790 891.57477
5840.0000 -114.66062 -108.98911 5.67151 2.45347 -109.19525 841.07293
5845.0000 -115.32902 -109.54224 5.78679 2.43166 -109.48340 842.36948
5850.0000 -115.73158 -109.15568 6.57590 2.41026 -109.76603 852.24899
5855.0000 -116.52305 -111.02513 5.49792 2.41898 -109.65081 838.69979
5860.0000 -114.55843 -108.97338 5.58505 2.33841 -110.71500 785.01672
5865.0000 -114.31109 -109.05350 5.25759 2.44333 -109.32926 844.62782
5870.0000 -113.51780 -108.47690 5.04090 2.52848 -108.20463 890.45975
5875.0000 -114.34392 -109.24245 5.10147 2.47983 -108.84711 895.19020
5880.0000 -113.27565 -108.01413 5.26152 2.56363 -107.74026 920.36407
5885.0000 -113.45459 -108.19149 5.26310 2.62016 -106.99369 952.09811
5890.0000 -113.31870 -106.24287 7.07583 2.64887 -106.61452 979.13469
5895.0000 -113.04492 -107.06875 5.97617 2.58531 -107.45397 943.44247
5900.0000 -112.99665 -107.16750 5.82915 2.62068 -106.98689 1011.39552
5905.0000 -115.19841 -109.50597 5.69245 2.51449 -108.38929 908.73057
5910.0000 -114.90609 -108.91326 5.99283 2.48909 -108.72482 897.72694
5915.0000 -115.24141 -109.43658 5.80483 2.50842 -108.46955 885.47831
5920.0000 -111.26347 -106.69541 4.56807 2.52429 -108.25988 907.13637
5925.0000 -113.65035 -107.96575 5.68460 2.55595 -107.84173 926.89973
5930.0000 -114.27212 -108.98477 5.28735 2.51147 -108.42922 899.51527
5935.0000 -112.63741 -106.24134 6.39607 2.54549 -107.97991 932.67836
5940.0000 -113.76767 -108.07359 5.69408 2.56169 -107.76590 919.91862
5945.0000 -114.38614 -109.17356 5.21258 2.45981 -109.11158 858.76010
5950.0000 -115.50327 -108.74807 6.75520 2.46808 -109.00229 901.80723
5955.0000 -113.92501 -107.25615 6.66886 2.54471 -107.99020 969.18913
5960.0000 -114.58021 -108.49278 6.08743 2.47547 -108.90475 901.32374
5965.0000 -114.50787 -107.99109 6.51678 2.53683 -108.09432 933.58378
5970.0000 -114.77221 -108.38336 6.38885 2.54240 -108.02068 952.44112
5975.0000 -113.34436 -108.01457 5.32978 2.54937 -107.92860 935.23217
5980.0000 -114.33417 -108.70573 5.62844 2.50242 -108.54875 872.95930
5985.0000 -115.68218 -109.71876 5.96342 2.50623 -108.49849 921.58392
5990.0000 -114.58071 -110.29789 4.28282 2.40062 -109.89329 852.02155
5995.0000 -114.60449 -109.97820 4.62629 2.41820 -109.66112 815.69178
6000.0000 -115.18233 -109.48491 5.69742 2.44357 -109.32603 843.12928
MELTING PROCESS: loop number 25 T-loop= 941.00000000000000
main_MD> interactions number 25 at Temperature= 941.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.90756 -0.00067 -4.17860
force_rgl> df(natom) -0.77895 4.31899 1.63091
6005.0000 -113.34524 -108.31878 5.02646 2.52477 -108.25362 900.63993
6010.0000 -114.83035 -108.58587 6.24448 2.49034 -108.70827 932.37909
6015.0000 -115.71027 -110.08724 5.62303 2.49481 -108.64922 900.53427
6020.0000 -114.57606 -108.85672 5.71934 2.41840 -109.65842 818.91084
6025.0000 -113.90374 -107.62297 6.28078 2.50859 -108.46730 903.72084
6030.0000 -113.95942 -106.68509 7.27433 2.59779 -107.28908 974.00615
6035.0000 -112.30117 -105.41992 6.88125 2.67288 -106.29735 1017.49800
6040.0000 -110.83522 -104.52236 6.31287 2.74430 -105.35409 1104.21456
6045.0000 -113.98970 -108.59466 5.39503 2.64082 -106.72087 1044.63930
6050.0000 -113.62531 -108.25555 5.36976 2.49645 -108.62764 902.31604
6055.0000 -114.36409 -109.33644 5.02765 2.53003 -108.18410 935.68949
6060.0000 -113.34225 -107.92396 5.41829 2.45365 -109.19288 845.19957
6065.0000 -114.61122 -108.98851 5.62270 2.55159 -107.89934 946.41286
6070.0000 -113.64661 -108.84825 4.79835 2.51516 -108.38048 877.63358
6075.0000 -112.98284 -107.39993 5.58291 2.53895 -108.06627 917.28869
6080.0000 -112.79400 -106.11830 6.67569 2.62086 -106.98446 951.30582
6085.0000 -112.96139 -107.40751 5.55388 2.65611 -106.51891 1017.85755
6090.0000 -113.42158 -107.81287 5.60871 2.54881 -107.93603 928.26188
6095.0000 -113.65942 -107.50035 6.15907 2.50120 -108.56489 923.14411
6100.0000 -113.21773 -107.34811 5.86962 2.56939 -107.66427 1000.73731
6105.0000 -114.66945 -107.91288 6.75657 2.53130 -108.16732 941.56597
6110.0000 -112.14460 -106.40899 5.73561 2.64658 -106.64475 1035.72290
6115.0000 -111.98322 -104.90684 7.07638 2.63603 -106.78412 985.23021
6120.0000 -113.29492 -107.09220 6.20271 2.72968 -105.54721 1060.14010
6125.0000 -113.23690 -107.37072 5.86619 2.59016 -107.38998 1011.26973
6130.0000 -113.43382 -108.11151 5.32231 2.52817 -108.20865 953.56584
6135.0000 -112.58808 -106.25496 6.33313 2.59384 -107.34138 956.61645
6140.0000 -112.58144 -105.55307 7.02836 2.71155 -105.78669 1017.94949
6145.0000 -112.99359 -107.98106 5.01253 2.61420 -107.07241 974.43082
6150.0000 -114.60813 -108.08007 6.52806 2.56591 -107.71018 935.03517
6155.0000 -113.18848 -106.67590 6.51258 2.58978 -107.39495 961.93795
6160.0000 -111.02887 -105.19160 5.83727 2.66291 -106.42903 1037.94990
6165.0000 -112.39109 -105.57994 6.81115 2.71353 -105.76048 1057.33621
6170.0000 -113.05549 -107.56335 5.49214 2.58474 -107.46147 940.65903
6175.0000 -114.28146 -107.98706 6.29440 2.49307 -108.67228 861.86739
6180.0000 -113.66398 -107.98231 5.68167 2.49787 -108.60888 868.88075
6185.0000 -113.32547 -106.96503 6.36044 2.59865 -107.27784 979.17332
6190.0000 -113.25224 -107.54929 5.70295 2.58504 -107.45754 959.68131
6195.0000 -113.91756 -108.11153 5.80603 2.60125 -107.24345 940.81204
6200.0000 -115.00793 -109.80791 5.20003 2.45734 -109.14410 857.83764
6205.0000 -113.28843 -107.31290 5.97553 2.54238 -108.02101 927.77574
6210.0000 -113.33406 -107.33206 6.00201 2.58782 -107.42086 980.12938
6215.0000 -113.13434 -107.92000 5.21434 2.56750 -107.68926 931.57122
6220.0000 -113.82556 -107.03753 6.78803 2.56148 -107.76869 925.33171
6225.0000 -112.83870 -106.07539 6.76331 2.58674 -107.43512 927.32941
6230.0000 -113.16397 -105.66157 7.50241 2.66934 -106.34410 1026.16946
6235.0000 -112.60240 -106.62256 5.97984 2.64692 -106.64019 989.76982
6240.0000 -112.89729 -106.48076 6.41653 2.60279 -107.22309 999.81491
6245.0000 -112.99492 -107.13587 5.85905 2.61086 -107.11649 985.91025
6250.0000 -113.51980 -107.40471 6.11509 2.59995 -107.26068 947.50932
MELTING PROCESS: loop number 26 T-loop= 966.00000000000000
main_MD> interactions number 26 at Temperature= 966.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -3.83366 -5.86852 -2.43231
force_rgl> df(natom) 2.70479 -0.93011 1.29639
6255.0000 -113.41341 -107.96232 5.45109 2.52565 -108.24188 896.97461
6260.0000 -113.19377 -106.97779 6.21597 2.59123 -107.37579 958.75731
6265.0000 -113.48515 -108.11737 5.36778 2.52817 -108.20869 900.14902
6270.0000 -113.15222 -107.48681 5.66541 2.54355 -108.00558 902.07450
6275.0000 -113.82282 -108.35860 5.46422 2.53153 -108.16429 886.28514
6280.0000 -113.74928 -108.13574 5.61354 2.54811 -107.94535 939.77431
6285.0000 -114.15746 -108.64441 5.51305 2.50530 -108.51074 921.67857
6290.0000 -113.59608 -107.75887 5.83720 2.49128 -108.69587 895.25060
6295.0000 -113.92548 -107.43520 6.49029 2.57456 -107.59591 974.63381
6300.0000 -112.43100 -107.01583 5.41516 2.61964 -107.00060 991.60835
6305.0000 -113.60000 -108.34458 5.25541 2.65359 -106.55220 1009.22912
6310.0000 -113.47297 -107.13718 6.33579 2.61178 -107.10439 967.29744
6315.0000 -114.02925 -106.47719 7.55206 2.62667 -106.90770 1009.78298
6320.0000 -113.56685 -107.71497 5.85188 2.56392 -107.73651 946.94662
6325.0000 -112.90923 -106.55745 6.35178 2.66646 -106.38217 1031.43653
6330.0000 -112.73580 -107.28734 5.44846 2.57207 -107.62879 917.90277
6335.0000 -112.10155 -106.25748 5.84407 2.63677 -106.77434 1007.23386
6340.0000 -112.26659 -105.25361 7.01298 2.69425 -106.01514 1064.12487
6345.0000 -113.05805 -105.57121 7.48684 2.69351 -106.02487 1056.54242
6350.0000 -112.58118 -106.32955 6.25162 2.68410 -106.14919 1001.73087
6355.0000 -112.37341 -106.37607 5.99734 2.69631 -105.98789 1060.37017
6360.0000 -111.89678 -104.87896 7.01782 2.76608 -105.06644 1089.05785
6365.0000 -114.26350 -108.19264 6.07085 2.71128 -105.79025 1096.24775
6370.0000 -113.62197 -108.38111 5.24085 2.51745 -108.35027 934.98206
6375.0000 -113.96549 -107.36662 6.59887 2.56964 -107.66098 953.74337
6380.0000 -112.45962 -105.64840 6.81122 2.62855 -106.88282 1017.96341
6385.0000 -113.44944 -106.60926 6.84018 2.68738 -106.10582 1042.19296
6390.0000 -113.04858 -107.77546 5.27312 2.60589 -107.18215 995.54868
6395.0000 -113.92202 -107.20826 6.71376 2.56161 -107.76702 986.05517
6400.0000 -111.56176 -105.43938 6.12238 2.62174 -106.97276 962.55467
6405.0000 -112.84777 -106.67345 6.17433 2.69242 -106.03926 1030.46959
6410.0000 -113.23100 -106.66219 6.56881 2.58446 -107.46526 974.82962
6415.0000 -112.15598 -105.42106 6.73492 2.67159 -106.31443 1024.15882
6420.0000 -114.18043 -107.79234 6.38809 2.65066 -106.59085 999.76860
6425.0000 -112.95136 -107.54264 5.40872 2.54486 -107.98817 937.80799
6430.0000 -113.57045 -107.65168 5.91877 2.61634 -107.04411 978.16677
6435.0000 -114.38237 -108.54768 5.83468 2.51930 -108.32578 920.35430
6440.0000 -113.63043 -107.34654 6.28389 2.57896 -107.53787 1001.28406
6445.0000 -112.75887 -106.23219 6.52669 2.65440 -106.54149 1042.49347
6450.0000 -113.06061 -107.35810 5.70251 2.65474 -106.53699 983.50581
6455.0000 -113.96455 -107.70818 6.25638 2.62536 -106.92497 987.93632
6460.0000 -114.37513 -108.87540 5.49973 2.48293 -108.80619 885.37156
6465.0000 -110.72542 -104.76111 5.96431 2.58288 -107.48610 903.85164
6470.0000 -112.36764 -106.49387 5.87377 2.68781 -106.10018 1009.74358
6475.0000 -113.98214 -108.49627 5.48587 2.62189 -106.97084 1017.29796
6480.0000 -115.56206 -110.40097 5.16109 2.45793 -109.13638 892.94002
6485.0000 -115.09780 -110.03275 5.06505 2.44178 -109.34969 831.92164
6490.0000 -113.37915 -107.85578 5.52336 2.48791 -108.74046 868.55860
6495.0000 -114.53963 -108.47792 6.06171 2.51354 -108.40195 918.26062
6500.0000 -113.72220 -108.29517 5.42704 2.61109 -107.11355 981.15869
MELTING PROCESS: loop number 27 T-loop= 991.00000000000000
main_MD> interactions number 27 at Temperature= 991.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.38991 -1.76304 -0.85386
force_rgl> df(natom) -1.90811 -1.26310 1.34694
6505.0000 -113.12805 -107.38586 5.74219 2.54292 -108.01383 928.32099
6510.0000 -113.19708 -106.98004 6.21704 2.58808 -107.41742 990.13591
6515.0000 -113.95791 -107.87727 6.08064 2.58139 -107.50574 995.92614
6520.0000 -112.59661 -107.14378 5.45283 2.62477 -106.93277 992.82028
6525.0000 -112.70918 -106.46910 6.24008 2.68311 -106.16228 1024.02790
6530.0000 -113.81250 -107.19747 6.61503 2.66053 -106.46050 1020.87290
6535.0000 -112.16682 -106.79904 5.36778 2.56478 -107.72508 938.63913
6540.0000 -111.83362 -105.75146 6.08216 2.70744 -105.84092 1082.96366
6545.0000 -113.89482 -108.18005 5.71477 2.64717 -106.63701 1030.24802
6550.0000 -113.12189 -107.79787 5.32402 2.52088 -108.30499 921.85579
6555.0000 -113.83943 -107.57862 6.26081 2.60379 -107.20994 921.54188
6560.0000 -113.72763 -107.00377 6.72386 2.60973 -107.13140 989.77357
6565.0000 -112.79574 -107.12181 5.67393 2.61561 -107.05372 997.23683
6570.0000 -113.31529 -108.54522 4.77007 2.56502 -107.72198 914.23750
6575.0000 -113.38555 -108.40935 4.97620 2.49909 -108.59276 884.38347
6580.0000 -113.38181 -108.62392 4.75789 2.51195 -108.42285 943.03880
6585.0000 -111.93814 -106.89524 5.04290 2.57475 -107.59349 956.82748
6590.0000 -114.96794 -109.08074 5.88720 2.60597 -107.18111 944.70483
6595.0000 -113.87863 -107.93950 5.93913 2.44225 -109.34343 871.54876
6600.0000 -113.33434 -107.35889 5.97545 2.54837 -107.94194 923.96416
6605.0000 -113.50986 -108.15803 5.35184 2.53546 -108.11243 939.43884
6610.0000 -113.75181 -107.43985 6.31197 2.60134 -107.24224 1001.05538
6615.0000 -112.88232 -106.65257 6.22975 2.63033 -106.85941 1012.00680
6620.0000 -113.59699 -106.92990 6.66710 2.61856 -107.01486 1025.84371
6625.0000 -113.06617 -106.49411 6.57206 2.64571 -106.65624 993.10956
6630.0000 -114.28264 -107.59930 6.68334 2.62636 -106.91175 1010.01550
6635.0000 -112.71881 -105.68884 7.02997 2.69318 -106.02927 1075.46346
6640.0000 -111.83395 -104.85761 6.97634 2.75482 -105.21512 1113.89293
6645.0000 -111.47664 -105.26514 6.21149 2.80221 -104.58929 1122.87654
6650.0000 -112.52199 -107.24710 5.27488 2.66915 -106.34659 1013.71115
6655.0000 -112.49529 -107.04064 5.45465 2.55165 -107.89851 938.33839
6660.0000 -112.14322 -107.23125 4.91197 2.60821 -107.15157 942.65508
6665.0000 -112.00530 -105.72801 6.27729 2.60997 -107.12828 986.22406
6670.0000 -112.05007 -105.71803 6.33204 2.78850 -104.77034 1121.71277
6675.0000 -111.70735 -105.12783 6.57952 2.68746 -106.10483 1033.47278
6680.0000 -112.11914 -105.63897 6.48017 2.70959 -105.81253 1072.19005
6685.0000 -111.64394 -104.75742 6.88652 2.76830 -105.03711 1080.40851
6690.0000 -111.96891 -106.24428 5.72463 2.71264 -105.77218 1044.13682
6695.0000 -114.07403 -106.69908 7.37495 2.66298 -106.42814 1033.80917
6700.0000 -110.87360 -104.72838 6.14522 2.73716 -105.44837 1078.52048
6705.0000 -111.54518 -104.82096 6.72421 2.78742 -104.78452 1104.30080
6710.0000 -112.75493 -105.74663 7.00829 2.70731 -105.84262 1077.83502
6715.0000 -113.99418 -106.91838 7.07580 2.70490 -105.87448 1032.29317
6720.0000 -112.35055 -105.75812 6.59243 2.68587 -106.12576 1035.99885
6725.0000 -113.33556 -107.56547 5.77009 2.65315 -106.55801 1007.28418
6730.0000 -112.74868 -107.07447 5.67421 2.59747 -107.29339 991.92123
6735.0000 -113.42326 -107.78577 5.63749 2.59588 -107.31437 918.59645
6740.0000 -111.82559 -106.25989 5.56570 2.58543 -107.45243 946.24859
6745.0000 -112.36902 -106.02130 6.34772 2.67485 -106.27134 1016.45468
6750.0000 -112.94892 -107.24465 5.70427 2.63553 -106.79070 996.85887
MELTING PROCESS: loop number 28 T-loop= 1016.0000000000000
main_MD> interactions number 28 at Temperature= 1016.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.96997 1.74439 -0.42876
force_rgl> df(natom) 1.93027 -1.35322 0.20690
6755.0000 -113.42413 -106.38701 7.03712 2.60884 -107.14317 961.34734
6760.0000 -113.61108 -107.15146 6.45961 2.62284 -106.95827 1016.23030
6765.0000 -113.66220 -108.40593 5.25626 2.55488 -107.85591 962.36594
6770.0000 -114.60085 -108.15397 6.44687 2.53218 -108.15574 951.79310
6775.0000 -112.59321 -107.00275 5.59047 2.55837 -107.80975 937.91969
6780.0000 -113.26321 -107.50410 5.75912 2.60782 -107.15669 1015.59465
6785.0000 -111.08592 -105.45311 5.63281 2.67547 -106.26322 1021.26828
6790.0000 -113.27281 -107.61799 5.65482 2.65027 -106.59598 1014.92637
6795.0000 -114.10833 -108.44485 5.66348 2.53835 -108.07421 919.57995
6800.0000 -113.52360 -106.59808 6.92552 2.61436 -107.07025 999.41717
6805.0000 -113.06979 -107.21827 5.85152 2.61079 -107.11745 989.08874
6810.0000 -112.47672 -105.93731 6.53941 2.73945 -105.41810 1073.44148
6815.0000 -112.15145 -105.33466 6.81679 2.71527 -105.73747 1057.99899
6820.0000 -110.55907 -104.43850 6.12057 2.74743 -105.31271 1076.22779
6825.0000 -112.65531 -106.70723 5.94808 2.78873 -104.76733 1098.99371
6830.0000 -112.76771 -106.88055 5.88716 2.67681 -106.24547 1059.12415
6835.0000 -114.18795 -106.16124 8.02671 2.66187 -106.44277 1002.38591
6840.0000 -114.12013 -107.42436 6.69577 2.61319 -107.08570 978.83583
6845.0000 -113.54684 -107.45237 6.09447 2.56775 -107.68595 914.97266
6850.0000 -112.56195 -106.39881 6.16314 2.63946 -106.73882 958.42434
6855.0000 -113.76919 -107.30375 6.46544 2.63072 -106.85421 1031.73455
6860.0000 -113.33221 -107.69393 5.63828 2.57239 -107.62458 947.64095
6865.0000 -112.37820 -106.70617 5.67203 2.65145 -106.58048 1024.55129
6870.0000 -111.81868 -105.33833 6.48035 2.74914 -105.29021 1067.77436
6875.0000 -111.85601 -106.00707 5.84895 2.72472 -105.61263 1047.90044
6880.0000 -113.15053 -106.97637 6.17416 2.64824 -106.62288 972.20228
6885.0000 -114.25091 -108.82527 5.42564 2.52561 -108.24253 902.13046
6890.0000 -114.41946 -108.36957 6.04988 2.55313 -107.87904 932.06766
6895.0000 -112.75856 -107.78125 4.97731 2.50123 -108.56445 900.62886
6900.0000 -112.71389 -106.65752 6.05638 2.64843 -106.62036 1025.16913
6905.0000 -112.56563 -107.43221 5.13343 2.60730 -107.16349 970.55311
6910.0000 -111.44531 -105.05811 6.38721 2.67334 -106.29135 1022.91267
6915.0000 -112.60177 -107.67204 4.92972 2.61660 -107.04065 966.00553
6920.0000 -113.84332 -108.23732 5.60601 2.57487 -107.59181 927.61352
6925.0000 -113.28170 -107.39582 5.88588 2.51430 -108.39189 855.99920
6930.0000 -113.83390 -108.08916 5.74475 2.53504 -108.11799 906.50493
6935.0000 -112.11607 -105.89252 6.22354 2.56810 -107.68129 947.94803
6940.0000 -113.35464 -106.32590 7.02875 2.71560 -105.73316 1066.75834
6945.0000 -111.58994 -106.58575 5.00418 2.70024 -105.93605 1033.43350
6950.0000 -112.95585 -105.68574 7.27011 2.67465 -106.27399 971.87520
6955.0000 -110.88268 -104.74371 6.13897 2.73485 -105.47891 1066.14627
6960.0000 -113.80887 -107.64996 6.15891 2.69302 -106.03135 1100.42158
6965.0000 -113.72195 -107.47690 6.24506 2.61365 -107.07962 1019.70365
6970.0000 -114.35636 -107.71534 6.64102 2.57193 -107.63069 967.08335
6975.0000 -113.29440 -107.05196 6.24244 2.58326 -107.48103 950.49423
6980.0000 -112.08919 -105.50699 6.58220 2.72436 -105.61741 1047.07890
6985.0000 -113.59444 -107.09994 6.49450 2.68162 -106.18192 1028.96008
6990.0000 -112.28935 -107.01155 5.27780 2.64176 -106.70835 1028.95252
6995.0000 -112.55994 -107.10759 5.45236 2.62805 -106.88951 972.76763
7000.0000 -112.53672 -106.10735 6.42937 2.62630 -106.91265 990.59916
MELTING PROCESS: loop number 29 T-loop= 1041.0000000000000
main_MD> interactions number 29 at Temperature= 1041.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.93497 -0.51148 -1.48553
force_rgl> df(natom) -1.92561 2.53536 0.18134
7005.0000 -111.17685 -104.59763 6.57922 2.73380 -105.49275 1085.93533
7010.0000 -112.71573 -105.98573 6.73000 2.76736 -105.04946 1127.37415
7015.0000 -110.89182 -104.09598 6.79584 2.80311 -104.57736 1083.34490
7020.0000 -111.24132 -105.49393 5.74739 2.79802 -104.64462 1128.02753
7025.0000 -112.40319 -106.15992 6.24327 2.71869 -105.69239 998.42903
7030.0000 -113.15168 -105.54439 7.60730 2.76415 -105.09186 1114.43698
7035.0000 -113.58206 -106.69759 6.88447 2.64515 -106.66364 1008.79465
7040.0000 -110.71466 -105.37828 5.33638 2.71125 -105.79059 1039.87855
7045.0000 -111.67270 -106.15094 5.52176 2.69537 -106.00040 1045.86905
7050.0000 -112.07528 -106.34510 5.73017 2.65913 -106.47897 1028.13660
7055.0000 -112.71039 -106.39275 6.31765 2.62122 -106.97969 970.18162
7060.0000 -113.72623 -106.55092 7.17531 2.64924 -106.60957 1019.83437
7065.0000 -112.25942 -106.72343 5.53599 2.62154 -106.97553 979.24028
7070.0000 -110.90017 -104.21468 6.68549 2.71262 -105.77250 1049.20363
7075.0000 -110.90588 -105.33815 5.56773 2.77350 -104.96841 1075.28127
7080.0000 -111.80463 -105.28062 6.52400 2.74690 -105.31981 1068.14363
7085.0000 -112.07926 -105.02396 7.05529 2.67395 -106.28329 1033.39259
7090.0000 -113.64528 -106.22223 7.42305 2.74712 -105.31688 1107.59016
7095.0000 -113.63681 -106.72226 6.91454 2.65693 -106.50806 1035.50304
7100.0000 -112.37851 -106.17062 6.20790 2.68570 -106.12809 1032.65484
7105.0000 -112.60358 -107.44018 5.16340 2.63882 -106.74728 1031.43522
7110.0000 -111.87908 -106.34090 5.53817 2.63609 -106.78331 981.60753
7115.0000 -112.22087 -105.72404 6.49683 2.72892 -105.55717 1083.10758
7120.0000 -113.14361 -105.98352 7.16009 2.72649 -105.58933 1073.88446
7125.0000 -112.28060 -105.97353 6.30707 2.69640 -105.98669 1065.70887
7130.0000 -113.38484 -106.34516 7.03969 2.69296 -106.03211 1093.83308
7135.0000 -111.60447 -105.85289 5.75158 2.67492 -106.27038 1018.08703
7140.0000 -113.66447 -107.03497 6.62950 2.61606 -107.04778 987.43104
7145.0000 -113.69255 -107.15379 6.53875 2.61989 -106.99723 1029.40765
7150.0000 -111.91462 -105.90199 6.01263 2.70546 -105.86709 1085.65248
7155.0000 -112.08635 -104.19454 7.89181 2.73482 -105.47933 1081.72454
7160.0000 -112.59291 -106.28341 6.30950 2.68668 -106.11517 1068.14888
7165.0000 -113.34064 -106.90616 6.43447 2.60492 -107.19497 993.91286
7170.0000 -113.06007 -105.53643 7.52364 2.73315 -105.50131 1100.67456
7175.0000 -112.03963 -104.66443 7.37520 2.74655 -105.32435 1086.36659
7180.0000 -112.76375 -106.08891 6.67485 2.76999 -105.01483 1118.19216
7185.0000 -112.19867 -105.63634 6.56232 2.76735 -105.04958 1070.23498
7190.0000 -113.38494 -107.93871 5.44624 2.61436 -107.07036 1021.50182
7195.0000 -113.09967 -107.38051 5.71916 2.66346 -106.42179 1001.33092
7200.0000 -112.74720 -107.66558 5.08162 2.61397 -107.07540 1004.95914
7205.0000 -112.53368 -105.90554 6.62814 2.64770 -106.62988 985.58809
7210.0000 -110.65640 -103.44560 7.21080 2.75378 -105.22893 1112.15694
7215.0000 -112.75217 -105.87195 6.88022 2.72574 -105.59925 1072.18185
7220.0000 -113.71632 -106.24575 7.47057 2.72625 -105.59244 1086.74141
7225.0000 -113.81110 -105.75520 8.05589 2.67194 -106.30986 1076.57218
7230.0000 -112.33334 -105.20491 7.12844 2.71675 -105.71794 1033.62092
7235.0000 -110.30208 -104.08621 6.21587 2.81201 -104.45981 1130.49316
7240.0000 -110.87080 -105.23877 5.63203 2.74711 -105.31702 1041.31378
7245.0000 -112.30845 -106.01693 6.29152 2.70013 -105.93752 1044.22638
7250.0000 -110.00298 -104.56474 5.43824 2.75871 -105.16382 1062.15186
MELTING PROCESS: loop number 30 T-loop= 1066.0000000000000
main_MD> interactions number 30 at Temperature= 1066.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.02934 -7.81954 3.08291
force_rgl> df(natom) -3.05529 4.28282 2.40433
7255.0000 -111.21988 -104.46931 6.75057 2.80226 -104.58857 1138.88273
7260.0000 -111.33420 -103.53587 7.79833 2.79136 -104.73259 1124.75379
7265.0000 -109.47460 -102.25849 7.21610 2.93517 -102.83310 1202.02253
7270.0000 -113.78278 -107.76905 6.01373 2.70911 -105.81884 1033.24505
7275.0000 -112.30463 -106.02390 6.28073 2.65202 -106.57293 990.91589
7280.0000 -112.41235 -105.23747 7.17488 2.71089 -105.79539 1090.50725
7285.0000 -111.39148 -104.70083 6.69065 2.80178 -104.59485 1147.12299
7290.0000 -113.13501 -106.07342 7.06159 2.75602 -105.19926 1092.26348
7295.0000 -111.18738 -103.09150 8.09588 2.75630 -105.19561 1120.20459
7300.0000 -112.45795 -105.70770 6.75025 2.78939 -104.75849 1098.32473
7305.0000 -109.92471 -104.51137 5.41334 2.72457 -105.61471 1056.62750
7310.0000 -111.33704 -103.82211 7.51492 2.82250 -104.32128 1092.62853
7315.0000 -111.67937 -103.65951 8.01986 2.79409 -104.69647 1103.02414
7320.0000 -112.81358 -105.74894 7.06465 2.78021 -104.87986 1126.22014
7325.0000 -111.20497 -104.89584 6.30913 2.70607 -105.85899 1049.28920
7330.0000 -110.77817 -104.63913 6.13904 2.83591 -104.14409 1149.33620
7335.0000 -111.25762 -105.14409 6.11353 2.76210 -105.11894 1080.18290
7340.0000 -112.21616 -105.32801 6.88815 2.76440 -105.08854 1110.18605
7345.0000 -113.13542 -106.83918 6.29625 2.67116 -106.32008 1059.30485
7350.0000 -112.19637 -105.52120 6.67518 2.66724 -106.37182 1040.29409
7355.0000 -110.29472 -103.68802 6.60669 2.77188 -104.98978 1123.37863
7360.0000 -111.95556 -105.40145 6.55411 2.81858 -104.37297 1163.31723
7365.0000 -114.34950 -108.39079 5.95871 2.64585 -106.65444 1026.94322
7370.0000 -113.42956 -107.46050 5.96906 2.55851 -107.80793 952.06018
7375.0000 -113.14071 -107.05743 6.08329 2.62785 -106.89217 996.69592
7380.0000 -111.85803 -105.47119 6.38685 2.70522 -105.87025 1060.38436
7385.0000 -112.88663 -106.07963 6.80701 2.69057 -106.06379 1036.47433
7390.0000 -111.83508 -104.97623 6.85885 2.70972 -105.81075 1073.65981
7395.0000 -110.11900 -103.76403 6.35496 2.75997 -105.14716 1047.00177
7400.0000 -113.22393 -106.62351 6.60042 2.77435 -104.95723 1117.27514
7405.0000 -112.25365 -105.81374 6.43991 2.71176 -105.78385 1040.99386
7410.0000 -113.30132 -107.06871 6.23261 2.68722 -106.10801 1014.87926
7415.0000 -111.31258 -103.50306 7.80953 2.76763 -105.04597 1101.91021
7420.0000 -113.26448 -105.46712 7.79736 2.76793 -105.04193 1098.43475
7425.0000 -113.00883 -106.91180 6.09702 2.63445 -106.80495 982.97216
7430.0000 -113.94877 -107.65857 6.29020 2.55690 -107.82921 957.94808
7435.0000 -113.64398 -106.11118 7.53281 2.61436 -107.07026 961.04358
7440.0000 -110.31055 -104.50637 5.80418 2.77641 -104.93001 1101.27560
7445.0000 -111.72201 -103.85154 7.87047 2.80331 -104.57464 1131.10223
7450.0000 -111.98415 -104.94337 7.04078 2.79509 -104.68329 1094.86439
7455.0000 -110.36444 -104.07343 6.29101 2.84983 -103.96032 1103.02926
7460.0000 -112.12218 -106.14589 5.97630 2.72619 -105.59330 1058.32078
7465.0000 -113.28247 -106.80685 6.47562 2.65482 -106.53588 1012.49788
7470.0000 -114.38573 -108.16680 6.21893 2.61884 -107.01112 997.55056
7475.0000 -113.26181 -107.98267 5.27914 2.52444 -108.25795 917.29033
7480.0000 -112.15728 -105.21584 6.94144 2.63433 -106.80650 996.18304
7485.0000 -111.32508 -106.35332 4.97176 2.71780 -105.70412 1108.26398
7490.0000 -112.25418 -106.50572 5.74845 2.67281 -106.29831 1021.02571
7495.0000 -112.15877 -105.59424 6.56453 2.71248 -105.77439 1084.73243
7500.0000 -112.67614 -106.27373 6.40241 2.78991 -104.75173 1122.20990
MELTING PROCESS: loop number 31 T-loop= 1091.0000000000000
main_MD> interactions number 31 at Temperature= 1091.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 5.38214 -13.86126 4.47285
force_rgl> df(natom) -2.77808 -1.40438 0.00217
7505.0000 -112.42886 -105.47444 6.95442 2.73179 -105.51929 1056.16170
7510.0000 -112.19514 -105.23395 6.96119 2.78628 -104.79956 1122.67331
7515.0000 -112.25587 -104.22645 8.02942 2.73808 -105.43622 1069.91448
7520.0000 -113.21547 -105.66388 7.55159 2.72868 -105.56040 1043.15314
7525.0000 -112.20017 -106.15528 6.04489 2.66585 -106.39025 1026.53578
7530.0000 -111.56182 -105.38783 6.17399 2.65964 -106.47224 1002.65669
7535.0000 -112.41739 -105.61958 6.79781 2.71939 -105.68303 1057.05070
7540.0000 -112.04171 -104.06739 7.97433 2.77482 -104.95100 1138.54840
7545.0000 -112.27639 -105.55177 6.72462 2.79588 -104.67286 1110.77735
7550.0000 -114.70217 -108.33741 6.36475 2.59749 -107.29306 966.43481
7555.0000 -111.47393 -104.80983 6.66410 2.63355 -106.81686 1019.64742
7560.0000 -111.15654 -104.98546 6.17108 2.85783 -103.85457 1224.04908
7565.0000 -111.80907 -104.63661 7.17247 2.80076 -104.60838 1113.38472
7570.0000 -111.61774 -106.18774 5.43000 2.72687 -105.58428 1109.86928
7575.0000 -113.73629 -107.14521 6.59108 2.57176 -107.63295 963.35192
7580.0000 -113.00966 -106.89424 6.11543 2.56860 -107.67468 964.15472
7585.0000 -111.26880 -105.32358 5.94522 2.70276 -105.90274 1053.16384
7590.0000 -110.94587 -105.86963 5.07624 2.71401 -105.75420 1032.04448
7595.0000 -112.90016 -105.77923 7.12093 2.68547 -106.13116 1025.55875
7600.0000 -111.26399 -103.89032 7.37366 2.73280 -105.50592 1106.19841
7605.0000 -111.18928 -103.49586 7.69342 2.88760 -103.46139 1195.05565
7610.0000 -112.05581 -106.25875 5.79706 2.82697 -104.26223 1150.20238
7615.0000 -113.54113 -107.12309 6.41804 2.61462 -107.06688 985.44230
7620.0000 -111.13029 -104.49214 6.63815 2.70970 -105.81103 1043.08775
7625.0000 -112.96950 -106.06994 6.89957 2.74098 -105.39789 1122.42455
7630.0000 -112.87958 -106.51030 6.36928 2.70858 -105.82580 1082.08288
7635.0000 -112.29695 -105.02007 7.27689 2.68219 -106.17438 1066.84267
7640.0000 -112.25077 -105.57323 6.67754 2.77758 -104.91458 1118.73801
7645.0000 -111.25251 -105.14707 6.10543 2.71206 -105.77985 1077.13514
7650.0000 -112.48239 -105.19203 7.29036 2.76016 -105.14455 1112.59338
7655.0000 -113.70743 -107.58781 6.11962 2.65589 -106.52178 1065.41056
7660.0000 -111.80629 -105.40004 6.40625 2.65348 -106.55356 999.75954
7665.0000 -111.07638 -105.61458 5.46180 2.77504 -104.94811 1122.10811
7670.0000 -112.99848 -106.14259 6.85590 2.67159 -106.31442 1030.28025
7675.0000 -111.82651 -103.87922 7.94728 2.75025 -105.27548 1094.70766
7680.0000 -111.73072 -104.20349 7.52723 2.83931 -104.09925 1156.05066
7685.0000 -112.75079 -105.79238 6.95840 2.78194 -104.85691 1098.09003
7690.0000 -112.12801 -105.43210 6.69591 2.68851 -106.09093 1048.13988
7695.0000 -113.02469 -107.02701 5.99768 2.67441 -106.27722 1057.88540
7700.0000 -112.12137 -105.95663 6.16475 2.68706 -106.11012 1059.73809
7705.0000 -112.72969 -106.10052 6.62917 2.65885 -106.48272 1011.05306
7710.0000 -111.31126 -105.06695 6.24431 2.80646 -104.53309 1149.76960
7715.0000 -111.69585 -105.24769 6.44816 2.73641 -105.45829 1104.10692
7720.0000 -111.69418 -105.14420 6.54997 2.77767 -104.91336 1085.62285
7725.0000 -111.49839 -105.44220 6.05619 2.75915 -105.15796 1034.09954
7730.0000 -113.14510 -106.62360 6.52150 2.72729 -105.57871 1073.12484
7735.0000 -113.28842 -106.95276 6.33567 2.64582 -106.65482 1002.08233
7740.0000 -113.82879 -106.53247 7.29632 2.63985 -106.73364 998.11559
7745.0000 -112.11723 -105.17760 6.93963 2.70171 -105.91659 1043.27992
7750.0000 -110.74977 -104.76515 5.98462 2.75788 -105.17477 1099.75737
MELTING PROCESS: loop number 32 T-loop= 1116.0000000000000
main_MD> interactions number 32 at Temperature= 1116.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -2.45751 1.24010 1.31945
force_rgl> df(natom) -7.83550 -0.61179 -5.38545
7755.0000 -111.09784 -104.05732 7.04052 2.85063 -103.94967 1147.90766
7760.0000 -111.07571 -104.17007 6.90565 2.84046 -104.08406 1181.06307
7765.0000 -113.18981 -106.01584 7.17398 2.77308 -104.97402 1135.46583
7770.0000 -112.50646 -106.14310 6.36336 2.68119 -106.18765 1065.44048
7775.0000 -113.22229 -106.12598 7.09631 2.71693 -105.71559 1078.53494
7780.0000 -112.04056 -104.86655 7.17401 2.79569 -104.67531 1120.42592
7785.0000 -112.49635 -106.60314 5.89321 2.72717 -105.58031 1060.08244
7790.0000 -112.40196 -105.00949 7.39247 2.76879 -105.03059 1140.13442
7795.0000 -112.40478 -105.67940 6.72538 2.82472 -104.29191 1139.11759
7800.0000 -111.69587 -105.31383 6.38204 2.75929 -105.15611 1084.82545
7805.0000 -111.48012 -104.47094 7.00918 2.82071 -104.34489 1143.18342
7810.0000 -110.21698 -104.20323 6.01375 2.85068 -103.94900 1137.28855
7815.0000 -112.40052 -106.80074 5.59978 2.79384 -104.69979 1049.84679
7820.0000 -111.73769 -103.41295 8.32474 2.77657 -104.92792 1120.72438
7825.0000 -110.63872 -103.21756 7.42117 2.87483 -103.63003 1160.10939
7830.0000 -110.70334 -103.70817 6.99517 2.87618 -103.61226 1159.25160
7835.0000 -110.91377 -104.52908 6.38470 2.81571 -104.41096 1165.86113
7840.0000 -110.41642 -102.84992 7.56650 2.96302 -102.46526 1266.33120
7845.0000 -112.45477 -104.84754 7.60723 2.85178 -103.93450 1167.03205
7850.0000 -110.56129 -103.83599 6.72530 2.83253 -104.18880 1168.74564
7855.0000 -110.76971 -102.57461 8.19510 2.94594 -102.69082 1239.37559
7860.0000 -111.07821 -101.68653 9.39168 2.95087 -102.62577 1225.07399
7865.0000 -110.88472 -104.07554 6.80918 2.94929 -102.64667 1292.50932
7870.0000 -112.09537 -104.53231 7.56306 2.87692 -103.60254 1204.38507
7875.0000 -111.46615 -104.78109 6.68507 2.72950 -105.54952 1072.78220
7880.0000 -110.54390 -103.49979 7.04411 2.82608 -104.27402 1172.96197
7885.0000 -111.29450 -103.76387 7.53063 2.94734 -102.67242 1193.28690
7890.0000 -110.58091 -103.23993 7.34098 2.87147 -103.67446 1202.04450
7895.0000 -109.58206 -102.88833 6.69373 2.91891 -103.04795 1212.51551
7900.0000 -112.70383 -104.48797 8.21586 2.79870 -104.63553 1095.74496
7905.0000 -111.69435 -103.63712 8.05723 2.92465 -102.97210 1199.82700
7910.0000 -111.19178 -102.80021 8.39158 2.82340 -104.30933 1138.96825
7915.0000 -109.70798 -102.44515 7.26283 2.99558 -102.03519 1311.70248
7920.0000 -111.75454 -106.23647 5.51807 2.87219 -103.66492 1173.40932
7925.0000 -110.96029 -103.99915 6.96114 2.73726 -105.44704 1071.10979
7930.0000 -108.32622 -100.04484 8.28138 3.01078 -101.83445 1289.05634
7935.0000 -111.34655 -102.54868 8.79787 3.01740 -101.74706 1281.32285
7940.0000 -110.28997 -103.86719 6.42278 2.91730 -103.06909 1223.71296
7945.0000 -112.02637 -104.75147 7.27490 2.86226 -103.79615 1184.26991
7950.0000 -113.45485 -106.80709 6.64776 2.71441 -105.74881 1077.11416
7955.0000 -113.39530 -105.25633 8.13897 2.70042 -105.93365 1065.94696
7960.0000 -113.44631 -106.49275 6.95355 2.72513 -105.60727 1043.31408
7965.0000 -112.57834 -104.75068 7.82766 2.71705 -105.71404 1068.89544
7970.0000 -110.39417 -103.66817 6.72600 2.77547 -104.94237 1145.89188
7975.0000 -110.25426 -103.35291 6.90135 2.86076 -103.81588 1174.30304
7980.0000 -111.40533 -105.53601 5.86932 2.88235 -103.53078 1169.88730
7985.0000 -111.92607 -105.80051 6.12557 2.72584 -105.59788 1060.41044
7990.0000 -112.28160 -104.16006 8.12154 2.75525 -105.20944 1113.45492
7995.0000 -111.75111 -104.16043 7.59068 2.83475 -104.15947 1150.32780
8000.0000 -109.01740 -102.45650 6.56089 2.87573 -103.61815 1208.85662
MELTING PROCESS: loop number 33 T-loop= 1141.0000000000000
main_MD> interactions number 33 at Temperature= 1141.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.68926 1.99320 8.76636
force_rgl> df(natom) -5.16045 -1.90625 3.79791
8005.0000 -110.93502 -104.36511 6.56991 2.88519 -103.49331 1235.45176
8010.0000 -111.82440 -105.84378 5.98061 2.78219 -104.85361 1094.77828
8015.0000 -112.55551 -104.40922 8.14629 2.74165 -105.38909 1081.83765
8020.0000 -113.23318 -107.01327 6.21991 2.66112 -106.45274 1050.17727
8025.0000 -112.12054 -106.26504 5.85550 2.69692 -105.97986 1037.85293
8030.0000 -112.72008 -107.41036 5.30972 2.65517 -106.53131 1017.86342
8035.0000 -112.92344 -105.17992 7.74352 2.60258 -107.22594 983.70189
8040.0000 -112.13294 -105.52181 6.61113 2.74620 -105.32905 1077.64886
8045.0000 -111.42044 -104.67055 6.74989 2.75547 -105.20660 1093.10401
8050.0000 -110.65541 -103.09196 7.56345 2.78658 -104.79568 1131.40305
8055.0000 -110.40507 -104.01379 6.39128 2.92876 -102.91784 1203.68192
8060.0000 -111.74680 -104.89365 6.85314 2.79964 -104.62310 1133.47356
8065.0000 -112.02813 -104.30088 7.72725 2.79222 -104.72112 1131.12097
8070.0000 -112.79378 -104.55086 8.24292 2.84065 -104.08148 1181.50151
8075.0000 -113.69277 -106.70399 6.98877 2.80015 -104.61648 1160.26838
8080.0000 -113.37449 -105.91448 7.46001 2.72492 -105.60999 1098.90061
8085.0000 -113.68798 -106.45712 7.23086 2.66093 -106.45515 1015.38244
8090.0000 -112.39930 -104.98204 7.41726 2.75872 -105.16363 1099.84332
8095.0000 -109.55842 -101.97573 7.58269 2.88585 -103.48449 1227.26111
8100.0000 -111.12912 -104.40744 6.72169 2.82499 -104.28836 1109.34676
8105.0000 -112.16207 -104.38340 7.77867 2.70762 -105.83853 1068.62312
8110.0000 -110.77446 -105.23000 5.54445 2.78734 -104.78564 1108.24097
8115.0000 -113.15107 -106.53425 6.61683 2.72976 -105.54614 1080.09331
8120.0000 -112.21966 -105.14460 7.07506 2.72836 -105.56457 1084.34260
8125.0000 -113.00227 -104.65024 8.35204 2.77497 -104.94903 1108.48373
8130.0000 -113.10167 -104.81863 8.28304 2.72768 -105.57355 1077.56158
8135.0000 -112.45188 -104.68550 7.76637 2.75771 -105.17691 1120.33202
8140.0000 -110.25753 -103.88496 6.37257 2.74536 -105.34008 1089.54100
8145.0000 -111.04446 -103.85690 7.18756 2.86431 -103.76909 1168.49277
8150.0000 -111.74909 -104.09991 7.64918 2.81415 -104.43157 1123.53089
8155.0000 -111.60955 -105.11397 6.49558 2.78276 -104.84607 1110.64908
8160.0000 -111.35630 -103.76188 7.59443 2.76588 -105.06905 1103.68336
8165.0000 -111.23762 -103.82588 7.41174 2.86964 -103.69864 1172.87557
8170.0000 -111.46388 -105.14247 6.32141 2.81938 -104.36248 1127.67242
8175.0000 -112.06896 -104.37943 7.68952 2.83880 -104.10602 1147.77567
8180.0000 -109.43101 -103.09733 6.33368 2.88575 -103.48580 1211.52410
8185.0000 -109.79348 -102.56773 7.22575 2.91934 -103.04215 1230.42864
8190.0000 -111.61496 -104.39079 7.22417 2.95661 -102.54994 1174.28058
8195.0000 -110.29106 -103.44450 6.84656 2.84859 -103.97670 1153.96744
8200.0000 -112.70633 -106.60283 6.10350 2.82731 -104.25765 1150.98323
8205.0000 -113.98665 -108.32783 5.65883 2.60185 -107.23550 973.37460
8210.0000 -112.14048 -104.79846 7.34203 2.64665 -106.64378 994.10673
8215.0000 -111.12066 -103.95606 7.16461 2.86320 -103.78368 1162.25904
8220.0000 -111.78038 -102.52952 9.25086 2.90531 -103.22745 1169.96513
8225.0000 -111.06399 -104.11711 6.94688 2.85034 -103.95352 1133.28894
8230.0000 -108.53617 -102.03431 6.50186 2.86979 -103.69663 1179.94312
8235.0000 -111.80234 -103.49061 8.31173 2.90061 -103.28963 1161.11860
8240.0000 -111.82869 -105.07406 6.75464 2.81668 -104.39812 1146.81019
8245.0000 -110.72636 -103.31661 7.40975 2.82355 -104.30743 1135.51226
8250.0000 -110.94264 -102.38928 8.55336 2.89067 -103.42094 1183.78841
MELTING PROCESS: loop number 34 T-loop= 1166.0000000000000
main_MD> interactions number 34 at Temperature= 1166.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -3.06441 -2.69496 0.18948
force_rgl> df(natom) -0.17692 2.25379 3.63162
8255.0000 -108.98884 -101.10746 7.88138 2.96956 -102.37895 1258.51901
8260.0000 -110.99063 -102.48966 8.50096 2.98111 -102.22633 1268.08397
8265.0000 -108.64658 -102.24994 6.39663 2.93654 -102.81508 1224.17948
8270.0000 -109.75678 -102.31437 7.44241 2.93123 -102.88517 1233.05501
8275.0000 -111.95772 -102.05393 9.90379 2.96365 -102.45703 1290.94070
8280.0000 -111.73713 -103.76346 7.97368 2.96127 -102.48836 1291.56413
8285.0000 -111.18548 -105.09781 6.08767 2.80223 -104.58903 1156.45622
8290.0000 -113.02905 -106.24317 6.78588 2.76913 -105.02615 1119.31134
8295.0000 -113.14309 -107.58897 5.55412 2.66038 -106.46242 997.99756
8300.0000 -111.97599 -105.22286 6.75313 2.70255 -105.90548 1071.87657
8305.0000 -112.64437 -105.05349 7.59088 2.85730 -103.86155 1120.86909
8310.0000 -112.24858 -105.11128 7.13730 2.74985 -105.28084 1093.83107
8315.0000 -111.03188 -104.19117 6.84070 2.81384 -104.43561 1137.06379
8320.0000 -112.64197 -104.52924 8.11273 2.81802 -104.38036 1148.81405
8325.0000 -113.01225 -106.62505 6.38719 2.72999 -105.54315 1058.72276
8330.0000 -111.38640 -104.64504 6.74137 2.73943 -105.41841 1105.41490
8335.0000 -110.84143 -102.39462 8.44680 2.85765 -103.85701 1125.58134
8340.0000 -110.27358 -102.35182 7.92176 2.93641 -102.81670 1221.70181
8345.0000 -111.24908 -103.70232 7.54676 2.95335 -102.59301 1249.73193
8350.0000 -113.01098 -105.68286 7.32813 2.72189 -105.65007 1084.07891
8355.0000 -111.83073 -105.45794 6.37279 2.73714 -105.44861 1086.27213
8360.0000 -111.89138 -105.47714 6.41424 2.69138 -106.05305 1038.24860
8365.0000 -111.98614 -104.49638 7.48976 2.77218 -104.98586 1130.65449
8370.0000 -112.71476 -105.41716 7.29760 2.79535 -104.67986 1096.19646
8375.0000 -112.76785 -104.76835 7.99951 2.76453 -105.08684 1098.22078
8380.0000 -112.36354 -104.74377 7.61978 2.73272 -105.50698 1111.57814
8385.0000 -111.80514 -104.24014 7.56500 2.77364 -104.96653 1111.64235
8390.0000 -111.76212 -104.28267 7.47945 2.84464 -104.02882 1140.06794
8395.0000 -112.15151 -105.42015 6.73136 2.76602 -105.06717 1102.35659
8400.0000 -109.52830 -102.05187 7.47643 2.87121 -103.67791 1180.48867
8405.0000 -111.04090 -102.31468 8.72622 2.97544 -102.30121 1241.46128
8410.0000 -111.10088 -104.22667 6.87421 2.88854 -103.44899 1174.51088
8415.0000 -109.82718 -102.97660 6.85058 2.89062 -103.42148 1203.47764
8420.0000 -112.15645 -103.94111 8.21534 2.89095 -103.41713 1171.68282
8425.0000 -111.50898 -103.87995 7.62903 2.86779 -103.72312 1141.28086
8430.0000 -111.86196 -105.45917 6.40279 2.85733 -103.86120 1191.72052
8435.0000 -112.81668 -106.60063 6.21605 2.67201 -106.30891 1024.35388
8440.0000 -112.04015 -105.24834 6.79180 2.73045 -105.53703 1113.92778
8445.0000 -110.38947 -104.36474 6.02473 2.89711 -103.33582 1192.19481
8450.0000 -111.54528 -103.99394 7.55135 2.80285 -104.58073 1098.55757
8455.0000 -112.17165 -104.87822 7.29343 2.80690 -104.52724 1091.17809
8460.0000 -111.43708 -104.40278 7.03430 2.75114 -105.26371 1048.90502
8465.0000 -110.93022 -104.22203 6.70819 2.77443 -104.95615 1115.90004
8470.0000 -112.20219 -104.03359 8.16860 2.85715 -103.86357 1182.53334
8475.0000 -111.18062 -104.06946 7.11117 2.86924 -103.70388 1194.40396
8480.0000 -110.68259 -103.52720 7.15539 2.86832 -103.71602 1216.82490
8485.0000 -109.19643 -102.22154 6.97489 3.00242 -101.94485 1272.63219
8490.0000 -113.15023 -107.33338 5.81684 2.86491 -103.76110 1170.22728
8495.0000 -113.00242 -107.04801 5.95441 2.64126 -106.71495 995.09394
8500.0000 -112.25904 -104.61455 7.64449 2.71469 -105.74518 1050.02761
MELTING PROCESS: loop number 35 T-loop= 1191.0000000000000
main_MD> interactions number 35 at Temperature= 1191.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.42301 -0.08401 2.39490
force_rgl> df(natom) -3.39037 2.25769 -0.03122
8505.0000 -111.20869 -104.31187 6.89682 2.77151 -104.99472 1088.50698
8510.0000 -111.47039 -105.17574 6.29465 2.78752 -104.78319 1110.20676
8515.0000 -113.25463 -105.79299 7.46164 2.73321 -105.50058 1113.79016
8520.0000 -111.07539 -103.41876 7.65663 2.86191 -103.80067 1164.77606
8525.0000 -110.87199 -102.80683 8.06515 2.93809 -102.79455 1276.02845
8530.0000 -109.81388 -103.23856 6.57531 2.88895 -103.44358 1188.69339
8535.0000 -111.37851 -102.15654 9.22197 2.97030 -102.36912 1277.41295
8540.0000 -110.94675 -103.63362 7.31313 2.95767 -102.53596 1267.16374
8545.0000 -110.63240 -102.64025 7.99215 2.89471 -103.36753 1230.32868
8550.0000 -110.52581 -100.79051 9.73530 2.99253 -102.07552 1264.11678
8555.0000 -110.59071 -103.12963 7.46108 3.06772 -101.08248 1284.94934
8560.0000 -109.11889 -101.52789 7.59100 3.02823 -101.60400 1250.29707
8565.0000 -109.36802 -101.50963 7.85840 3.05832 -101.20662 1290.76579
8570.0000 -112.20890 -103.21321 8.99568 2.93801 -102.79556 1248.39247
8575.0000 -111.18468 -100.98360 10.20108 2.92648 -102.94790 1241.00494
8580.0000 -110.04360 -101.85465 8.18895 3.03910 -101.46050 1355.49836
8585.0000 -110.17745 -103.61447 6.56298 2.91100 -103.15242 1226.37948
8590.0000 -111.08896 -104.03859 7.05037 2.89381 -103.37939 1227.42673
8595.0000 -113.17848 -105.33246 7.84602 2.83771 -104.12036 1146.49182
8600.0000 -110.64327 -103.73374 6.90953 2.86099 -103.81289 1148.70273
8605.0000 -112.17361 -104.76633 7.40728 2.79801 -104.64475 1119.17214
8610.0000 -111.75441 -105.24007 6.51434 2.84426 -104.03380 1157.48095
8615.0000 -110.48797 -103.08926 7.39871 2.86342 -103.78083 1179.24018
8620.0000 -111.96222 -103.71904 8.24318 2.89840 -103.31873 1219.14678
8625.0000 -110.19581 -102.95962 7.23619 2.95455 -102.57716 1247.36662
8630.0000 -109.15131 -101.82400 7.32732 2.97413 -102.31858 1258.88021
8635.0000 -110.84705 -104.16787 6.67918 2.94019 -102.76678 1237.51539
8640.0000 -110.81411 -105.16212 5.65199 2.86722 -103.73057 1149.72868
8645.0000 -110.65196 -103.74848 6.90348 2.81447 -104.42732 1184.07346
8650.0000 -111.26232 -103.66166 7.60065 2.83685 -104.13169 1137.83147
8655.0000 -111.12997 -105.58711 5.54286 2.79505 -104.68376 1135.34453
8660.0000 -111.13033 -104.45334 6.67699 2.74349 -105.36473 1086.43500
8665.0000 -109.83022 -103.33732 6.49289 2.82417 -104.29921 1163.01870
8670.0000 -110.94550 -101.82757 9.11793 2.93327 -102.85819 1194.96359
8675.0000 -109.32775 -102.02146 7.30629 3.04228 -101.41839 1348.49552
8680.0000 -109.92722 -103.01446 6.91276 2.93865 -102.78718 1199.05022
8685.0000 -110.56521 -103.55904 7.00617 2.90951 -103.17206 1210.44940
8690.0000 -110.81841 -103.41261 7.40580 2.92387 -102.98234 1227.15816
8695.0000 -111.65736 -103.38242 8.27494 2.94664 -102.68170 1239.46668
8700.0000 -112.13086 -105.95794 6.17292 2.69834 -105.96116 1025.45386
8705.0000 -111.17894 -103.81537 7.36357 2.82229 -104.32404 1159.02268
8710.0000 -109.54412 -102.08196 7.46216 2.90449 -103.23835 1219.39575
8715.0000 -111.49546 -102.20126 9.29420 2.99467 -102.04723 1308.77637
8720.0000 -110.55154 -103.40542 7.14612 2.87402 -103.64080 1208.08573
8725.0000 -110.87349 -105.12387 5.74962 2.82737 -104.25694 1135.62634
8730.0000 -109.74799 -102.00258 7.74541 2.92191 -103.00821 1162.36313
8735.0000 -111.33570 -102.69195 8.64375 3.01133 -101.82726 1305.61706
8740.0000 -109.49535 -101.72512 7.77023 3.08714 -100.82600 1336.04901
8745.0000 -111.67958 -102.71729 8.96228 3.00999 -101.84497 1323.72360
8750.0000 -109.59803 -102.75169 6.84633 2.91770 -103.06384 1222.21189
main_MD> EXECUTION TIME: 0 [day], 0 [hour], 8 [min], 26.4746226 [s].
main_MD> Deallocating global variables
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