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nanoparticlesims/growth_Melting_Silver_ICO_2451/meltingSims/run_58/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_58.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 = 58 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: 58 5800
main_MD> Size of nv and nvoiz: 58 5800
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 = 58
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> 4.5852472010595152E-003 -0.11834822111154583 -0.10324957095454751 initial drift of cluster / NP1 for coalescence
init> 0.36603880881067730 0.34213114655775745 0.33860934028276152 scaling for velocity /for coalescence NP1
init.f90 > facguy = 1.9055392125450796E-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) 2.11220 1.69318 0.93874
force_rgl> df(natom) -2.09746 2.41709 0.48270
preparo> THERMALIZATION PROCESS AT 314.24325855407693
preparo> TOTAL ENERGY, KINETIC EN., POT. ENERGY, DELTA
5000 -145.12881778466226 2.1345246999221574 -147.26334248458443 3.7173620850784148E-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= 340.00000000000000
main_MD> interactions number 1 at Temperature= 340.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -3.61816 -2.46041 -4.81082
force_rgl> df(natom) -1.15928 -0.45477 0.82807
5.0000 -146.63353 -143.89657 2.73696 1.78522 -144.35075 354.27961
10.0000 -147.06515 -144.50160 2.56354 1.79629 -144.18493 348.06171
15.0000 -147.36384 -144.63015 2.73369 1.77370 -144.52338 343.88372
20.0000 -147.45707 -144.71132 2.74575 1.75872 -144.74795 329.87055
25.0000 -146.88701 -144.51132 2.37569 1.77938 -144.43828 347.44344
30.0000 -146.89572 -144.20411 2.69161 1.78770 -144.31371 353.02066
35.0000 -147.20251 -144.83512 2.36739 1.78748 -144.31695 370.48065
40.0000 -147.46475 -145.17759 2.28716 1.73616 -145.08595 326.39706
45.0000 -147.57539 -144.99313 2.58225 1.74494 -144.95441 331.58329
50.0000 -147.47489 -144.90251 2.57238 1.74572 -144.94268 336.78287
55.0000 -147.40695 -145.33721 2.06973 1.74270 -144.98794 331.12312
60.0000 -147.79966 -145.37250 2.42716 1.70246 -145.59095 292.03871
65.0000 -147.82378 -145.38976 2.43402 1.71884 -145.34543 310.74898
70.0000 -147.74880 -144.81945 2.92935 1.74291 -144.98473 330.84018
75.0000 -147.60762 -145.06150 2.54612 1.73294 -145.13414 323.42600
80.0000 -147.52945 -145.09628 2.43317 1.74069 -145.01807 329.79044
85.0000 -147.15497 -144.62967 2.52530 1.75080 -144.86658 342.42600
90.0000 -147.39443 -144.99517 2.39926 1.74319 -144.98063 333.33548
95.0000 -147.42137 -144.78442 2.63696 1.73652 -145.08051 324.39374
100.0000 -147.07442 -144.55528 2.51915 1.76320 -144.68076 349.19006
105.0000 -148.05387 -145.29245 2.76143 1.74508 -144.95230 335.65102
110.0000 -147.60373 -145.54290 2.06083 1.70571 -145.54218 296.84534
115.0000 -147.48158 -144.77607 2.70551 1.73209 -145.14697 324.95838
120.0000 -147.26907 -144.66512 2.60395 1.76109 -144.71233 354.85932
125.0000 -147.70425 -144.83763 2.86662 1.76048 -144.72152 347.08762
130.0000 -146.75874 -144.13150 2.62723 1.77458 -144.51024 360.74497
135.0000 -146.56045 -143.47676 3.08369 1.82449 -143.76239 408.10920
140.0000 -147.67633 -145.14678 2.52955 1.78357 -144.37552 371.99535
145.0000 -147.89755 -145.43445 2.46310 1.71086 -145.46500 304.21703
150.0000 -147.10441 -145.23761 1.86680 1.71894 -145.34402 312.72519
155.0000 -147.90846 -145.23415 2.67432 1.73381 -145.12111 324.62953
160.0000 -147.47448 -144.97271 2.50177 1.73588 -145.09014 327.35084
165.0000 -147.32525 -144.40061 2.92464 1.75944 -144.73715 346.64205
170.0000 -147.17426 -144.83925 2.33500 1.77146 -144.55703 357.04792
175.0000 -147.99967 -145.82296 2.17671 1.73169 -145.15283 323.92155
180.0000 -146.80513 -144.17285 2.63228 1.74054 -145.02034 328.83671
185.0000 -146.94161 -144.54020 2.40141 1.79115 -144.26194 374.67884
190.0000 -147.30226 -144.55180 2.75045 1.78727 -144.32012 374.05308
195.0000 -147.29107 -144.96063 2.33044 1.75195 -144.84930 340.59688
200.0000 -147.69577 -145.06903 2.62674 1.74410 -144.96697 331.86174
205.0000 -147.32495 -144.11359 3.21136 1.76333 -144.67878 352.82940
210.0000 -147.68729 -145.12327 2.56401 1.75756 -144.76532 347.95585
215.0000 -147.27875 -144.94338 2.33537 1.74028 -145.02417 329.51213
220.0000 -147.92493 -145.15753 2.76740 1.74541 -144.94734 338.41456
225.0000 -147.04165 -144.62765 2.41400 1.73695 -145.07412 324.14451
230.0000 -147.63592 -144.74381 2.89212 1.74106 -145.01258 334.42136
235.0000 -147.48015 -144.50933 2.97083 1.76044 -144.72210 345.43646
240.0000 -146.98083 -144.47472 2.50611 1.76687 -144.62572 352.67542
245.0000 -147.24473 -144.78445 2.46028 1.78426 -144.36517 368.42783
250.0000 -147.37480 -144.95265 2.42215 1.75310 -144.83206 343.10997
MELTING PROCESS: loop number 2 T-loop= 365.00000000000000
main_MD> interactions number 2 at Temperature= 365.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.80257 -0.26072 -2.52957
force_rgl> df(natom) -2.52753 -0.03288 0.07792
255.0000 -146.93670 -144.61892 2.31778 1.76558 -144.64509 352.13422
260.0000 -147.48220 -144.58953 2.89267 1.76776 -144.61244 352.33031
265.0000 -147.26348 -144.10150 3.16198 1.79434 -144.21412 382.20891
270.0000 -146.87179 -144.02565 2.84614 1.79987 -144.13133 383.53771
275.0000 -147.25849 -144.69665 2.56184 1.80602 -144.03923 388.57095
280.0000 -147.57913 -144.67083 2.90830 1.75725 -144.76996 345.39713
285.0000 -147.14505 -144.24845 2.89659 1.77628 -144.48480 362.44937
290.0000 -147.04052 -144.69345 2.34707 1.77174 -144.55281 356.24330
295.0000 -147.87899 -145.07037 2.80862 1.74588 -144.94024 333.61545
300.0000 -147.29759 -144.36192 2.93567 1.77887 -144.44603 365.42479
305.0000 -147.25032 -145.08284 2.16748 1.76345 -144.67696 353.76964
310.0000 -146.92738 -144.21934 2.70804 1.77557 -144.49542 365.39496
315.0000 -146.86158 -144.78698 2.07460 1.78149 -144.40678 366.72757
320.0000 -147.63513 -145.00134 2.63378 1.77341 -144.52771 360.00180
325.0000 -147.05551 -144.35604 2.69947 1.75218 -144.84590 340.21382
330.0000 -147.29839 -144.91177 2.38663 1.78029 -144.42474 365.06337
335.0000 -147.16899 -144.24259 2.92640 1.77210 -144.54734 358.40120
340.0000 -147.40479 -144.19920 3.20559 1.81474 -143.90857 400.10523
345.0000 -147.10205 -144.33551 2.76654 1.77535 -144.49864 359.08175
350.0000 -147.27662 -144.15910 3.11752 1.80153 -144.10642 385.98515
355.0000 -147.25074 -144.56563 2.68511 1.79260 -144.24019 379.36859
360.0000 -147.44100 -144.77168 2.66932 1.75819 -144.75577 347.37270
365.0000 -147.06032 -144.66757 2.39275 1.77217 -144.54634 359.86528
370.0000 -146.90140 -144.59862 2.30278 1.75662 -144.77936 342.32793
375.0000 -146.78019 -143.98109 2.79909 1.79538 -144.19853 384.95508
380.0000 -146.66783 -143.95620 2.71163 1.82064 -143.82007 405.76998
385.0000 -146.98737 -144.48204 2.50532 1.80432 -144.06458 390.14616
390.0000 -147.47529 -145.24857 2.22673 1.75144 -144.85691 338.16982
395.0000 -147.35330 -144.36990 2.98340 1.73886 -145.04550 329.65258
400.0000 -147.21960 -143.99045 3.22916 1.79515 -144.20204 375.19705
405.0000 -147.11131 -144.66542 2.44589 1.79005 -144.27839 374.68088
410.0000 -147.37655 -143.96902 3.40752 1.78994 -144.28016 376.00071
415.0000 -147.29347 -144.66414 2.62933 1.78647 -144.33205 373.35624
420.0000 -147.15646 -144.12497 3.03149 1.80710 -144.02305 394.72047
425.0000 -146.97191 -143.78734 3.18457 1.81719 -143.87176 404.52542
430.0000 -147.38880 -144.15027 3.23853 1.81863 -143.85015 400.41412
435.0000 -146.99851 -144.66196 2.33655 1.79634 -144.18425 382.18250
440.0000 -147.38517 -144.32455 3.06061 1.79028 -144.27501 374.15844
445.0000 -147.16097 -144.70608 2.45489 1.77032 -144.57412 358.41210
450.0000 -147.11548 -144.61369 2.50180 1.76575 -144.64256 351.40215
455.0000 -147.40410 -144.20229 3.20181 1.79401 -144.21918 379.84792
460.0000 -147.47990 -144.87773 2.60216 1.77301 -144.53384 368.79887
465.0000 -147.59482 -144.76538 2.82943 1.76696 -144.62438 349.79232
470.0000 -146.71844 -143.90177 2.81668 1.78038 -144.42327 368.90392
475.0000 -146.64554 -143.71949 2.92604 1.82950 -143.68732 408.78238
480.0000 -147.13957 -144.06864 3.07093 1.79341 -144.22815 379.60156
485.0000 -147.13362 -144.14201 2.99160 1.79590 -144.19076 379.41628
490.0000 -147.21104 -144.28920 2.92184 1.79748 -144.16709 379.67516
495.0000 -147.36279 -144.61868 2.74410 1.79903 -144.14385 386.37723
500.0000 -147.40801 -144.50295 2.90507 1.76320 -144.68071 352.50807
MELTING PROCESS: loop number 3 T-loop= 390.00000000000000
main_MD> interactions number 3 at Temperature= 390.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -2.41498 2.08510 1.18666
force_rgl> df(natom) -0.90054 1.76645 1.12308
505.0000 -147.04186 -144.02678 3.01507 1.79172 -144.25347 374.63616
510.0000 -147.35642 -144.32099 3.03543 1.79073 -144.26829 376.10137
515.0000 -146.78637 -144.12134 2.66503 1.79964 -144.13479 384.13326
520.0000 -146.88410 -143.95244 2.93166 1.80699 -144.02466 393.37837
525.0000 -147.20476 -144.46883 2.73593 1.81163 -143.95509 398.44821
530.0000 -147.41167 -144.27789 3.13378 1.78075 -144.41773 363.43382
535.0000 -146.94638 -144.15701 2.78936 1.79459 -144.21038 377.30196
540.0000 -146.80426 -143.75108 3.05319 1.82811 -143.70811 410.55558
545.0000 -146.99234 -144.10089 2.89145 1.81528 -143.90046 395.80985
550.0000 -147.11098 -144.51650 2.59448 1.79260 -144.24030 377.81340
555.0000 -147.05904 -144.24955 2.80949 1.76694 -144.62478 355.19671
560.0000 -146.78563 -143.56708 3.21855 1.80594 -144.04039 391.81160
565.0000 -146.53584 -143.39573 3.14012 1.84933 -143.39025 435.92774
570.0000 -146.09998 -143.02756 3.07242 1.85329 -143.33083 433.51362
575.0000 -147.11586 -143.57929 3.53657 1.83539 -143.59903 416.85832
580.0000 -146.52353 -143.63062 2.89291 1.81167 -143.95447 396.86927
585.0000 -146.24747 -143.61825 2.62922 1.85629 -143.28596 410.67757
590.0000 -146.55173 -143.64610 2.90563 1.82313 -143.78278 375.95896
595.0000 -145.71485 -142.91753 2.79732 1.84003 -143.52956 378.23879
600.0000 -145.64279 -142.67474 2.96806 1.87935 -142.94038 411.56429
605.0000 -145.98090 -143.33501 2.64589 1.87445 -143.01382 411.47555
610.0000 -146.87358 -143.78048 3.09310 1.83955 -143.53679 384.31677
615.0000 -145.82760 -142.89548 2.93212 1.87353 -143.02768 406.59671
620.0000 -146.76428 -144.19288 2.57140 1.83912 -143.54322 395.70139
625.0000 -146.41227 -143.90566 2.50661 1.81254 -143.94147 376.78139
630.0000 -146.57365 -143.81804 2.75561 1.80690 -144.02592 359.78538
635.0000 -146.79486 -143.91049 2.88438 1.80574 -144.04332 372.22803
640.0000 -146.47631 -143.91362 2.56269 1.81902 -143.84444 384.99588
645.0000 -146.02145 -143.57626 2.44519 1.83532 -143.60010 401.12812
650.0000 -146.74033 -143.63314 3.10719 1.82775 -143.71352 394.10007
655.0000 -147.12922 -144.25175 2.87747 1.79115 -144.26191 358.60409
660.0000 -146.90480 -144.50457 2.40023 1.81302 -143.93434 382.91335
665.0000 -147.28984 -144.27385 3.01599 1.76646 -144.63197 339.71141
670.0000 -146.74460 -144.03500 2.70960 1.80949 -143.98717 376.21078
675.0000 -147.23114 -144.15101 3.08013 1.83507 -143.60383 398.03049
680.0000 -146.27314 -143.79234 2.48079 1.81488 -143.90646 379.35542
685.0000 -146.51900 -143.85579 2.66321 1.80610 -144.03795 369.13605
690.0000 -146.70803 -143.70121 3.00682 1.80500 -144.05449 351.55731
695.0000 -146.04585 -142.88183 3.16403 1.84039 -143.52419 392.24897
700.0000 -146.95515 -143.80583 3.14932 1.85130 -143.36067 397.73567
705.0000 -146.40591 -143.37248 3.03343 1.82020 -143.82674 372.86260
710.0000 -147.02191 -143.56805 3.45387 1.82973 -143.68394 375.84911
715.0000 -146.63615 -143.76980 2.86636 1.85147 -143.35814 421.52713
720.0000 -147.04406 -143.92800 3.11606 1.81831 -143.85501 399.13508
725.0000 -146.90370 -143.61733 3.28637 1.84620 -143.43714 429.12887
730.0000 -146.97883 -144.20999 2.76884 1.81740 -143.86858 400.75651
735.0000 -146.51767 -143.81232 2.70535 1.80957 -143.98591 397.17000
740.0000 -146.77789 -143.98451 2.79338 1.82131 -143.81009 404.87625
745.0000 -147.43182 -144.53810 2.89372 1.80297 -144.08491 388.93096
750.0000 -146.36065 -143.77825 2.58241 1.78304 -144.38355 364.80517
MELTING PROCESS: loop number 4 T-loop= 415.00000000000000
main_MD> interactions number 4 at Temperature= 415.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.21882 -0.62462 3.36248
force_rgl> df(natom) 0.09530 -3.34974 -1.98178
755.0000 -146.69113 -143.23820 3.45293 1.86513 -143.15352 438.22158
760.0000 -146.59614 -143.47771 3.11843 1.84094 -143.51592 426.41433
765.0000 -146.62543 -143.53717 3.08826 1.85697 -143.27570 431.30566
770.0000 -146.67669 -142.99467 3.68202 1.87341 -143.02945 450.82178
775.0000 -147.19041 -143.67569 3.51472 1.85354 -143.32717 432.56203
780.0000 -146.06575 -142.51266 3.55309 1.88054 -142.92258 453.15254
785.0000 -146.10684 -143.00835 3.09848 1.90644 -142.53452 478.98260
790.0000 -146.99587 -144.17177 2.82410 1.84101 -143.51493 406.22948
795.0000 -146.39398 -143.13483 3.25915 1.83923 -143.54154 403.95229
800.0000 -146.73327 -143.69112 3.04215 1.85174 -143.35414 416.40218
805.0000 -146.95684 -144.07888 2.87796 1.82886 -143.69692 394.57060
810.0000 -146.91566 -144.04250 2.87315 1.80159 -144.10552 370.79852
815.0000 -146.43978 -143.37585 3.06393 1.80328 -144.08024 365.00523
820.0000 -145.30542 -142.71333 2.59209 1.87738 -142.96987 428.85584
825.0000 -145.85492 -142.72515 3.12977 1.89225 -142.74717 440.37588
830.0000 -146.29066 -142.76125 3.52940 1.88922 -142.79245 449.54242
835.0000 -145.86712 -142.20856 3.65855 1.90637 -142.53561 463.55840
840.0000 -145.83840 -142.78523 3.05317 1.88984 -142.78328 439.72803
845.0000 -146.28798 -142.96703 3.32095 1.91351 -142.42852 469.16459
850.0000 -146.45956 -143.65786 2.80170 1.86334 -143.18034 424.32184
855.0000 -146.74658 -144.12046 2.62612 1.81047 -143.97246 369.58926
860.0000 -146.92699 -143.62609 3.30090 1.82789 -143.71142 393.35480
865.0000 -146.61220 -143.69433 2.91786 1.84058 -143.52133 422.02477
870.0000 -147.26225 -144.38853 2.87372 1.79464 -144.20974 378.40030
875.0000 -146.61657 -143.88439 2.73218 1.83815 -143.55775 423.26665
880.0000 -146.77373 -143.71909 3.05464 1.83711 -143.57327 422.11189
885.0000 -146.50300 -143.89662 2.60638 1.83212 -143.64812 415.73335
890.0000 -147.36221 -144.01321 3.34900 1.82447 -143.76273 406.35281
895.0000 -147.22909 -143.92814 3.30096 1.80150 -144.10694 382.02115
900.0000 -146.37755 -143.00352 3.37403 1.83549 -143.59765 420.11461
905.0000 -146.36095 -143.24833 3.11262 1.87065 -143.07082 446.80078
910.0000 -147.04553 -142.93304 4.11249 1.87285 -143.03783 454.41625
915.0000 -146.11811 -143.26030 2.85781 1.86557 -143.14686 447.37734
920.0000 -147.19212 -143.88642 3.30570 1.83463 -143.61043 416.45572
925.0000 -146.73066 -143.97227 2.75840 1.85962 -143.23601 436.24902
930.0000 -147.64689 -144.09909 3.54780 1.81850 -143.85216 401.76538
935.0000 -147.06959 -144.08468 2.98490 1.81464 -143.91007 396.94901
940.0000 -146.74114 -143.62729 3.11386 1.81913 -143.84279 396.68915
945.0000 -146.62401 -143.77918 2.84483 1.83564 -143.59533 413.50558
950.0000 -146.39896 -143.13516 3.26380 1.83887 -143.54693 417.94566
955.0000 -146.99329 -144.31022 2.68307 1.83824 -143.55641 419.50638
960.0000 -146.96058 -143.70127 3.25931 1.80326 -144.08045 388.11873
965.0000 -146.94481 -144.08542 2.85940 1.83274 -143.63873 417.47242
970.0000 -147.26559 -143.74112 3.52447 1.79901 -144.14421 390.98846
975.0000 -146.70458 -143.52034 3.18424 1.84458 -143.46132 429.12553
980.0000 -145.95820 -142.85799 3.10021 1.85913 -143.24344 432.82725
985.0000 -146.91978 -143.22801 3.69177 1.86769 -143.11506 441.84276
990.0000 -146.89354 -143.79616 3.09738 1.84264 -143.49046 422.67591
995.0000 -146.78103 -143.70177 3.07926 1.83073 -143.66898 416.35663
1000.0000 -146.95106 -143.79247 3.15859 1.81838 -143.85390 405.01637
MELTING PROCESS: loop number 5 T-loop= 440.00000000000000
main_MD> interactions number 5 at Temperature= 440.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.74766 4.61998 -3.03661
force_rgl> df(natom) -2.75814 0.13394 -0.93138
1005.0000 -146.38609 -143.16165 3.22444 1.86478 -143.15866 445.14985
1010.0000 -145.87840 -142.26340 3.61500 1.88445 -142.86406 460.67671
1015.0000 -146.92214 -143.20751 3.71463 1.88149 -142.90835 462.58854
1020.0000 -145.74740 -142.56156 3.18584 1.88138 -142.91003 464.99622
1025.0000 -145.47116 -142.18718 3.28398 1.90173 -142.60509 471.89546
1030.0000 -146.11005 -142.83243 3.27762 1.91326 -142.43226 480.86082
1035.0000 -146.38919 -142.99691 3.39229 1.87749 -142.96834 457.57932
1040.0000 -146.31005 -142.83983 3.47023 1.87637 -142.98510 458.37628
1045.0000 -146.11664 -142.73016 3.38648 1.89056 -142.77238 470.09172
1050.0000 -146.89725 -143.37607 3.52119 1.85934 -143.24020 436.49093
1055.0000 -146.63776 -144.01326 2.62450 1.81655 -143.88144 404.72218
1060.0000 -147.07061 -143.67224 3.39837 1.82053 -143.82171 404.87979
1065.0000 -146.93753 -143.83380 3.10374 1.82002 -143.82934 401.04241
1070.0000 -146.86614 -142.89182 3.97432 1.85259 -143.34135 430.53897
1075.0000 -146.28991 -143.38830 2.90161 1.86063 -143.22087 443.19725
1080.0000 -146.04324 -143.17889 2.86435 1.86327 -143.18134 441.80418
1085.0000 -146.25128 -143.27264 2.97864 1.85488 -143.30703 434.68100
1090.0000 -147.04287 -144.03832 3.00454 1.81918 -143.84202 403.16719
1095.0000 -146.15462 -143.27724 2.87738 1.83195 -143.65065 411.63881
1100.0000 -146.22942 -143.15060 3.07881 1.86766 -143.11564 440.46840
1105.0000 -145.61807 -141.97612 3.64196 1.89255 -142.74267 461.66864
1110.0000 -145.97410 -142.56696 3.40715 1.91046 -142.47425 484.52656
1115.0000 -146.92321 -143.65099 3.27222 1.86859 -143.10161 446.35643
1120.0000 -146.26587 -142.84430 3.42157 1.84752 -143.41740 431.88867
1125.0000 -146.55271 -143.21029 3.34242 1.87402 -143.02034 452.14690
1130.0000 -147.01416 -143.50498 3.50918 1.83610 -143.58843 411.79779
1135.0000 -147.01669 -144.22551 2.79118 1.82172 -143.80392 403.57789
1140.0000 -146.02887 -142.41580 3.61308 1.87016 -143.07804 447.23927
1145.0000 -146.24384 -143.04218 3.20166 1.89154 -142.75769 471.48662
1150.0000 -146.27027 -142.99684 3.27343 1.87123 -143.06208 451.38718
1155.0000 -146.40033 -143.38324 3.01710 1.85530 -143.30071 435.24824
1160.0000 -145.54645 -142.50829 3.03817 1.86634 -143.13537 444.94518
1165.0000 -146.62834 -143.17170 3.45664 1.88260 -142.89177 459.57851
1170.0000 -147.31572 -143.60782 3.70789 1.83713 -143.57308 420.33282
1175.0000 -147.25399 -143.63068 3.62331 1.83662 -143.58060 419.81379
1180.0000 -146.60519 -143.52501 3.08019 1.84246 -143.49318 421.15960
1185.0000 -146.92710 -143.72396 3.20314 1.83299 -143.63500 413.47498
1190.0000 -147.33588 -143.70856 3.62732 1.84607 -143.43907 426.95175
1195.0000 -146.72593 -143.72213 3.00380 1.82210 -143.79821 403.51408
1200.0000 -146.51611 -142.96963 3.54647 1.86008 -143.22914 437.24238
1205.0000 -146.46856 -143.15940 3.30916 1.85583 -143.29288 432.16132
1210.0000 -146.19610 -142.83539 3.36070 1.85973 -143.23435 438.56407
1215.0000 -146.87762 -143.07669 3.80093 1.87647 -142.98361 452.92617
1220.0000 -146.75101 -143.49437 3.25664 1.88078 -142.91900 458.76704
1225.0000 -146.67343 -143.24680 3.42663 1.85467 -143.31014 432.87353
1230.0000 -146.73370 -143.88523 2.84847 1.84181 -143.50288 418.92196
1235.0000 -146.88591 -144.05015 2.83575 1.81147 -143.95755 388.46305
1240.0000 -146.41367 -143.07722 3.33645 1.85377 -143.32363 428.98804
1245.0000 -146.65105 -143.30382 3.34723 1.87193 -143.05164 452.35347
1250.0000 -146.98162 -143.75660 3.22503 1.83407 -143.61893 415.83015
MELTING PROCESS: loop number 6 T-loop= 465.00000000000000
main_MD> interactions number 6 at Temperature= 465.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -6.03810 -0.76793 -0.37521
force_rgl> df(natom) -1.03877 -1.36601 -1.59093
1255.0000 -146.77924 -143.65823 3.12101 1.84310 -143.48358 421.12184
1260.0000 -146.58908 -143.39234 3.19674 1.84879 -143.39834 426.90171
1265.0000 -146.96593 -143.23314 3.73279 1.85336 -143.32983 433.00419
1270.0000 -146.22462 -142.64705 3.57757 1.84882 -143.39783 428.89556
1275.0000 -146.81015 -143.27836 3.53179 1.88623 -142.83739 458.31518
1280.0000 -146.52637 -143.91945 2.60692 1.85574 -143.29410 438.31834
1285.0000 -146.87627 -143.66697 3.20930 1.82720 -143.72174 409.78972
1290.0000 -147.00682 -143.70688 3.29993 1.84004 -143.52944 421.87138
1295.0000 -146.60880 -142.97901 3.62979 1.86189 -143.20205 446.42009
1300.0000 -146.87739 -143.64841 3.22898 1.87101 -143.06543 446.50194
1305.0000 -146.00939 -142.53738 3.47201 1.87203 -143.05010 453.48635
1310.0000 -146.69360 -143.18350 3.51010 1.87401 -143.02040 455.44898
1315.0000 -147.16915 -143.70977 3.45938 1.84413 -143.46820 430.26488
1320.0000 -146.93293 -143.92884 3.00409 1.82381 -143.77257 409.25193
1325.0000 -145.54923 -141.78947 3.75976 1.87779 -142.96375 448.65602
1330.0000 -145.64459 -141.69848 3.94611 1.93900 -142.04665 489.51189
1335.0000 -145.66097 -141.20797 4.45300 1.96851 -141.60439 519.70898
1340.0000 -145.38282 -141.67371 3.70911 1.97011 -141.58042 504.81980
1345.0000 -145.11162 -141.95678 3.15484 1.93353 -142.12859 469.47687
1350.0000 -145.88394 -142.06490 3.81904 1.94017 -142.02903 471.70110
1355.0000 -145.08946 -141.70016 3.38931 1.95372 -141.82601 480.33157
1360.0000 -145.48616 -142.14570 3.34046 1.97010 -141.58068 485.31255
1365.0000 -144.91379 -141.55339 3.36041 1.93014 -142.17946 460.91179
1370.0000 -146.20263 -142.99783 3.20480 1.92574 -142.24533 466.49716
1375.0000 -145.90104 -142.78310 3.11794 1.87496 -143.00622 429.48484
1380.0000 -146.46175 -143.32514 3.13660 1.87188 -143.05240 429.59205
1385.0000 -145.96394 -142.56424 3.39970 1.87504 -143.00492 413.75740
1390.0000 -145.11272 -141.73869 3.37403 1.96188 -141.70378 489.99052
1395.0000 -145.77251 -142.19401 3.57850 1.94664 -141.93223 478.81714
1400.0000 -146.11439 -142.69134 3.42305 1.91508 -142.40508 465.69103
1405.0000 -146.00301 -142.51643 3.48658 1.90558 -142.54733 453.15242
1410.0000 -145.83358 -142.12803 3.70556 1.91986 -142.33337 469.38824
1415.0000 -144.44233 -140.29854 4.14379 2.00309 -141.08640 523.20452
1420.0000 -145.34428 -141.95330 3.39098 2.00507 -141.05669 505.10497
1425.0000 -145.41444 -142.24247 3.17197 1.93600 -142.09153 463.85766
1430.0000 -145.38726 -141.72032 3.66693 1.93879 -142.04973 466.19951
1435.0000 -145.06722 -141.15544 3.91177 1.97077 -141.57057 509.30834
1440.0000 -145.09520 -140.93743 4.15777 1.98918 -141.29474 536.68604
1445.0000 -145.19723 -141.61053 3.58670 1.98771 -141.31682 522.86087
1450.0000 -145.67420 -141.77555 3.89865 1.94520 -141.95372 465.59004
1455.0000 -145.42331 -142.36158 3.06173 1.90265 -142.59134 430.07264
1460.0000 -144.95508 -141.71234 3.24274 1.92944 -142.18983 456.24039
1465.0000 -145.70212 -142.69206 3.01006 1.93643 -142.08521 478.37082
1470.0000 -146.42649 -142.96666 3.45983 1.90603 -142.54061 456.17834
1475.0000 -146.06767 -141.96296 4.10471 1.95918 -141.74432 504.20413
1480.0000 -145.97514 -142.47202 3.50312 1.90189 -142.60268 452.91813
1485.0000 -145.86930 -142.37908 3.49022 1.88911 -142.79413 447.12437
1490.0000 -146.60289 -142.90174 3.70115 1.93658 -142.08285 483.34338
1495.0000 -145.76064 -142.48569 3.27495 1.89077 -142.76926 441.22780
1500.0000 -145.72947 -142.46933 3.26014 1.92292 -142.28760 473.77026
MELTING PROCESS: loop number 7 T-loop= 490.00000000000000
main_MD> interactions number 7 at Temperature= 490.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.48817 3.56049 -4.66615
force_rgl> df(natom) -1.83416 1.15610 -1.81671
1505.0000 -146.08598 -142.69011 3.39586 1.90069 -142.62067 456.86771
1510.0000 -145.90002 -142.22299 3.67703 1.91487 -142.40823 468.61176
1515.0000 -145.88460 -142.82454 3.06007 1.91457 -142.41266 462.77487
1520.0000 -146.27718 -143.06722 3.20996 1.87938 -142.93995 435.75684
1525.0000 -145.45805 -142.14320 3.31485 1.92834 -142.20636 462.59818
1530.0000 -144.71779 -141.33668 3.38111 1.97404 -141.52160 496.38865
1535.0000 -145.17514 -141.84365 3.33149 1.98002 -141.43197 496.04377
1540.0000 -145.23225 -141.76626 3.46599 1.94354 -141.97866 473.06820
1545.0000 -146.37802 -142.28694 4.09109 1.91643 -142.38487 468.47491
1550.0000 -145.80055 -141.39531 4.40525 1.94056 -142.02327 489.31718
1555.0000 -145.30371 -141.71889 3.58481 1.96916 -141.59479 503.53397
1560.0000 -145.91010 -141.69457 4.21552 1.97569 -141.49696 517.19306
1565.0000 -145.48430 -142.01002 3.47428 1.95023 -141.87838 482.36882
1570.0000 -145.58337 -142.68293 2.90044 1.95992 -141.73318 504.26305
1575.0000 -145.33261 -141.83676 3.49585 1.94184 -142.00413 481.29930
1580.0000 -144.89467 -141.06367 3.83099 1.98851 -141.30475 512.57046
1585.0000 -145.89961 -141.34277 4.55684 1.99931 -141.14302 527.70751
1590.0000 -144.78467 -141.08160 3.70306 1.98270 -141.39186 493.42216
1595.0000 -145.97500 -141.63995 4.33505 1.99982 -141.13533 521.37847
1600.0000 -145.72757 -142.46807 3.25949 1.93370 -142.12606 480.81774
1605.0000 -145.11026 -141.65864 3.45162 1.92694 -142.22741 447.40526
1610.0000 -145.17170 -140.62512 4.54658 1.99667 -141.18249 523.19825
1615.0000 -145.42171 -141.58142 3.84029 1.98988 -141.28432 505.47966
1620.0000 -145.01911 -141.18777 3.83134 2.02099 -140.81807 516.84859
1625.0000 -145.13562 -141.66225 3.47336 1.96795 -141.61291 462.78861
1630.0000 -144.99914 -141.65529 3.34384 1.94680 -141.92971 447.19008
1635.0000 -145.09455 -141.33784 3.75671 1.99489 -141.20918 460.69503
1640.0000 -144.56805 -141.18618 3.38188 2.00023 -141.12915 457.19124
1645.0000 -144.59579 -140.51491 4.08087 2.02579 -140.74625 487.94901
1650.0000 -144.21117 -140.63100 3.58017 2.04825 -140.40974 492.12228
1655.0000 -143.61124 -140.47527 3.13597 2.04342 -140.48198 465.73507
1660.0000 -143.53772 -139.78094 3.75678 2.07990 -139.93537 506.73553
1665.0000 -142.99895 -139.25498 3.74397 2.09283 -139.74163 536.48714
1670.0000 -144.21530 -139.82964 4.38566 2.09349 -139.73188 554.66221
1675.0000 -144.47828 -141.01030 3.46798 2.03161 -140.65894 495.72690
1680.0000 -143.61047 -140.55680 3.05366 2.03631 -140.58857 495.09417
1685.0000 -144.36522 -140.37499 3.99023 2.03271 -140.64256 506.20321
1690.0000 -143.58512 -140.17635 3.40877 2.05083 -140.37107 518.11380
1695.0000 -144.28513 -139.99412 4.29101 2.09084 -139.77152 541.14350
1700.0000 -144.88885 -141.35477 3.53408 2.02157 -140.80948 483.13186
1705.0000 -143.94804 -140.24474 3.70331 2.06157 -140.21004 511.59517
1710.0000 -143.46900 -139.18259 4.28641 2.07241 -140.04771 520.98449
1715.0000 -144.72514 -141.24222 3.48292 2.06954 -140.09064 525.44761
1720.0000 -144.51659 -140.76369 3.75291 2.01379 -140.92594 494.85388
1725.0000 -144.75126 -140.82769 3.92358 2.02718 -140.72534 519.53952
1730.0000 -144.46440 -140.74231 3.72209 2.03198 -140.65352 527.86530
1735.0000 -145.20509 -141.21660 3.98849 2.01410 -140.92140 526.22715
1740.0000 -145.48022 -141.11303 4.36719 2.00869 -141.00238 520.70057
1745.0000 -145.07168 -141.15178 3.91990 1.99928 -141.14335 508.71243
1750.0000 -144.93629 -141.06911 3.86718 2.00276 -141.09125 520.93159
MELTING PROCESS: loop number 8 T-loop= 515.00000000000000
main_MD> interactions number 8 at Temperature= 515.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.50764 0.02272 0.38141
force_rgl> df(natom) 0.45660 1.36752 0.78106
1755.0000 -144.66696 -141.06658 3.60038 2.02426 -140.76910 524.77782
1760.0000 -144.42964 -140.29781 4.13183 2.01282 -140.94053 511.41075
1765.0000 -144.52715 -140.65491 3.87224 2.04642 -140.43704 516.97071
1770.0000 -144.59866 -140.51577 4.08289 2.03238 -140.64753 518.73252
1775.0000 -145.02474 -140.59528 4.42946 2.00264 -141.09305 496.55430
1780.0000 -145.23238 -140.76240 4.46999 2.04220 -140.50031 536.66687
1785.0000 -144.44147 -141.47989 2.96159 1.98439 -141.36656 503.73189
1790.0000 -143.88745 -140.62564 3.26180 1.99649 -141.18517 483.95339
1795.0000 -144.99602 -141.49061 3.50541 2.01447 -140.91580 518.04193
1800.0000 -144.49450 -140.81870 3.67580 1.99716 -141.17521 505.21651
1805.0000 -145.17482 -141.06124 4.11358 2.00409 -141.07139 518.42881
1810.0000 -145.39909 -141.48926 3.90982 1.99183 -141.25505 509.05139
1815.0000 -144.59753 -141.18343 3.41410 1.97233 -141.54719 483.10195
1820.0000 -145.21153 -141.78039 3.43114 1.99526 -141.20365 502.67300
1825.0000 -144.76849 -140.70015 4.06834 2.00158 -141.10889 532.29464
1830.0000 -144.47010 -140.94887 3.52122 2.00822 -141.00941 533.47508
1835.0000 -145.00774 -141.36376 3.64399 2.02056 -140.82462 544.52985
1840.0000 -144.89941 -141.10121 3.79820 1.99418 -141.21978 497.36030
1845.0000 -144.87886 -141.56270 3.31615 2.01799 -140.86313 523.85570
1850.0000 -145.05930 -140.88148 4.17782 2.00794 -141.01360 532.08419
1855.0000 -144.31065 -139.94818 4.36247 2.04245 -140.49662 574.43001
1860.0000 -144.38338 -140.90798 3.47540 2.04268 -140.49308 543.38258
1865.0000 -145.50105 -140.85387 4.64717 2.01554 -140.89977 524.06977
1870.0000 -144.34699 -140.59546 3.75154 2.00116 -141.11528 510.23693
1875.0000 -145.03406 -141.06485 3.96921 2.03987 -140.53519 535.07604
1880.0000 -144.65724 -140.20371 4.45353 2.03034 -140.67796 529.10307
1885.0000 -144.26972 -140.13004 4.13968 2.09111 -139.76752 552.90313
1890.0000 -143.77001 -140.79838 2.97163 2.03701 -140.57815 508.41258
1895.0000 -143.44360 -139.05090 4.39270 2.10391 -139.57573 558.62070
1900.0000 -143.55957 -139.63159 3.92798 2.09567 -139.69911 538.20291
1905.0000 -143.67387 -139.78915 3.88472 2.10415 -139.57208 550.82506
1910.0000 -144.15136 -140.18847 3.96290 2.10477 -139.56275 554.29922
1915.0000 -143.97302 -140.12064 3.85237 2.08027 -139.92996 536.48266
1920.0000 -144.37742 -140.32415 4.05327 2.04179 -140.50646 520.07548
1925.0000 -143.90701 -139.60511 4.30190 2.08609 -139.84262 562.59785
1930.0000 -144.48693 -140.33257 4.15436 2.06483 -140.16126 539.92037
1935.0000 -145.32813 -142.11255 3.21559 2.00185 -141.10484 489.77766
1940.0000 -144.45368 -141.21913 3.23455 1.96677 -141.63051 467.58687
1945.0000 -144.90011 -141.19214 3.70797 2.00199 -141.10275 492.76803
1950.0000 -143.93710 -140.58412 3.35298 2.03107 -140.66701 525.54911
1955.0000 -143.46168 -139.76096 3.70072 2.08149 -139.91154 535.42772
1960.0000 -143.95597 -139.56901 4.38696 2.09781 -139.66703 560.39605
1965.0000 -143.70338 -139.70030 4.00308 2.10649 -139.53696 566.28534
1970.0000 -144.19036 -140.26952 3.92084 2.07956 -139.94051 573.63377
1975.0000 -144.97611 -140.80693 4.16917 2.07066 -140.07387 544.44931
1980.0000 -144.34310 -140.17617 4.16693 2.05832 -140.25874 535.28165
1985.0000 -144.25403 -141.36480 2.88924 2.04027 -140.52922 552.61125
1990.0000 -144.13736 -140.50126 3.63610 2.02665 -140.73335 535.04434
1995.0000 -145.05578 -142.04180 3.01399 1.99520 -141.20457 506.78420
2000.0000 -145.16655 -141.95234 3.21422 1.95638 -141.78619 478.88892
MELTING PROCESS: loop number 9 T-loop= 540.00000000000000
main_MD> interactions number 9 at Temperature= 540.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.04415 2.51563 -0.94691
force_rgl> df(natom) -0.23451 -1.39222 -3.35368
2005.0000 -144.82346 -140.51559 4.30787 1.97934 -141.44226 489.99852
2010.0000 -143.92232 -139.50151 4.42081 2.06765 -140.11903 570.73499
2015.0000 -145.50102 -140.97634 4.52468 2.03605 -140.59244 553.93029
2020.0000 -145.46269 -141.16392 4.29877 2.02935 -140.69282 567.37734
2025.0000 -145.96052 -142.19634 3.76418 1.96471 -141.66146 503.33733
2030.0000 -145.20271 -141.39726 3.80544 1.95975 -141.73571 503.66350
2035.0000 -146.16440 -142.09636 4.06803 1.95652 -141.78413 498.35565
2040.0000 -144.00275 -140.65918 3.34357 2.00382 -141.07540 532.50472
2045.0000 -144.73104 -139.59537 5.13567 2.05326 -140.33453 585.24966
2050.0000 -144.55635 -140.19181 4.36454 2.09959 -139.64042 609.49210
2055.0000 -143.87542 -140.43114 3.44428 2.04657 -140.43483 557.65960
2060.0000 -144.50509 -140.43839 4.06670 2.05152 -140.36063 556.98909
2065.0000 -145.39248 -141.30440 4.08808 2.00509 -141.05632 539.97845
2070.0000 -144.76346 -140.89750 3.86596 2.02925 -140.69431 552.07729
2075.0000 -145.20246 -140.44781 4.75464 2.05574 -140.29749 583.80606
2080.0000 -144.66314 -139.92491 4.73823 2.07101 -140.06857 591.55079
2085.0000 -144.72380 -139.32878 5.39503 2.12127 -139.31555 636.95991
2090.0000 -144.48520 -140.73515 3.75005 2.06729 -140.12432 568.76346
2095.0000 -144.85869 -140.85539 4.00329 2.02762 -140.71880 540.08390
2100.0000 -145.66933 -142.32257 3.34676 1.96843 -141.60564 504.04450
2105.0000 -144.33909 -140.76287 3.57622 1.98277 -141.39081 515.56919
2110.0000 -145.20317 -141.56259 3.64058 1.99225 -141.24871 513.74679
2115.0000 -144.94433 -140.68743 4.25690 2.01800 -140.86296 547.48286
2120.0000 -145.59631 -141.24873 4.34758 2.03147 -140.66103 559.91611
2125.0000 -145.34485 -141.77168 3.57317 1.99360 -141.22852 518.65454
2130.0000 -145.68523 -141.44096 4.24427 1.95083 -141.86932 486.10805
2135.0000 -145.78435 -141.93618 3.84817 1.98109 -141.41592 519.23741
2140.0000 -144.97855 -141.08664 3.89191 1.95846 -141.75512 509.29335
2145.0000 -145.13568 -141.35282 3.78286 1.99465 -141.21276 535.87959
2150.0000 -145.15790 -140.42437 4.73353 2.03368 -140.62793 528.66768
2155.0000 -144.88690 -141.10440 3.78250 2.03103 -140.66774 559.09542
2160.0000 -144.14785 -140.18444 3.96341 2.02604 -140.74243 538.50136
2165.0000 -144.79808 -140.52864 4.26944 2.07820 -139.96086 560.86218
2170.0000 -145.12145 -141.78910 3.33235 2.02937 -140.69256 546.87464
2175.0000 -144.49353 -140.83142 3.66210 1.99843 -141.15618 519.64086
2180.0000 -143.08662 -140.16158 2.92504 2.06719 -140.12595 560.98681
2185.0000 -144.82451 -141.28844 3.53607 2.05460 -140.31458 546.28487
2190.0000 -144.78271 -141.27807 3.50464 2.01212 -140.95109 506.51966
2195.0000 -144.25142 -140.05617 4.19525 2.05764 -140.26892 528.36665
2200.0000 -144.33132 -140.01116 4.32015 2.06919 -140.09594 540.76978
2205.0000 -145.28598 -141.19482 4.09115 2.04875 -140.40224 555.39904
2210.0000 -145.66070 -141.53618 4.12452 1.95547 -141.79984 470.08462
2215.0000 -144.90406 -140.99331 3.91074 1.99923 -141.14418 524.37148
2220.0000 -144.85005 -141.44191 3.40814 1.99721 -141.17437 509.78071
2225.0000 -144.70793 -141.72961 2.97833 1.98305 -141.38656 491.07504
2230.0000 -144.71220 -140.58918 4.12302 1.96475 -141.66077 482.86005
2235.0000 -144.25090 -140.23247 4.01844 2.04066 -140.52332 570.63859
2240.0000 -143.15935 -139.09510 4.06425 2.08762 -139.81977 552.85059
2245.0000 -144.51852 -141.11187 3.40665 2.06300 -140.18865 548.98691
2250.0000 -144.90662 -141.17404 3.73259 2.01917 -140.84545 512.94563
MELTING PROCESS: loop number 10 T-loop= 565.00000000000000
main_MD> interactions number 10 at Temperature= 565.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.01532 -1.46202 -1.18546
force_rgl> df(natom) 2.44752 -0.88589 0.00965
2255.0000 -144.43351 -140.56614 3.86738 2.01791 -140.86431 540.40705
2260.0000 -144.58372 -139.73632 4.84740 2.04193 -140.50436 560.73440
2265.0000 -144.56088 -140.07907 4.48181 2.04955 -140.39016 560.77751
2270.0000 -144.20405 -140.17351 4.03054 2.03281 -140.64095 550.82462
2275.0000 -145.20320 -140.24717 4.95604 2.09132 -139.76429 596.86699
2280.0000 -143.99062 -140.04631 3.94431 2.07992 -139.93512 573.85209
2285.0000 -143.06598 -138.83050 4.23548 2.12403 -139.27426 603.91462
2290.0000 -143.60106 -139.27618 4.32487 2.14308 -138.98877 611.95892
2295.0000 -144.27016 -140.23247 4.03769 2.08975 -139.78778 576.11345
2300.0000 -144.08890 -139.48656 4.60234 2.09129 -139.76471 616.72232
2305.0000 -144.21769 -139.54631 4.67138 2.11743 -139.37303 624.60490
2310.0000 -144.55267 -139.78906 4.76361 2.12809 -139.21332 619.55381
2315.0000 -143.30342 -139.59965 3.70377 2.11391 -139.42581 591.11119
2320.0000 -144.00981 -140.01240 3.99740 2.12106 -139.31877 584.14136
2325.0000 -142.74722 -138.15013 4.59709 2.13723 -139.07635 581.75146
2330.0000 -143.56913 -139.29041 4.27872 2.18507 -138.35955 621.57062
2335.0000 -144.14717 -139.73168 4.41549 2.09030 -139.77962 541.55837
2340.0000 -143.32493 -138.93922 4.38570 2.10199 -139.60445 565.01736
2345.0000 -144.39965 -140.66704 3.73260 2.09358 -139.73038 542.11149
2350.0000 -143.91099 -139.89618 4.01481 2.11336 -139.43403 563.75388
2355.0000 -142.81053 -138.30699 4.50354 2.14717 -138.92746 575.02026
2360.0000 -142.55593 -138.26853 4.28740 2.16545 -138.65355 586.97308
2365.0000 -143.25222 -138.33277 4.91946 2.16386 -138.67745 591.79933
2370.0000 -142.94151 -138.57645 4.36506 2.17543 -138.50403 611.15535
2375.0000 -142.55727 -138.08619 4.47108 2.20256 -138.09755 630.33321
2380.0000 -143.72009 -140.13912 3.58097 2.13393 -139.12592 569.65377
2385.0000 -143.03023 -138.50923 4.52099 2.14945 -138.89325 575.37402
2390.0000 -143.43912 -139.32602 4.11310 2.14660 -138.93605 575.17081
2395.0000 -143.26630 -138.31390 4.95241 2.16755 -138.62209 604.70985
2400.0000 -143.55880 -139.91608 3.64273 2.12549 -139.25234 587.59940
2405.0000 -143.36208 -139.03730 4.32478 2.10226 -139.60038 566.73770
2410.0000 -143.74522 -138.97924 4.76598 2.10808 -139.51320 560.27281
2415.0000 -143.95229 -139.29905 4.65324 2.13229 -139.15045 556.78684
2420.0000 -143.36610 -138.59620 4.76990 2.13265 -139.14506 540.51762
2425.0000 -143.46742 -139.72449 3.74293 2.13838 -139.05924 571.23691
2430.0000 -144.00549 -139.85631 4.14918 2.08111 -139.91732 545.69263
2435.0000 -143.60038 -139.40566 4.19472 2.05927 -140.24452 517.30601
2440.0000 -143.97447 -140.36634 3.60813 2.13084 -139.17222 583.18353
2445.0000 -143.62545 -139.45555 4.16990 2.07065 -140.07407 528.98406
2450.0000 -143.70272 -138.95404 4.74868 2.12013 -139.33258 595.85809
2455.0000 -143.63396 -139.58267 4.05129 2.12879 -139.20291 598.39408
2460.0000 -143.69398 -139.28323 4.41075 2.13817 -139.06232 588.18609
2465.0000 -142.89915 -138.63903 4.26012 2.15091 -138.87137 611.56608
2470.0000 -143.20751 -138.47863 4.72888 2.19354 -138.23276 647.59521
2475.0000 -143.21513 -139.24204 3.97309 2.15373 -138.82916 602.03537
2480.0000 -142.91411 -138.31038 4.60374 2.15961 -138.74115 591.67408
2485.0000 -143.20847 -138.73123 4.47725 2.16971 -138.58980 591.08338
2490.0000 -143.60412 -139.26251 4.34161 2.13369 -139.12942 600.12239
2495.0000 -144.50600 -138.91737 5.58863 2.12131 -139.31502 622.07379
2500.0000 -143.65267 -139.51601 4.13665 2.09237 -139.74854 579.13290
MELTING PROCESS: loop number 11 T-loop= 590.00000000000000
main_MD> interactions number 11 at Temperature= 590.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 3.83091 1.00094 1.23848
force_rgl> df(natom) 1.85942 -0.52185 0.14679
2505.0000 -144.34130 -140.47347 3.86783 2.12531 -139.25498 586.46276
2510.0000 -143.44952 -138.87667 4.57284 2.05476 -140.31211 541.35841
2515.0000 -143.97711 -139.66482 4.31230 2.14026 -139.03104 612.05187
2520.0000 -143.15221 -138.37883 4.77337 2.14219 -139.00211 618.51827
2525.0000 -142.90843 -139.11607 3.79236 2.14684 -138.93245 610.83640
2530.0000 -143.74067 -139.52424 4.21643 2.10871 -139.50375 560.94349
2535.0000 -143.83077 -139.91202 3.91875 2.11511 -139.40780 597.33471
2540.0000 -144.80633 -140.44211 4.36422 2.06982 -140.08652 564.87105
2545.0000 -144.00431 -139.41231 4.59200 2.08951 -139.79151 591.56342
2550.0000 -143.68836 -139.20617 4.48218 2.14971 -138.88944 608.71451
2555.0000 -142.74991 -138.12474 4.62517 2.15157 -138.86153 615.27714
2560.0000 -143.52833 -139.15034 4.37800 2.13870 -139.05445 600.10008
2565.0000 -143.42777 -139.31245 4.11532 2.13305 -139.13912 585.89810
2570.0000 -143.75139 -139.70399 4.04740 2.11226 -139.45054 555.28176
2575.0000 -143.93156 -138.40849 5.52307 2.14725 -138.92629 573.91944
2580.0000 -144.12117 -139.29895 4.82222 2.13957 -139.04128 594.80870
2585.0000 -144.12263 -139.07964 5.04298 2.14693 -138.93107 591.61115
2590.0000 -142.85888 -138.78626 4.07262 2.16413 -138.67336 578.32379
2595.0000 -143.53809 -139.03270 4.50539 2.20046 -138.12902 628.52010
2600.0000 -143.67141 -138.35682 5.31459 2.17292 -138.54166 580.07382
2605.0000 -143.72185 -139.03419 4.68766 2.16288 -138.69203 585.11468
2610.0000 -143.89570 -139.29088 4.60482 2.11149 -139.46217 542.75385
2615.0000 -143.08682 -139.20684 3.87998 2.12949 -139.19237 568.33964
2620.0000 -141.96874 -137.23376 4.73498 2.17671 -138.48491 595.83510
2625.0000 -142.17689 -137.16376 5.01313 2.24105 -137.52088 622.59852
2630.0000 -142.93533 -138.08392 4.85141 2.23846 -137.55955 618.44515
2635.0000 -143.82023 -139.01736 4.80287 2.15848 -138.75804 582.48486
2640.0000 -143.46302 -139.04366 4.41936 2.14963 -138.89060 607.77074
2645.0000 -143.58249 -138.61775 4.96474 2.14992 -138.88632 606.82446
2650.0000 -143.46160 -138.11316 5.34843 2.13930 -139.04544 569.50665
2655.0000 -142.26356 -137.44371 4.81985 2.21841 -137.86009 631.28856
2660.0000 -142.43951 -138.25902 4.18049 2.23642 -137.59015 661.38628
2665.0000 -143.28605 -138.68851 4.59753 2.17558 -138.50184 591.33147
2670.0000 -143.45897 -138.70010 4.75887 2.17005 -138.58465 601.23212
2675.0000 -143.76531 -139.12544 4.63987 2.17007 -138.58436 645.49953
2680.0000 -143.50899 -137.38346 6.12554 2.17444 -138.51892 630.45068
2685.0000 -143.11068 -138.37897 4.73171 2.21338 -137.93536 668.27587
2690.0000 -142.62053 -138.65947 3.96106 2.17877 -138.45396 607.48113
2695.0000 -143.96791 -140.20730 3.76061 2.10521 -139.55616 545.69893
2700.0000 -143.13623 -138.19814 4.93808 2.13427 -139.12074 601.70774
2705.0000 -143.83250 -139.31387 4.51863 2.18244 -138.39893 630.48023
2710.0000 -144.40497 -139.37015 5.03482 2.10876 -139.50297 571.43751
2715.0000 -143.25312 -138.73447 4.51865 2.13238 -139.14903 540.88201
2720.0000 -143.76458 -139.54695 4.21763 2.13772 -139.06908 601.09729
2725.0000 -143.40167 -139.26594 4.13573 2.13133 -139.16482 569.20770
2730.0000 -142.35426 -138.72780 3.62645 2.13343 -139.13342 550.49137
2735.0000 -142.06573 -137.40033 4.66540 2.22590 -137.74782 653.84293
2740.0000 -144.30717 -139.39527 4.91190 2.16655 -138.63704 616.46884
2745.0000 -144.17031 -140.16342 4.00689 2.09835 -139.65901 575.15968
2750.0000 -144.41836 -138.74630 5.67205 2.15638 -138.78953 624.95162
MELTING PROCESS: loop number 12 T-loop= 615.00000000000000
main_MD> interactions number 12 at Temperature= 615.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.34280 0.01916 3.98947
force_rgl> df(natom) -0.41353 -3.01276 0.25830
2755.0000 -143.95381 -140.38931 3.56450 2.13824 -139.06126 600.09339
2760.0000 -143.66995 -139.14565 4.52430 2.11700 -139.37957 576.21340
2765.0000 -143.04476 -138.68568 4.35907 2.14938 -138.89430 606.41573
2770.0000 -143.25016 -138.13761 5.11255 2.20398 -138.07624 646.80682
2775.0000 -143.65517 -139.35871 4.29646 2.16511 -138.65869 618.35997
2780.0000 -142.32219 -138.62341 3.69878 2.14028 -139.03068 569.11428
2785.0000 -142.86345 -137.70782 5.15563 2.18423 -138.37224 599.96964
2790.0000 -143.28324 -138.34480 4.93844 2.18730 -138.32616 609.31213
2795.0000 -142.79694 -138.20301 4.59393 2.17055 -138.57721 615.02709
2800.0000 -143.37242 -138.13692 5.23550 2.24129 -137.51719 664.13409
2805.0000 -142.83055 -138.25631 4.57424 2.22434 -137.77124 648.23022
2810.0000 -143.19766 -138.77792 4.41973 2.18894 -138.30155 591.85788
2815.0000 -142.53512 -138.72309 3.81202 2.17004 -138.58482 575.82968
2820.0000 -143.48438 -139.84852 3.63586 2.12157 -139.31111 545.05382
2825.0000 -144.74523 -141.02506 3.72017 2.05128 -140.36430 500.61637
2830.0000 -143.55112 -139.13682 4.41430 2.09428 -139.71993 544.47767
2835.0000 -143.98952 -139.18253 4.80699 2.14021 -139.03181 567.14588
2840.0000 -144.21110 -139.91794 4.29316 2.05291 -140.33982 523.79078
2845.0000 -144.37656 -139.76667 4.60989 2.09996 -139.63490 575.32613
2850.0000 -143.13484 -138.14600 4.98884 2.12819 -139.21194 606.16983
2855.0000 -142.27317 -137.44000 4.83317 2.22724 -137.72776 668.05295
2860.0000 -142.74866 -137.51512 5.23354 2.22837 -137.71075 650.84136
2865.0000 -143.82945 -138.06997 5.75948 2.15505 -138.80939 579.24175
2870.0000 -143.41008 -139.46682 3.94326 2.17164 -138.56081 613.73704
2875.0000 -142.92480 -138.24724 4.67756 2.15725 -138.77649 595.32852
2880.0000 -142.56925 -138.78271 3.78654 2.20586 -138.04812 629.31573
2885.0000 -143.77691 -139.07802 4.69890 2.17510 -138.50904 622.11872
2890.0000 -144.61921 -140.06742 4.55179 2.09115 -139.76686 565.59304
2895.0000 -143.24751 -139.38786 3.85965 2.09454 -139.71611 558.54265
2900.0000 -142.31999 -137.98658 4.33341 2.13902 -139.04965 560.08644
2905.0000 -142.68015 -137.98700 4.69316 2.20944 -137.99447 643.63866
2910.0000 -142.06948 -136.95326 5.11622 2.21526 -137.90723 629.70495
2915.0000 -140.73070 -136.26230 4.46840 2.31190 -136.45920 708.18044
2920.0000 -142.32347 -137.67014 4.65333 2.27241 -137.05090 678.51495
2925.0000 -142.77115 -137.46988 5.30126 2.24019 -137.53368 642.99086
2930.0000 -142.42344 -136.39280 6.03064 2.27113 -137.07016 655.88151
2935.0000 -141.93125 -136.06871 5.86255 2.31304 -136.44217 725.44768
2940.0000 -142.00256 -136.02806 5.97450 2.31585 -136.40006 737.89526
2945.0000 -141.64567 -138.00321 3.64246 2.24805 -137.41600 652.25484
2950.0000 -143.04737 -138.04456 5.00280 2.17510 -138.50903 619.50522
2955.0000 -142.37391 -138.35205 4.02185 2.23608 -137.59532 654.47351
2960.0000 -143.89078 -139.30124 4.58954 2.14997 -138.88549 570.09641
2965.0000 -143.53079 -139.83204 3.69876 2.10766 -139.51945 539.71498
2970.0000 -143.65071 -139.17731 4.47339 2.11152 -139.46166 535.97737
2975.0000 -142.81491 -138.78511 4.02980 2.13468 -139.11460 573.89927
2980.0000 -143.99529 -137.53402 6.46127 2.20429 -138.07155 650.84115
2985.0000 -142.27849 -137.60667 4.67182 2.24463 -137.46713 662.90364
2990.0000 -142.84869 -138.05958 4.78911 2.21091 -137.97244 642.13504
2995.0000 -143.17941 -138.50613 4.67329 2.13493 -139.11089 569.58286
3000.0000 -142.89799 -138.90574 3.99225 2.11358 -139.43080 571.13664
MELTING PROCESS: loop number 13 T-loop= 640.00000000000000
main_MD> interactions number 13 at Temperature= 640.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -2.85525 2.98415 -4.80411
force_rgl> df(natom) 0.54314 2.02261 0.02480
3005.0000 -144.50669 -140.04898 4.45771 2.12771 -139.21902 580.43026
3010.0000 -143.03423 -138.99829 4.03593 2.12594 -139.24560 577.93146
3015.0000 -142.73295 -138.03253 4.70043 2.18775 -138.31944 626.79130
3020.0000 -143.44315 -138.97856 4.46459 2.21501 -137.91104 661.08442
3025.0000 -142.52133 -138.45626 4.06507 2.19038 -138.28000 635.78085
3030.0000 -142.37993 -138.92714 3.45279 2.19982 -138.13858 629.56637
3035.0000 -142.45038 -137.95740 4.49299 2.19608 -138.19456 619.07986
3040.0000 -142.63142 -136.85956 5.77186 2.21895 -137.85199 647.11316
3045.0000 -142.43672 -138.45117 3.98555 2.22435 -137.77100 651.94571
3050.0000 -143.15089 -137.85783 5.29306 2.17999 -138.43565 633.69448
3055.0000 -142.44230 -137.57244 4.86985 2.23283 -137.64403 678.31322
3060.0000 -142.64875 -137.68077 4.96798 2.22236 -137.80078 647.53286
3065.0000 -143.16310 -139.06867 4.09442 2.21068 -137.97592 603.89149
3070.0000 -142.09982 -137.50156 4.59827 2.18228 -138.40136 602.83571
3075.0000 -142.80469 -137.14390 5.66079 2.24794 -137.41760 667.01768
3080.0000 -142.93622 -137.57527 5.36096 2.24578 -137.45000 656.61816
3085.0000 -142.47576 -137.49580 4.97997 2.21718 -137.87849 630.89133
3090.0000 -142.15629 -137.38711 4.76918 2.22997 -137.68689 623.32845
3095.0000 -143.04889 -137.42197 5.62692 2.22838 -137.71065 619.85271
3100.0000 -142.99999 -137.92958 5.07040 2.22136 -137.81579 645.33866
3105.0000 -142.74691 -138.94995 3.79696 2.17573 -138.49952 602.73158
3110.0000 -143.68190 -139.35638 4.32551 2.13151 -139.16208 596.15291
3115.0000 -142.78608 -138.68143 4.10465 2.13301 -139.13972 594.91651
3120.0000 -143.48228 -138.95916 4.52312 2.14917 -138.89758 576.08351
3125.0000 -142.33779 -136.78703 5.55076 2.24706 -137.43072 652.34285
3130.0000 -144.00478 -138.65237 5.35241 2.20989 -137.98766 627.22954
3135.0000 -142.88714 -137.79872 5.08842 2.16431 -138.67066 604.54807
3140.0000 -142.78295 -138.92931 3.85365 2.22130 -137.81673 651.39254
3145.0000 -143.31781 -139.05373 4.26408 2.16050 -138.72782 576.59918
3150.0000 -142.98950 -138.02743 4.96207 2.20436 -138.07057 632.05174
3155.0000 -141.85804 -137.32425 4.53379 2.20652 -138.03816 640.16039
3160.0000 -141.30121 -136.75481 4.54640 2.28755 -136.82408 685.48536
3165.0000 -143.18297 -138.10304 5.07993 2.21450 -137.91866 638.44928
3170.0000 -141.57385 -136.63450 4.93935 2.23239 -137.65052 644.40491
3175.0000 -142.95520 -138.84554 4.10965 2.20559 -138.05216 639.26133
3180.0000 -143.60890 -139.36038 4.24852 2.15037 -138.87959 593.64813
3185.0000 -142.89310 -138.07418 4.81892 2.17377 -138.52899 598.28764
3190.0000 -143.84489 -138.90056 4.94433 2.18116 -138.41822 613.71256
3195.0000 -142.54482 -138.93495 3.60988 2.11554 -139.40143 544.63234
3200.0000 -143.89951 -139.60875 4.29076 2.11861 -139.35547 580.41979
3205.0000 -142.91401 -137.96441 4.94960 2.15516 -138.80779 598.71443
3210.0000 -142.01091 -136.57900 5.43191 2.25661 -137.28764 668.06072
3215.0000 -143.65331 -138.15962 5.49369 2.24878 -137.40494 673.69304
3220.0000 -142.00219 -137.36170 4.64049 2.24258 -137.49785 677.97963
3225.0000 -141.52295 -137.19176 4.33119 2.28026 -136.93333 689.06182
3230.0000 -143.11277 -138.31446 4.79831 2.22059 -137.82738 625.12969
3235.0000 -143.31671 -138.67761 4.63910 2.21212 -137.95435 639.70587
3240.0000 -142.53360 -138.32164 4.21196 2.18488 -138.36242 621.60186
3245.0000 -143.08703 -138.79666 4.29036 2.17616 -138.49316 618.91406
3250.0000 -143.41512 -139.13770 4.27742 2.18442 -138.36941 612.55182
MELTING PROCESS: loop number 14 T-loop= 665.00000000000000
main_MD> interactions number 14 at Temperature= 665.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.10250 1.03883 1.02883
force_rgl> df(natom) 0.87116 1.57990 -0.16084
3255.0000 -142.31018 -137.93448 4.37570 2.17343 -138.53406 621.68229
3260.0000 -142.96318 -138.48606 4.47711 2.17541 -138.50433 619.22378
3265.0000 -142.87052 -138.03905 4.83146 2.22268 -137.79599 673.35244
3270.0000 -142.86577 -138.78201 4.08376 2.19714 -138.17871 629.77321
3275.0000 -142.59943 -137.92815 4.67128 2.17104 -138.56987 591.22400
3280.0000 -143.03843 -138.02491 5.01352 2.22173 -137.81033 626.63928
3285.0000 -142.73801 -138.14433 4.59368 2.18995 -138.28644 616.78768
3290.0000 -142.87150 -137.56371 5.30779 2.21071 -137.97536 652.52613
3295.0000 -141.99527 -136.77227 5.22300 2.26183 -137.20940 672.36670
3300.0000 -142.02908 -136.13346 5.89562 2.23662 -137.58715 643.06970
3305.0000 -141.82792 -137.25105 4.57687 2.29605 -136.69665 683.49894
3310.0000 -141.61967 -136.18940 5.43026 2.31418 -136.42498 677.33241
3315.0000 -141.93539 -136.97016 4.96523 2.31910 -136.35134 704.28159
3320.0000 -143.16432 -137.95663 5.20770 2.22878 -137.70465 634.50907
3325.0000 -142.64090 -138.76000 3.88090 2.19613 -138.19388 613.35683
3330.0000 -142.63287 -138.23711 4.39577 2.15222 -138.85182 579.94094
3335.0000 -142.45593 -138.04438 4.41156 2.23006 -137.68554 647.42197
3340.0000 -141.51745 -136.01145 5.50600 2.25749 -137.27447 679.56300
3345.0000 -141.52776 -136.45881 5.06895 2.36193 -135.70965 741.76946
3350.0000 -140.90283 -136.25099 4.65184 2.34878 -135.90668 700.44313
3355.0000 -141.87371 -137.35940 4.51431 2.29017 -136.78474 674.77957
3360.0000 -142.60464 -137.75381 4.85083 2.21782 -137.86884 624.98140
3365.0000 -142.60643 -136.46286 6.14357 2.26330 -137.18737 661.83152
3370.0000 -141.86892 -136.86775 5.00117 2.27816 -136.96483 664.87284
3375.0000 -142.68804 -137.47227 5.21576 2.29042 -136.78113 709.03131
3380.0000 -142.60309 -137.34476 5.25833 2.25673 -137.28592 662.37387
3385.0000 -141.68448 -136.61314 5.07135 2.27868 -136.95696 680.65790
3390.0000 -142.39720 -137.77585 4.62134 2.24767 -137.42155 678.55114
3395.0000 -143.48453 -137.55700 5.92753 2.22274 -137.79519 665.54755
3400.0000 -142.90193 -137.17677 5.72515 2.27357 -137.03360 710.25295
3405.0000 -142.76813 -138.17782 4.59031 2.24855 -137.40836 650.10570
3410.0000 -143.50694 -139.16496 4.34198 2.20231 -138.10134 619.55626
3415.0000 -143.31631 -138.56283 4.75348 2.14531 -138.95537 574.83839
3420.0000 -143.40844 -136.83997 6.56848 2.27152 -137.06419 656.95361
3425.0000 -140.46720 -135.07989 5.38731 2.33429 -136.12379 714.79843
3430.0000 -142.09294 -136.09749 5.99545 2.39092 -135.27519 749.06602
3435.0000 -142.37730 -135.86642 6.51088 2.34106 -136.02226 719.27325
3440.0000 -140.81174 -135.72423 5.08751 2.32512 -136.26107 721.19700
3445.0000 -141.46623 -135.46706 5.99917 2.38282 -135.39656 775.53278
3450.0000 -141.73209 -136.16898 5.56311 2.33395 -136.12881 706.36733
3455.0000 -142.20238 -137.05753 5.14485 2.30399 -136.57773 699.18423
3460.0000 -141.94568 -136.41181 5.53386 2.31012 -136.48584 712.57376
3465.0000 -142.82166 -137.41714 5.40452 2.29697 -136.68292 707.61466
3470.0000 -141.28582 -136.65887 4.62695 2.29888 -136.65431 711.63041
3475.0000 -142.63961 -136.77178 5.86783 2.26537 -137.15638 660.07829
3480.0000 -142.55326 -137.86081 4.69245 2.28251 -136.89953 707.88795
3485.0000 -142.95325 -138.11427 4.83898 2.22381 -137.77912 628.58814
3490.0000 -142.20209 -137.25546 4.94662 2.20824 -138.01241 630.53750
3495.0000 -142.85571 -137.63592 5.21979 2.22477 -137.76472 647.57804
3500.0000 -143.26178 -138.82383 4.43795 2.20207 -138.10483 631.65234
MELTING PROCESS: loop number 15 T-loop= 690.00000000000000
main_MD> interactions number 15 at Temperature= 690.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.82555 0.37548 0.40562
force_rgl> df(natom) 1.82494 -0.67694 -5.51882
3505.0000 -141.22858 -136.52844 4.70014 2.23087 -137.67330 652.05121
3510.0000 -140.36855 -135.51309 4.85546 2.34029 -136.03388 725.68169
3515.0000 -141.90203 -135.80591 6.09612 2.37196 -135.55936 725.78427
3520.0000 -141.94274 -136.76634 5.17640 2.34333 -135.98825 722.84056
3525.0000 -141.89667 -137.49108 4.40559 2.29740 -136.67644 687.90427
3530.0000 -142.52540 -137.33016 5.19525 2.24527 -137.45764 650.19092
3535.0000 -142.53528 -137.63564 4.89964 2.27392 -137.02828 677.52241
3540.0000 -143.49572 -137.96533 5.53039 2.21303 -137.94069 648.25939
3545.0000 -143.10623 -138.38790 4.71833 2.18246 -138.39870 624.87461
3550.0000 -142.52785 -137.38553 5.14232 2.20946 -137.99414 615.30376
3555.0000 -141.69901 -137.08233 4.61667 2.28713 -136.83042 696.32133
3560.0000 -142.46713 -137.46176 5.00536 2.25371 -137.33112 645.44413
3565.0000 -142.08798 -137.47098 4.61699 2.25362 -137.33252 668.81030
3570.0000 -140.95684 -135.84357 5.11326 2.28756 -136.82397 688.08975
3575.0000 -141.61674 -136.49698 5.11976 2.32734 -136.22788 696.17725
3580.0000 -140.78179 -136.46333 4.31847 2.33182 -136.16071 726.79498
3585.0000 -143.41825 -137.87914 5.53912 2.29749 -136.67515 715.21402
3590.0000 -142.30380 -138.09357 4.21023 2.19503 -138.21036 637.38903
3595.0000 -142.57233 -137.65411 4.91821 2.20322 -138.08767 631.58532
3600.0000 -142.94710 -137.05200 5.89510 2.28885 -136.80461 692.65717
3605.0000 -141.32061 -136.35359 4.96702 2.30188 -136.60928 695.02430
3610.0000 -141.08838 -135.85253 5.23584 2.33038 -136.18224 722.70492
3615.0000 -141.48724 -135.67907 5.80817 2.34836 -135.91291 718.51594
3620.0000 -141.95536 -136.71523 5.24013 2.33640 -136.09210 717.20583
3625.0000 -142.25328 -136.67270 5.58059 2.28665 -136.83750 689.19548
3630.0000 -140.47854 -135.37724 5.10129 2.36661 -135.63949 768.19446
3635.0000 -142.02745 -137.18422 4.84323 2.28496 -136.86291 689.10658
3640.0000 -141.88845 -137.56837 4.32009 2.26180 -137.20988 678.69688
3645.0000 -141.64383 -136.78029 4.86354 2.27437 -137.02159 696.66697
3650.0000 -142.61978 -136.89454 5.72523 2.31301 -136.44265 739.33907
3655.0000 -142.49062 -137.39646 5.09416 2.25413 -137.32480 683.18236
3660.0000 -142.98315 -137.30694 5.67621 2.23941 -137.54531 691.99228
3665.0000 -141.44374 -136.89381 4.54993 2.24131 -137.51689 650.54466
3670.0000 -141.07297 -136.70596 4.36701 2.29942 -136.64626 685.54843
3675.0000 -142.10796 -137.09023 5.01773 2.29033 -136.78240 667.22603
3680.0000 -140.76423 -135.67172 5.09251 2.35401 -135.82822 721.41903
3685.0000 -142.04161 -136.13309 5.90853 2.33856 -136.05971 726.99826
3690.0000 -141.25216 -136.40519 4.84696 2.33639 -136.09231 730.93911
3695.0000 -141.24158 -136.39329 4.84828 2.33107 -136.17205 731.12039
3700.0000 -141.61415 -135.81845 5.79570 2.33538 -136.10735 743.58682
3705.0000 -140.48431 -135.72334 4.76097 2.33157 -136.16449 685.05105
3710.0000 -141.50065 -136.12265 5.37800 2.38531 -135.35921 757.98105
3715.0000 -142.91715 -137.54047 5.37669 2.30441 -136.57138 699.54005
3720.0000 -142.02223 -137.58869 4.43354 2.23304 -137.64076 644.08928
3725.0000 -142.53212 -136.76873 5.76339 2.24013 -137.53463 641.07513
3730.0000 -141.66420 -136.86952 4.79467 2.32133 -136.31786 732.16223
3735.0000 -142.33612 -137.80316 4.53296 2.26212 -137.20504 674.56876
3740.0000 -141.58904 -136.66139 4.92765 2.22830 -137.71190 673.35866
3745.0000 -141.86440 -136.67299 5.19141 2.29093 -136.77348 711.94000
3750.0000 -141.74496 -136.47421 5.27075 2.33082 -136.17566 710.78343
MELTING PROCESS: loop number 16 T-loop= 715.00000000000000
main_MD> interactions number 16 at Temperature= 715.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -2.97820 -0.74498 -0.83308
force_rgl> df(natom) -0.75096 -2.85424 0.57876
3755.0000 -140.07186 -135.63910 4.43276 2.33769 -136.07272 717.03472
3760.0000 -140.04790 -134.69874 5.34917 2.38651 -135.34123 743.38896
3765.0000 -141.94046 -137.26808 4.67239 2.29091 -136.77374 672.25544
3770.0000 -142.30955 -138.02605 4.28350 2.25445 -137.32010 653.29837
3775.0000 -141.59602 -136.23459 5.36142 2.27370 -137.03155 669.24491
3780.0000 -141.87866 -135.96786 5.91080 2.34864 -135.90866 724.19429
3785.0000 -139.86817 -135.26093 4.60724 2.35697 -135.78385 720.97855
3790.0000 -143.00836 -138.58423 4.42413 2.27975 -136.94091 658.14744
3795.0000 -143.92218 -139.99498 3.92720 2.13331 -139.13519 600.58549
3800.0000 -142.76940 -138.61349 4.15591 2.16043 -138.72886 622.20705
3805.0000 -142.24075 -136.15241 6.08834 2.26716 -137.12966 675.10824
3810.0000 -142.27911 -136.73432 5.54479 2.34643 -135.94187 720.93261
3815.0000 -141.75557 -137.01856 4.73701 2.26993 -137.08809 693.95447
3820.0000 -142.34051 -137.07313 5.26737 2.30350 -136.58509 728.03059
3825.0000 -141.52529 -136.20734 5.31794 2.31111 -136.47104 730.75206
3830.0000 -141.34399 -135.86297 5.48102 2.28558 -136.85352 689.31893
3835.0000 -141.17167 -136.20570 4.96597 2.35728 -135.77932 743.05765
3840.0000 -141.04213 -136.18529 4.85683 2.32470 -136.26737 687.07478
3845.0000 -141.00912 -135.86118 5.14793 2.33235 -136.15280 690.77774
3850.0000 -139.57614 -134.43245 5.14370 2.44430 -134.47531 769.10804
3855.0000 -140.69956 -134.79196 5.90760 2.42267 -134.79955 787.27411
3860.0000 -141.74587 -136.99652 4.74936 2.37719 -135.48093 758.45867
3865.0000 -139.92998 -135.08590 4.84408 2.32903 -136.20249 712.59603
3870.0000 -141.54910 -136.16364 5.38545 2.33764 -136.07351 687.60599
3875.0000 -140.75489 -135.58460 5.17029 2.36643 -135.64215 739.18677
3880.0000 -142.09200 -136.65434 5.43766 2.33512 -136.11127 722.33331
3885.0000 -141.53150 -137.23653 4.29498 2.26999 -137.08724 656.96692
3890.0000 -141.05311 -135.98473 5.06838 2.28720 -136.82932 708.59240
3895.0000 -141.93099 -136.08440 5.84659 2.32985 -136.19023 725.60955
3900.0000 -141.44895 -137.05779 4.39116 2.33461 -136.11899 713.20088
3905.0000 -142.61098 -137.36361 5.24737 2.22407 -137.77518 662.64608
3910.0000 -142.17477 -137.17321 5.00156 2.26649 -137.13962 703.45043
3915.0000 -142.56430 -137.38067 5.18364 2.27470 -137.01666 701.60805
3920.0000 -142.45094 -136.59151 5.85943 2.31787 -136.36979 700.25225
3925.0000 -141.52815 -137.22846 4.29969 2.24802 -137.41630 675.68986
3930.0000 -143.07560 -137.72067 5.35493 2.30186 -136.60972 720.34973
3935.0000 -140.90036 -134.72940 6.17095 2.29769 -136.67210 730.72303
3940.0000 -139.83253 -133.30729 6.52524 2.50205 -133.61006 830.25734
3945.0000 -138.95815 -133.68134 5.27681 2.45020 -134.38697 798.25734
3950.0000 -140.44900 -135.20024 5.24875 2.43694 -134.58573 779.86837
3955.0000 -140.16531 -133.97435 6.19097 2.43579 -134.60286 781.18525
3960.0000 -140.01599 -133.44275 6.57324 2.45757 -134.27647 807.05025
3965.0000 -141.56062 -134.48351 7.07711 2.43646 -134.59279 808.67584
3970.0000 -142.26524 -136.25984 6.00541 2.38798 -135.31932 791.03654
3975.0000 -141.35752 -136.32809 5.02942 2.30785 -136.51994 713.47559
3980.0000 -141.14643 -136.12829 5.01814 2.34404 -135.97760 732.79584
3985.0000 -140.65968 -135.51883 5.14084 2.32808 -136.21680 712.43977
3990.0000 -141.00560 -134.65517 6.35044 2.36950 -135.59618 730.81953
3995.0000 -142.71192 -137.28937 5.42254 2.34175 -136.01202 727.64569
4000.0000 -143.19306 -137.90132 5.29174 2.20481 -138.06378 642.17643
MELTING PROCESS: loop number 17 T-loop= 740.00000000000000
main_MD> interactions number 17 at Temperature= 740.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -2.87017 5.30797 -4.87285
force_rgl> df(natom) -0.36669 -1.95293 -2.41270
4005.0000 -140.71709 -134.59350 6.12358 2.31431 -136.42307 695.81277
4010.0000 -139.78946 -133.42210 6.36737 2.47625 -133.99660 800.18640
4015.0000 -140.95697 -135.62152 5.33544 2.46305 -134.19439 801.13651
4020.0000 -141.33723 -136.25224 5.08500 2.32360 -136.28391 722.66149
4025.0000 -142.42075 -137.10813 5.31262 2.28497 -136.86272 683.75651
4030.0000 -142.52901 -137.02075 5.50825 2.28847 -136.81025 718.48612
4035.0000 -141.80909 -135.39430 6.41479 2.29455 -136.71923 727.58228
4040.0000 -141.93565 -135.98449 5.95117 2.37044 -135.58207 778.06331
4045.0000 -141.92957 -136.43341 5.49617 2.33494 -136.11397 740.55140
4050.0000 -142.15681 -136.14085 6.01597 2.31714 -136.38070 703.76579
4055.0000 -141.24968 -136.10301 5.14668 2.37929 -135.44950 755.96111
4060.0000 -141.62724 -135.34137 6.28587 2.36264 -135.69896 733.44526
4065.0000 -140.55080 -134.18110 6.36970 2.41023 -134.98591 783.10696
4070.0000 -141.01462 -134.72188 6.29274 2.46522 -134.16191 834.91360
4075.0000 -141.96077 -136.43265 5.52812 2.42894 -134.70559 793.63757
4080.0000 -141.39265 -136.77102 4.62163 2.27734 -136.97708 685.75942
4085.0000 -140.42881 -135.61712 4.81169 2.31719 -136.37989 717.56260
4090.0000 -141.27238 -135.84739 5.42499 2.33568 -136.10287 706.04991
4095.0000 -141.90959 -136.16321 5.74639 2.36214 -135.70638 722.88834
4100.0000 -141.06796 -135.30059 5.76737 2.33778 -136.07147 738.58434
4105.0000 -140.54542 -134.57991 5.96551 2.39640 -135.19306 748.96513
4110.0000 -141.27884 -135.76890 5.50993 2.39803 -135.16869 755.02093
4115.0000 -141.62337 -136.42381 5.19955 2.33209 -136.15664 723.61551
4120.0000 -141.16115 -136.25022 4.91094 2.31975 -136.34155 693.88224
4125.0000 -141.31995 -136.61635 4.70360 2.31459 -136.41886 698.27209
4130.0000 -140.73256 -135.69290 5.03966 2.31825 -136.36406 711.37614
4135.0000 -141.17953 -136.52735 4.65218 2.32380 -136.28097 717.39280
4140.0000 -140.68929 -135.42125 5.26805 2.35777 -135.77195 731.86890
4145.0000 -140.16071 -135.59891 4.56179 2.36774 -135.62256 710.47990
4150.0000 -141.96837 -136.16091 5.80746 2.38069 -135.42842 742.17770
4155.0000 -140.61835 -135.26152 5.35683 2.39363 -135.23464 783.56452
4160.0000 -140.25934 -134.73890 5.52044 2.42505 -134.76374 780.78074
4165.0000 -141.41789 -136.02594 5.39195 2.35189 -135.86001 735.22027
4170.0000 -142.12401 -136.15704 5.96697 2.34891 -135.90463 731.59348
4175.0000 -141.96540 -136.56120 5.40420 2.35813 -135.76653 734.43761
4180.0000 -141.47290 -136.30430 5.16860 2.26832 -137.11218 676.65169
4185.0000 -140.12414 -135.22935 4.89479 2.36857 -135.61004 752.37669
4190.0000 -140.81784 -134.89703 5.92081 2.42055 -134.83126 784.02708
4195.0000 -140.69508 -134.71513 5.97994 2.42633 -134.74467 787.18464
4200.0000 -140.64877 -134.30045 6.34833 2.42159 -134.81559 778.94054
4205.0000 -139.41138 -133.44046 5.97092 2.48840 -133.81455 841.73444
4210.0000 -141.32342 -134.93443 6.38899 2.46892 -134.10654 789.35541
4215.0000 -140.24431 -135.46945 4.77486 2.42793 -134.72061 773.27200
4220.0000 -141.27862 -136.43702 4.84160 2.39050 -135.28150 751.17798
4225.0000 -141.11954 -136.36080 4.75874 2.28450 -136.86975 705.92269
4230.0000 -141.96690 -136.70367 5.26323 2.28315 -136.88998 693.68177
4235.0000 -141.87497 -135.60681 6.26817 2.32559 -136.25414 727.43780
4240.0000 -140.35689 -134.04255 6.31434 2.44196 -134.51038 816.17288
4245.0000 -139.67027 -134.13764 5.53264 2.48024 -133.93683 817.50415
4250.0000 -141.63359 -134.64437 6.98922 2.43739 -134.57894 796.47047
MELTING PROCESS: loop number 18 T-loop= 765.00000000000000
main_MD> interactions number 18 at Temperature= 765.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 3.77725 2.92272 -0.06994
force_rgl> df(natom) -1.32192 -2.27220 0.38377
4255.0000 -140.75105 -134.95653 5.79452 2.39686 -135.18613 763.73260
4260.0000 -139.81090 -133.77651 6.03439 2.39778 -135.17244 742.02718
4265.0000 -140.34700 -134.10371 6.24329 2.47690 -133.98688 806.08717
4270.0000 -139.27121 -132.59725 6.67397 2.51889 -133.35773 855.81536
4275.0000 -139.97073 -135.28124 4.68949 2.47134 -134.07029 793.79406
4280.0000 -140.95810 -134.50214 6.45596 2.43209 -134.65827 789.56321
4285.0000 -139.92745 -133.19207 6.73538 2.45914 -134.25298 787.95540
4290.0000 -141.00366 -135.07070 5.93296 2.47618 -133.99773 811.39238
4295.0000 -140.15895 -134.30275 5.85620 2.42418 -134.77690 785.76951
4300.0000 -139.16486 -133.68769 5.47717 2.43761 -134.57566 777.46878
4305.0000 -140.18350 -134.43098 5.75252 2.47632 -133.99559 810.77542
4310.0000 -140.43673 -135.65199 4.78473 2.42192 -134.81067 756.81486
4315.0000 -141.16552 -134.65044 6.51508 2.45546 -134.30822 793.16599
4320.0000 -141.81822 -136.23338 5.58484 2.37293 -135.54483 771.41578
4325.0000 -141.28529 -135.97783 5.30747 2.33959 -136.04437 710.83825
4330.0000 -140.38164 -134.36596 6.01568 2.40591 -135.05057 754.68661
4335.0000 -140.77148 -134.85222 5.91926 2.42007 -134.83839 778.53637
4340.0000 -141.51906 -135.24556 6.27350 2.43051 -134.68202 784.93669
4345.0000 -141.25364 -135.86924 5.38439 2.35616 -135.79602 728.17986
4350.0000 -142.35376 -137.40389 4.94987 2.31248 -136.45055 717.97303
4355.0000 -142.29604 -137.82119 4.47485 2.23863 -137.55710 656.43226
4360.0000 -141.11430 -135.92810 5.18621 2.27161 -137.06292 655.39386
4365.0000 -140.47605 -135.32142 5.15462 2.34591 -135.94967 709.64416
4370.0000 -140.46310 -134.67122 5.79188 2.39731 -135.17944 753.64512
4375.0000 -138.95948 -132.65472 6.30476 2.45971 -134.24453 804.82405
4380.0000 -138.45758 -131.46310 6.99448 2.59066 -132.28234 894.78213
4385.0000 -140.56145 -134.87998 5.68147 2.52942 -133.20004 846.68916
4390.0000 -141.09523 -135.84181 5.25342 2.39795 -135.16987 772.19292
4395.0000 -141.14583 -135.99539 5.15044 2.36036 -135.73305 722.93972
4400.0000 -141.11923 -135.59602 5.52321 2.34408 -135.97701 731.09941
4405.0000 -141.76359 -136.66630 5.09729 2.32861 -136.20887 722.65482
4410.0000 -141.54442 -135.43429 6.11014 2.40322 -135.09093 783.59772
4415.0000 -139.75768 -134.90085 4.85683 2.42556 -134.75610 810.44637
4420.0000 -141.17429 -135.37115 5.80314 2.38589 -135.35051 742.71246
4425.0000 -141.28690 -136.03789 5.24901 2.37921 -135.45061 752.22521
4430.0000 -141.71841 -135.92887 5.78954 2.34307 -135.99215 749.39174
4435.0000 -139.16422 -133.32261 5.84160 2.45083 -134.37760 766.88873
4440.0000 -140.40956 -134.07133 6.33823 2.50857 -133.51245 829.96857
4445.0000 -141.25360 -134.55022 6.70338 2.40200 -135.10913 767.84171
4450.0000 -140.28952 -135.38744 4.90208 2.42176 -134.81304 770.28241
4455.0000 -141.19595 -136.33947 4.85648 2.37752 -135.47593 757.90588
4460.0000 -141.68831 -134.84579 6.84252 2.31805 -136.36711 721.26752
4465.0000 -141.61625 -135.29454 6.32171 2.38310 -135.39232 776.00197
4470.0000 -140.55033 -134.83281 5.71752 2.44881 -134.40774 795.79159
4475.0000 -140.74094 -135.60831 5.13262 2.39746 -135.17722 748.07948
4480.0000 -140.16860 -133.63932 6.52928 2.41759 -134.87566 760.62725
4485.0000 -141.69137 -135.97902 5.71235 2.42122 -134.82114 787.81528
4490.0000 -141.51027 -136.44479 5.06549 2.30464 -136.56807 693.93797
4495.0000 -142.00791 -136.28327 5.72464 2.32465 -136.26816 716.04445
4500.0000 -141.32117 -135.62903 5.69214 2.32452 -136.27006 702.50295
MELTING PROCESS: loop number 19 T-loop= 790.00000000000000
main_MD> interactions number 19 at Temperature= 790.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.69980 2.92020 -1.85379
force_rgl> df(natom) 1.36435 -0.34398 1.51329
4505.0000 -141.67383 -135.58396 6.08987 2.39558 -135.20540 770.73722
4510.0000 -141.46852 -135.95157 5.51695 2.35762 -135.77417 772.43383
4515.0000 -140.41972 -134.61700 5.80272 2.36306 -135.69262 776.86228
4520.0000 -140.63110 -134.51420 6.11690 2.47104 -134.07476 814.33081
4525.0000 -141.70405 -135.09341 6.61064 2.43570 -134.60418 792.40628
4530.0000 -142.08269 -136.74025 5.34244 2.37363 -135.53424 768.86247
4535.0000 -141.58564 -135.38651 6.19913 2.33676 -136.08665 696.34724
4540.0000 -140.12785 -134.19601 5.93184 2.41505 -134.91359 774.31819
4545.0000 -139.44582 -133.66876 5.77706 2.48555 -133.85730 790.77750
4550.0000 -139.34754 -132.89522 6.45232 2.50083 -133.62830 798.76782
4555.0000 -139.40705 -133.44572 5.96133 2.53215 -133.15909 862.11820
4560.0000 -140.02277 -134.08313 5.93965 2.51070 -133.48040 845.95355
4565.0000 -139.70100 -134.66804 5.03296 2.47053 -134.08240 809.63984
4570.0000 -140.98062 -135.01317 5.96745 2.42351 -134.78688 779.00802
4575.0000 -140.22777 -134.27962 5.94815 2.43197 -134.66015 790.45815
4580.0000 -140.58859 -135.60194 4.98665 2.44953 -134.39700 794.51338
4585.0000 -139.17934 -133.04118 6.13816 2.41305 -134.94365 746.35249
4590.0000 -139.17730 -132.45017 6.72713 2.54000 -133.04143 814.21541
4595.0000 -139.73579 -133.75692 5.97887 2.58570 -132.35666 893.98968
4600.0000 -140.10334 -133.53654 6.56680 2.53038 -133.18564 893.07875
4605.0000 -141.04786 -134.75259 6.29527 2.44287 -134.49679 792.13330
4610.0000 -141.14089 -134.97107 6.16982 2.43023 -134.68614 799.42332
4615.0000 -140.58927 -133.75362 6.83565 2.39392 -135.23026 759.86134
4620.0000 -140.72779 -134.31186 6.41593 2.48189 -133.91213 838.64081
4625.0000 -139.01862 -133.20121 5.81741 2.53913 -133.05449 867.13072
4630.0000 -140.61055 -134.53619 6.07436 2.48599 -133.85075 832.78330
4635.0000 -140.69518 -134.66495 6.03023 2.45368 -134.33482 810.38002
4640.0000 -141.23028 -135.87017 5.36011 2.41269 -134.94894 761.68148
4645.0000 -140.49143 -134.78343 5.70800 2.38090 -135.42528 752.51859
4650.0000 -141.63975 -136.24421 5.39554 2.43068 -134.67940 779.67414
4655.0000 -140.69548 -134.51770 6.17779 2.35938 -135.74785 750.63004
4660.0000 -140.53673 -134.38235 6.15438 2.42459 -134.77068 791.31101
4665.0000 -140.59480 -134.08825 6.50654 2.45223 -134.35661 836.53543
4670.0000 -140.09857 -133.88273 6.21584 2.48507 -133.86445 839.74473
4675.0000 -139.68946 -132.51879 7.17066 2.53442 -133.12508 861.86161
4680.0000 -141.48190 -135.54858 5.93332 2.46107 -134.22411 847.66286
4685.0000 -141.09376 -135.11762 5.97614 2.38166 -135.41401 754.44746
4690.0000 -139.40666 -134.19098 5.21568 2.40510 -135.06274 751.82225
4695.0000 -139.86380 -134.70097 5.16282 2.48642 -133.84426 804.94498
4700.0000 -140.91827 -134.46430 6.45397 2.43450 -134.62216 801.16690
4705.0000 -140.43922 -134.40120 6.03802 2.40834 -135.01416 768.23400
4710.0000 -141.07133 -135.77843 5.29290 2.41502 -134.91415 776.80090
4715.0000 -141.40189 -137.11186 4.29003 2.31647 -136.39081 708.91228
4720.0000 -141.79999 -136.16825 5.63174 2.30911 -136.50106 700.98828
4725.0000 -141.84518 -137.28139 4.56379 2.28974 -136.79128 691.99359
4730.0000 -142.05882 -136.66594 5.39288 2.28484 -136.86465 669.94020
4735.0000 -140.93526 -135.64102 5.29423 2.31904 -136.35224 711.45110
4740.0000 -140.89953 -134.63434 6.26519 2.41702 -134.88411 783.62202
4745.0000 -140.42267 -133.86969 6.55298 2.47345 -134.03855 795.67344
4750.0000 -139.79978 -134.99271 4.80707 2.51383 -133.43354 831.83376
MELTING PROCESS: loop number 20 T-loop= 815.00000000000000
main_MD> interactions number 20 at Temperature= 815.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 5.98995 2.32028 2.23993
force_rgl> df(natom) 2.08650 -0.02840 -1.27466
4755.0000 -139.21870 -133.46071 5.75799 2.50285 -133.59811 825.02444
4760.0000 -139.61425 -132.41674 7.19751 2.53055 -133.18296 853.03627
4765.0000 -138.82916 -132.41637 6.41280 2.55675 -132.79049 874.54974
4770.0000 -140.42255 -133.11084 7.31170 2.54382 -132.98414 841.65487
4775.0000 -139.19958 -132.89878 6.30080 2.53085 -133.17847 825.73090
4780.0000 -138.54037 -132.61617 5.92421 2.52371 -133.28545 848.62426
4785.0000 -139.35518 -133.51011 5.84507 2.53739 -133.08053 875.46426
4790.0000 -141.07462 -135.28533 5.78929 2.46375 -134.18400 805.98326
4795.0000 -140.20434 -133.11642 7.08792 2.46526 -134.16138 821.48038
4800.0000 -139.51741 -134.32875 5.18866 2.51238 -133.45535 859.13436
4805.0000 -140.86659 -134.12742 6.73916 2.41206 -134.95848 766.36815
4810.0000 -142.44743 -137.04123 5.40620 2.36185 -135.71074 749.70447
4815.0000 -141.90969 -136.34610 5.56359 2.34403 -135.97786 713.64253
4820.0000 -141.53588 -135.01499 6.52089 2.33127 -136.16904 728.37352
4825.0000 -141.23886 -135.33211 5.90675 2.39756 -135.17565 773.41116
4830.0000 -141.44103 -135.44866 5.99238 2.36469 -135.66826 753.05209
4835.0000 -141.28690 -136.15935 5.12754 2.35575 -135.80223 755.99397
4840.0000 -141.41555 -135.50147 5.91407 2.36775 -135.62237 745.87188
4845.0000 -141.63892 -134.95722 6.68169 2.42020 -134.83643 795.19602
4850.0000 -140.27897 -134.58690 5.69207 2.41932 -134.84969 757.92230
4855.0000 -140.42737 -134.45655 5.97081 2.46206 -134.20922 801.35060
4860.0000 -141.01660 -134.27336 6.74324 2.47774 -133.97431 824.53405
4865.0000 -141.70707 -135.75021 5.95686 2.38910 -135.30251 746.06922
4870.0000 -139.92771 -133.59492 6.33279 2.44577 -134.45340 808.73274
4875.0000 -139.90459 -133.81126 6.09334 2.46621 -134.14713 821.35118
4880.0000 -139.28280 -132.85700 6.42581 2.55271 -132.85095 862.94517
4885.0000 -139.88765 -133.17283 6.71482 2.54256 -133.00311 864.08049
4890.0000 -139.03551 -131.42046 7.61505 2.55528 -132.81255 852.67952
4895.0000 -138.58668 -132.23313 6.35355 2.59443 -132.22584 914.32703
4900.0000 -139.97376 -133.62426 6.34950 2.52511 -133.26459 865.54167
4905.0000 -139.56774 -133.78570 5.78204 2.50545 -133.55906 853.06339
4910.0000 -140.30442 -134.13656 6.16786 2.47458 -134.02161 817.03744
4915.0000 -140.22353 -134.06448 6.15906 2.45990 -134.24161 790.93585
4920.0000 -139.88687 -133.86409 6.02278 2.47679 -133.98859 812.10263
4925.0000 -140.23290 -133.91843 6.31447 2.49391 -133.73203 814.22041
4930.0000 -140.36444 -132.98977 7.37467 2.50718 -133.53320 845.88745
4935.0000 -140.27449 -134.69690 5.57758 2.45412 -134.32831 800.96670
4940.0000 -141.79346 -135.55704 6.23641 2.40676 -135.03784 768.26271
4945.0000 -140.94771 -134.71886 6.22885 2.42140 -134.81853 801.13190
4950.0000 -140.57660 -134.60409 5.97251 2.44027 -134.53579 800.76599
4955.0000 -140.21431 -134.97119 5.24312 2.46027 -134.23610 778.58770
4960.0000 -140.81254 -134.48082 6.33172 2.40781 -135.02212 760.96777
4965.0000 -139.73456 -134.04930 5.68526 2.45824 -134.26658 807.27426
4970.0000 -140.00846 -134.53569 5.47277 2.45373 -134.33409 790.82821
4975.0000 -141.30242 -134.36691 6.93551 2.40309 -135.09282 758.16279
4980.0000 -140.32902 -134.82046 5.50857 2.45744 -134.27855 832.19845
4985.0000 -139.48138 -132.69273 6.78865 2.45161 -134.36581 777.95389
4990.0000 -140.45883 -134.40884 6.04999 2.52504 -133.26564 852.41454
4995.0000 -139.82494 -133.51468 6.31026 2.42890 -134.70618 798.11954
5000.0000 -139.92333 -133.61684 6.30649 2.43683 -134.58731 803.05859
MELTING PROCESS: loop number 21 T-loop= 840.00000000000000
main_MD> interactions number 21 at Temperature= 840.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 3.04198 0.88472 -1.23838
force_rgl> df(natom) 0.11054 -2.44762 0.41104
5005.0000 -139.73348 -132.74870 6.98478 2.50242 -133.60445 864.89992
5010.0000 -139.86935 -133.35162 6.51773 2.48813 -133.81861 850.02860
5015.0000 -139.04189 -133.03617 6.00572 2.55716 -132.78433 868.75324
5020.0000 -140.08895 -133.73265 6.35630 2.52653 -133.24331 851.69807
5025.0000 -138.70020 -133.32952 5.37069 2.55182 -132.86437 884.44065
5030.0000 -137.73106 -131.33191 6.39915 2.52493 -133.26729 835.29640
5035.0000 -139.38092 -132.05370 7.32722 2.59325 -132.24356 881.96305
5040.0000 -139.35609 -131.75506 7.60103 2.57833 -132.46704 892.78985
5045.0000 -138.40022 -131.26886 7.13137 2.63140 -131.67185 931.28079
5050.0000 -139.52257 -133.10264 6.41993 2.57576 -132.50556 912.29537
5055.0000 -139.37839 -132.80528 6.57310 2.52249 -133.30373 904.45753
5060.0000 -138.19159 -131.78897 6.40262 2.62592 -131.75410 949.76546
5065.0000 -140.79366 -134.43594 6.35772 2.47472 -134.01952 819.84466
5070.0000 -139.36557 -133.81647 5.54910 2.48394 -133.88148 840.29379
5075.0000 -139.40462 -132.85123 6.55340 2.53077 -133.17974 882.66617
5080.0000 -140.94044 -134.06646 6.87398 2.48479 -133.86875 845.30830
5085.0000 -139.53579 -133.17090 6.36489 2.56447 -132.67482 925.15802
5090.0000 -140.70035 -134.52109 6.17926 2.45787 -134.27204 806.41087
5095.0000 -139.61495 -133.24869 6.36626 2.47934 -133.95041 816.50816
5100.0000 -139.24905 -133.29303 5.95602 2.53485 -133.11860 833.13810
5105.0000 -139.38204 -134.11705 5.26498 2.53812 -133.06957 870.74464
5110.0000 -140.29410 -135.48634 4.80776 2.45666 -134.29025 811.39608
5115.0000 -138.93775 -133.12813 5.80962 2.45948 -134.24792 794.46392
5120.0000 -139.91661 -133.83197 6.08463 2.50830 -133.51648 849.13361
5125.0000 -140.65657 -134.57043 6.08614 2.49289 -133.74725 825.59523
5130.0000 -139.73903 -133.17874 6.56029 2.42866 -134.70968 812.95041
5135.0000 -138.53172 -131.99133 6.54039 2.53823 -133.06796 876.64679
5140.0000 -139.49514 -132.96688 6.52826 2.60962 -131.99834 914.53405
5145.0000 -139.91931 -133.19335 6.72596 2.50475 -133.56962 842.68327
5150.0000 -138.76882 -131.99441 6.77441 2.56451 -132.67411 891.48816
5155.0000 -139.93766 -132.92390 7.01376 2.55669 -132.79131 869.51866
5160.0000 -141.18615 -135.17148 6.01467 2.49048 -133.78347 837.05702
5165.0000 -141.56499 -134.46369 7.10130 2.42591 -134.75092 797.47885
5170.0000 -139.31210 -133.49428 5.81782 2.47091 -134.07665 814.99961
5175.0000 -139.23495 -133.42268 5.81228 2.44824 -134.41640 786.70510
5180.0000 -139.54827 -132.64956 6.89871 2.52850 -133.21371 853.91695
5185.0000 -139.15701 -132.16265 6.99435 2.58621 -132.34905 868.59418
5190.0000 -139.74225 -133.70223 6.04003 2.57543 -132.51060 886.23298
5195.0000 -137.30233 -131.90257 5.39976 2.58943 -132.30084 901.33626
5200.0000 -138.48221 -132.26867 6.21354 2.63022 -131.68959 954.36309
5205.0000 -139.49491 -133.48221 6.01271 2.52714 -133.23407 865.85137
5210.0000 -138.00240 -131.45587 6.54653 2.53597 -133.10175 838.78244
5215.0000 -139.15239 -132.63647 6.51592 2.65691 -131.28966 944.92075
5220.0000 -137.55365 -131.58361 5.97003 2.56454 -132.67368 867.48840
5225.0000 -137.77348 -130.53349 7.23999 2.69677 -130.69248 976.70498
5230.0000 -138.35528 -131.14718 7.20810 2.62865 -131.71318 930.72173
5235.0000 -139.46560 -132.46360 7.00200 2.61028 -131.98836 900.74196
5240.0000 -139.09254 -132.41396 6.67858 2.56537 -132.66136 898.52324
5245.0000 -138.83297 -133.15539 5.67758 2.56985 -132.59422 879.48157
5250.0000 -139.99856 -133.52911 6.46945 2.47569 -134.00505 807.61292
MELTING PROCESS: loop number 22 T-loop= 865.00000000000000
main_MD> interactions number 22 at Temperature= 865.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -5.52926 6.92049 -2.25123
force_rgl> df(natom) -0.01625 -0.02807 1.78517
5255.0000 -139.95410 -133.80139 6.15271 2.50775 -133.52464 812.09083
5260.0000 -138.61252 -131.66357 6.94895 2.57506 -132.51610 894.80534
5265.0000 -139.06217 -132.05546 7.00672 2.61741 -131.88159 893.99820
5270.0000 -138.82269 -131.24393 7.57877 2.61002 -131.99235 890.87198
5275.0000 -137.81060 -131.94079 5.86981 2.63374 -131.63693 950.67733
5280.0000 -139.97279 -133.92231 6.05048 2.51233 -133.45601 821.55289
5285.0000 -138.70323 -131.33635 7.36689 2.55865 -132.76205 897.56152
5290.0000 -138.81421 -133.01635 5.79785 2.61679 -131.89078 925.31025
5295.0000 -138.62777 -133.23393 5.39384 2.55374 -132.83551 848.25552
5300.0000 -140.33394 -135.02412 5.30982 2.51183 -133.46356 810.21354
5305.0000 -140.41986 -134.35040 6.06946 2.40661 -135.04018 772.59399
5310.0000 -140.02280 -133.33924 6.68356 2.48767 -133.82553 828.86876
5315.0000 -139.71369 -133.51778 6.19591 2.57877 -132.46045 891.56781
5320.0000 -137.68261 -132.75733 4.92528 2.51509 -133.41462 822.43086
5325.0000 -139.50685 -131.20379 8.30307 2.60244 -132.10589 885.63194
5330.0000 -139.00372 -131.34439 7.65933 2.64501 -131.46802 939.13440
5335.0000 -139.66663 -131.75254 7.91409 2.62518 -131.76519 907.81678
5340.0000 -141.19055 -133.94435 7.24620 2.54256 -133.00302 898.86331
5345.0000 -140.91466 -135.80513 5.10953 2.41169 -134.96399 807.27941
5350.0000 -140.05636 -133.46584 6.59053 2.47238 -134.05470 830.38979
5355.0000 -139.51756 -133.64542 5.87215 2.49626 -133.69685 826.10798
5360.0000 -139.61126 -134.42056 5.19070 2.50623 -133.54745 820.47566
5365.0000 -139.94941 -133.45280 6.49661 2.45888 -134.25688 817.37081
5370.0000 -140.49005 -133.80758 6.68247 2.47429 -134.02607 800.38594
5375.0000 -139.54719 -134.17529 5.37189 2.45151 -134.36731 794.70531
5380.0000 -139.79889 -134.01843 5.78046 2.47328 -134.04121 804.14391
5385.0000 -139.63541 -133.03877 6.59664 2.53396 -133.13197 861.52705
5390.0000 -137.44130 -130.52904 6.91226 2.63620 -131.59997 936.84649
5395.0000 -140.14471 -133.33373 6.81098 2.61888 -131.85953 919.95502
5400.0000 -139.26894 -132.90536 6.36358 2.48394 -133.88148 815.72591
5405.0000 -139.60341 -132.72213 6.88129 2.58429 -132.37776 887.79436
5410.0000 -140.15647 -133.51468 6.64178 2.53542 -133.11013 860.37115
5415.0000 -139.47178 -133.70976 5.76202 2.55078 -132.87992 862.35726
5420.0000 -138.80803 -133.08019 5.72784 2.47260 -134.05140 827.80704
5425.0000 -139.35334 -133.08622 6.26712 2.56103 -132.72635 879.08424
5430.0000 -138.60215 -131.68061 6.92155 2.58788 -132.32405 902.56126
5435.0000 -140.74123 -134.36468 6.37655 2.49085 -133.77792 834.25867
5440.0000 -139.35151 -132.36539 6.98611 2.50932 -133.50121 847.79994
5445.0000 -139.20403 -133.46353 5.74050 2.51785 -133.37331 833.48943
5450.0000 -139.70593 -132.81263 6.89329 2.54757 -132.92802 867.47706
5455.0000 -138.88905 -132.57066 6.31839 2.58921 -132.30408 913.58886
5460.0000 -140.24524 -132.78657 7.45868 2.56142 -132.72051 870.36085
5465.0000 -139.03247 -132.62941 6.40307 2.55905 -132.75599 893.25042
5470.0000 -139.17405 -131.49992 7.67413 2.54478 -132.96980 854.94683
5475.0000 -136.98748 -130.47463 6.51285 2.70914 -130.50712 992.45606
5480.0000 -139.25707 -132.27721 6.97986 2.67989 -130.94544 974.79205
5485.0000 -139.43727 -132.90796 6.52931 2.59637 -132.19680 904.39926
5490.0000 -140.19403 -132.94410 7.24993 2.54076 -133.03011 844.11848
5495.0000 -139.39677 -132.53867 6.85810 2.54102 -133.02611 858.57722
5500.0000 -137.71394 -132.06471 5.64923 2.58520 -132.36421 892.21456
MELTING PROCESS: loop number 23 T-loop= 890.00000000000000
main_MD> interactions number 23 at Temperature= 890.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.14478 -2.76596 -0.46503
force_rgl> df(natom) 2.20904 0.23873 0.30899
5505.0000 -138.74976 -132.76656 5.98320 2.58747 -132.33011 899.07086
5510.0000 -139.44765 -132.56854 6.87911 2.56726 -132.63293 887.01048
5515.0000 -139.65574 -132.86426 6.79148 2.56893 -132.60803 900.32676
5520.0000 -139.58880 -131.77063 7.81817 2.55872 -132.76097 897.84243
5525.0000 -139.00105 -133.35667 5.64438 2.54139 -133.02056 902.51811
5530.0000 -138.47998 -132.98425 5.49573 2.53527 -133.11231 855.61099
5535.0000 -138.98317 -132.53976 6.44341 2.59182 -132.26505 873.23197
5540.0000 -138.68986 -132.16256 6.52730 2.56716 -132.63445 891.96904
5545.0000 -140.09028 -132.52007 7.57021 2.59958 -132.14866 910.47912
5550.0000 -140.36790 -132.67274 7.69516 2.60063 -132.13291 927.52556
5555.0000 -140.05809 -133.49511 6.56298 2.50277 -133.59932 863.91412
5560.0000 -139.64270 -132.58678 7.05593 2.51607 -133.39998 823.19388
5565.0000 -140.52566 -133.57283 6.95283 2.56319 -132.69395 864.80841
5570.0000 -138.93549 -133.07680 5.85869 2.49584 -133.70310 843.39168
5575.0000 -139.63528 -132.61837 7.01691 2.58320 -132.39412 884.33225
5580.0000 -138.42287 -130.85048 7.57240 2.60320 -132.09439 900.01792
5585.0000 -139.39300 -132.30532 7.08769 2.65789 -131.27498 967.23010
5590.0000 -137.16319 -130.90437 6.25882 2.61449 -131.92529 905.58660
5595.0000 -139.06387 -133.14618 5.91769 2.64990 -131.39469 921.66965
5600.0000 -140.44071 -134.30614 6.13457 2.51084 -133.47839 826.35677
5605.0000 -138.49334 -132.57855 5.91479 2.53179 -133.16440 844.53766
5610.0000 -140.06335 -133.70156 6.36179 2.52843 -133.21477 883.90483
5615.0000 -139.01691 -133.08803 5.92888 2.53402 -133.13108 891.32672
5620.0000 -139.33660 -132.88317 6.45343 2.54587 -132.95352 876.87667
5625.0000 -139.78743 -134.22215 5.56528 2.54577 -132.95499 880.16844
5630.0000 -139.54601 -133.13174 6.41427 2.51822 -133.36786 860.94231
5635.0000 -139.94591 -132.56946 7.37644 2.52854 -133.21310 854.61485
5640.0000 -139.19899 -132.76132 6.43766 2.55441 -132.82545 859.71067
5645.0000 -138.34581 -131.94638 6.39943 2.51960 -133.34708 811.94736
5650.0000 -140.19416 -133.79354 6.40062 2.53553 -133.10834 870.59178
5655.0000 -140.71381 -133.87069 6.84312 2.46136 -134.21970 796.37766
5660.0000 -139.99493 -133.54229 6.45264 2.46170 -134.21470 825.94070
5665.0000 -139.92393 -133.35348 6.57045 2.52972 -133.19542 842.63831
5670.0000 -139.25965 -132.90210 6.35755 2.55917 -132.75416 873.83155
5675.0000 -138.98016 -133.31044 5.66972 2.57231 -132.55732 890.71054
5680.0000 -138.30854 -133.04774 5.26080 2.57476 -132.52059 868.53143
5685.0000 -137.79128 -130.62386 7.16742 2.60442 -132.07611 914.30895
5690.0000 -138.94237 -131.73677 7.20560 2.68545 -130.86199 956.74786
5695.0000 -139.86181 -133.18836 6.67345 2.51109 -133.47464 849.21392
5700.0000 -139.26083 -131.51724 7.74359 2.62017 -131.84017 925.73376
5705.0000 -138.70730 -132.48871 6.21860 2.58915 -132.30499 896.91573
5710.0000 -138.19836 -132.54507 5.65329 2.56331 -132.69209 864.51985
5715.0000 -139.23149 -132.66866 6.56283 2.56613 -132.64987 887.73244
5720.0000 -138.98734 -132.73178 6.25557 2.59686 -132.18953 881.69442
5725.0000 -140.28012 -133.64850 6.63162 2.52759 -133.22738 863.09964
5730.0000 -139.32014 -132.75265 6.56749 2.55019 -132.88873 846.82169
5735.0000 -139.90319 -131.96447 7.93872 2.54760 -132.92753 853.22011
5740.0000 -140.46410 -132.63033 7.83377 2.54280 -132.99942 895.48128
5745.0000 -140.46233 -134.04433 6.41801 2.45895 -134.25583 812.19323
5750.0000 -140.06551 -132.96459 7.10092 2.49702 -133.68545 832.50870
MELTING PROCESS: loop number 24 T-loop= 915.00000000000000
main_MD> interactions number 24 at Temperature= 915.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 4.33632 0.38702 4.66595
force_rgl> df(natom) -5.96961 -1.18405 -2.78717
5755.0000 -138.31930 -130.78518 7.53412 2.67533 -131.01374 955.39651
5760.0000 -140.13757 -132.64852 7.48905 2.66115 -131.22619 961.94023
5765.0000 -139.10051 -134.26468 4.83583 2.57564 -132.50735 884.01285
5770.0000 -140.59032 -134.96799 5.62232 2.42918 -134.70191 810.53415
5775.0000 -138.75084 -132.31979 6.43105 2.50414 -133.57875 855.25367
5780.0000 -138.35306 -131.41202 6.94104 2.62930 -131.70337 913.09839
5785.0000 -138.85113 -131.78013 7.07100 2.67433 -131.02867 960.04375
5790.0000 -139.61458 -133.86112 5.75346 2.52274 -133.30007 875.59837
5795.0000 -139.14187 -133.37238 5.76949 2.52123 -133.32262 864.08277
5800.0000 -140.15849 -133.20899 6.94950 2.51063 -133.48145 820.84900
5805.0000 -139.72479 -132.21668 7.50811 2.57590 -132.50355 904.66255
5810.0000 -138.62641 -132.35512 6.27129 2.56769 -132.62646 886.43476
5815.0000 -140.53042 -132.84046 7.68996 2.58059 -132.43330 887.47994
5820.0000 -139.13768 -133.05302 6.08466 2.55714 -132.78457 885.36806
5825.0000 -140.14336 -132.75385 7.38951 2.50547 -133.55879 864.38961
5830.0000 -138.54820 -132.45929 6.08891 2.51623 -133.39762 852.81487
5835.0000 -139.48765 -131.90050 7.58714 2.57469 -132.52160 896.82615
5840.0000 -138.82061 -130.82347 7.99714 2.64718 -131.43542 919.08468
5845.0000 -139.07022 -131.59467 7.47555 2.64333 -131.49320 906.97279
5850.0000 -137.99763 -131.62872 6.36891 2.65282 -131.35101 961.74594
5855.0000 -138.63419 -131.59008 7.04410 2.65239 -131.35741 951.11312
5860.0000 -138.59414 -132.33465 6.25950 2.60732 -132.03272 901.39977
5865.0000 -137.62786 -130.09871 7.52916 2.63249 -131.65558 932.98476
5870.0000 -138.73249 -131.08064 7.65185 2.71048 -130.48702 985.49684
5875.0000 -139.11472 -132.20911 6.90561 2.62111 -131.82614 941.33875
5880.0000 -138.52835 -131.90422 6.62413 2.61196 -131.96325 931.14799
5885.0000 -139.65047 -133.02978 6.62069 2.58071 -132.43142 907.13153
5890.0000 -140.60457 -133.57121 7.03336 2.51531 -133.41142 856.65331
5895.0000 -139.16045 -131.71117 7.44928 2.58166 -132.41721 907.50231
5900.0000 -137.80387 -131.05403 6.74985 2.67847 -130.96665 964.66466
5905.0000 -138.69505 -132.72104 5.97401 2.62062 -131.83352 941.16320
5910.0000 -137.05256 -130.13475 6.91781 2.61926 -131.85389 935.90294
5915.0000 -139.87131 -132.79956 7.07175 2.63499 -131.61811 951.82823
5920.0000 -138.13740 -131.52345 6.61395 2.60456 -132.07411 911.28423
5925.0000 -137.16102 -129.88478 7.27624 2.71883 -130.36197 957.00994
5930.0000 -137.89688 -131.89536 6.00152 2.67016 -131.09117 975.59995
5935.0000 -140.49940 -133.63570 6.86369 2.56116 -132.72439 923.49644
5940.0000 -139.71710 -132.43895 7.27815 2.50276 -133.59946 850.13765
5945.0000 -138.19542 -131.02334 7.17208 2.64712 -131.43639 963.22687
5950.0000 -137.81595 -130.60464 7.21131 2.65873 -131.26240 955.48822
5955.0000 -139.84139 -132.84300 6.99839 2.64126 -131.52426 955.49578
5960.0000 -140.28326 -134.21412 6.06915 2.54592 -132.95271 850.65586
5965.0000 -139.23995 -131.48177 7.75818 2.54857 -132.91302 893.58714
5970.0000 -138.41020 -131.32042 7.08977 2.60992 -131.99374 893.40560
5975.0000 -138.57067 -131.69883 6.87184 2.63909 -131.55666 931.22678
5980.0000 -137.20207 -131.98273 5.21934 2.63926 -131.55412 940.11859
5985.0000 -139.73529 -131.44725 8.28804 2.62718 -131.73518 914.76388
5990.0000 -137.88062 -130.25151 7.62912 2.70838 -130.51855 998.79013
5995.0000 -139.43291 -132.37075 7.06215 2.64920 -131.40515 939.93762
6000.0000 -139.17949 -130.90541 8.27408 2.63330 -131.64345 942.81269
MELTING PROCESS: loop number 25 T-loop= 940.00000000000000
main_MD> interactions number 25 at Temperature= 940.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.56150 2.98182 -0.45656
force_rgl> df(natom) -2.01087 -2.53735 0.86835
6005.0000 -138.18427 -130.62000 7.56428 2.66971 -131.09797 998.19293
6010.0000 -139.14728 -131.36869 7.77859 2.65825 -131.26955 955.32632
6015.0000 -138.81887 -132.57498 6.24390 2.57587 -132.50391 865.80632
6020.0000 -138.73113 -133.07514 5.65599 2.56976 -132.59551 890.28234
6025.0000 -138.47573 -130.16031 8.31541 2.59041 -132.28607 910.04378
6030.0000 -138.12524 -131.31814 6.80710 2.66645 -131.14669 948.67174
6035.0000 -137.57520 -130.67335 6.90185 2.66564 -131.15889 949.47643
6040.0000 -138.85761 -130.99791 7.85970 2.65422 -131.32997 931.06012
6045.0000 -137.71105 -132.10188 5.60916 2.67025 -131.08977 937.96519
6050.0000 -138.95379 -132.27911 6.67468 2.64276 -131.50167 927.76532
6055.0000 -137.59115 -130.90787 6.68328 2.66514 -131.16631 931.71256
6060.0000 -138.29260 -131.06258 7.23003 2.68262 -130.90444 962.73240
6065.0000 -138.40711 -129.41966 8.98745 2.73606 -130.10375 1011.95188
6070.0000 -139.48751 -131.96132 7.52619 2.70537 -130.56360 981.80507
6075.0000 -138.27910 -130.87068 7.40841 2.65092 -131.37943 963.27571
6080.0000 -138.43792 -130.91925 7.51867 2.66171 -131.21770 946.52538
6085.0000 -138.08507 -129.59181 8.49326 2.70224 -130.61055 974.74242
6090.0000 -137.32951 -130.28949 7.04002 2.74731 -129.93520 1021.45463
6095.0000 -139.06667 -132.47784 6.58883 2.62958 -131.69916 943.17349
6100.0000 -137.64864 -130.25904 7.38960 2.62238 -131.80712 906.79551
6105.0000 -138.34890 -131.90815 6.44075 2.64681 -131.44110 952.55537
6110.0000 -141.04108 -134.60721 6.43386 2.52567 -133.25609 872.57394
6115.0000 -137.95361 -130.18165 7.77196 2.58249 -132.40479 914.90310
6120.0000 -138.93954 -132.42430 6.51523 2.59023 -132.28876 899.91384
6125.0000 -139.99802 -132.91567 7.08235 2.62941 -131.70169 921.10603
6130.0000 -140.33027 -132.49633 7.83394 2.56165 -132.71702 854.15499
6135.0000 -138.89910 -132.94601 5.95308 2.50003 -133.64029 831.74842
6140.0000 -137.81972 -131.60367 6.21605 2.64672 -131.44233 955.85885
6145.0000 -138.91781 -132.60231 6.31549 2.61220 -131.95966 904.96834
6150.0000 -138.44270 -131.27734 7.16536 2.65736 -131.28289 950.56853
6155.0000 -138.00747 -131.50647 6.50100 2.65213 -131.36138 948.47150
6160.0000 -138.79180 -132.09831 6.69349 2.65736 -131.28292 971.19839
6165.0000 -137.61660 -131.62472 5.99188 2.61701 -131.88749 918.93744
6170.0000 -137.47824 -129.99562 7.48262 2.66924 -131.10489 937.87396
6175.0000 -138.04110 -131.63330 6.40781 2.67983 -130.94626 952.49985
6180.0000 -137.25829 -129.98524 7.27305 2.74069 -130.03430 1021.48268
6185.0000 -137.71556 -129.81250 7.90306 2.75176 -129.86857 1021.03926
6190.0000 -136.31187 -129.45208 6.85978 2.74441 -129.97861 991.74406
6195.0000 -138.75448 -129.88377 8.87071 2.75505 -129.81922 1010.71097
6200.0000 -138.99476 -132.34586 6.64890 2.74213 -130.01272 1008.04593
6205.0000 -140.12934 -134.45941 5.66993 2.55908 -132.75560 880.62889
6210.0000 -140.48583 -133.82698 6.65885 2.48372 -133.88467 820.34915
6215.0000 -138.48937 -131.36194 7.12742 2.54680 -132.93960 881.29320
6220.0000 -137.71922 -130.25972 7.45950 2.71367 -130.43920 1014.35756
6225.0000 -139.53744 -133.32571 6.21173 2.61506 -131.91670 911.84802
6230.0000 -138.17788 -131.73234 6.44554 2.54204 -133.01092 872.26999
6235.0000 -137.01037 -129.65738 7.35299 2.70345 -130.59234 977.57695
6240.0000 -138.82064 -130.23288 8.58776 2.77246 -129.55833 1049.64452
6245.0000 -139.46825 -130.99615 8.47210 2.66865 -131.11380 982.34374
6250.0000 -140.75067 -132.79727 7.95340 2.64794 -131.42404 958.34767
MELTING PROCESS: loop number 26 T-loop= 965.00000000000000
main_MD> interactions number 26 at Temperature= 965.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.75430 2.84272 -3.42639
force_rgl> df(natom) -3.80083 3.88014 -0.34274
6255.0000 -139.06453 -132.08258 6.98195 2.58571 -132.35659 895.76493
6260.0000 -138.38880 -131.34730 7.04151 2.62870 -131.71236 943.95728
6265.0000 -137.85661 -131.96811 5.88850 2.63869 -131.56267 942.54946
6270.0000 -138.62745 -129.41822 9.20923 2.67685 -130.99094 980.98438
6275.0000 -138.59713 -131.41226 7.18486 2.77155 -129.57196 1009.03443
6280.0000 -140.62684 -134.39086 6.23598 2.54403 -132.98110 869.89054
6285.0000 -138.41800 -132.41616 6.00183 2.52302 -133.29591 875.58738
6290.0000 -139.16197 -131.69197 7.47001 2.53378 -133.13468 884.51089
6295.0000 -138.61737 -132.25282 6.36455 2.65364 -131.33869 975.58190
6300.0000 -139.15722 -132.06103 7.09619 2.57998 -132.44239 898.90270
6305.0000 -138.09241 -130.71357 7.37884 2.60914 -132.00549 923.87211
6310.0000 -140.03197 -132.67488 7.35708 2.65182 -131.36602 961.06234
6315.0000 -141.23202 -132.71519 8.51683 2.53764 -133.07678 882.66129
6320.0000 -137.19833 -131.06551 6.13282 2.64559 -131.45924 924.77117
6325.0000 -138.89120 -131.38846 7.50274 2.66509 -131.16705 949.80628
6330.0000 -137.87394 -128.74046 9.13348 2.75206 -129.86400 996.26008
6335.0000 -137.69519 -129.41409 8.28110 2.78312 -129.39867 1067.36470
6340.0000 -138.36801 -130.63095 7.73706 2.74988 -129.89664 1008.07123
6345.0000 -138.99841 -132.27973 6.71868 2.65199 -131.36334 941.17428
6350.0000 -139.86074 -132.93998 6.92076 2.57883 -132.45965 896.94650
6355.0000 -138.39536 -131.57929 6.81606 2.57992 -132.44330 878.23236
6360.0000 -136.50818 -128.65537 7.85282 2.76899 -129.61039 1048.01678
6365.0000 -137.26154 -128.32464 8.93690 2.86398 -128.18697 1082.00337
6370.0000 -138.22168 -130.83864 7.38304 2.79831 -129.17098 1095.93849
6375.0000 -137.87742 -130.45057 7.42685 2.73475 -130.12341 985.75214
6380.0000 -137.93125 -131.25984 6.67141 2.64942 -131.40199 944.55560
6385.0000 -138.49564 -130.93517 7.56047 2.67518 -131.01600 961.94545
6390.0000 -138.72768 -131.56757 7.16011 2.69383 -130.73657 975.93861
6395.0000 -137.82996 -130.79571 7.03425 2.62670 -131.74230 935.18977
6400.0000 -138.50885 -131.62467 6.88418 2.66231 -131.20885 968.09671
6405.0000 -138.62448 -132.82034 5.80414 2.63531 -131.61340 942.69305
6410.0000 -138.59715 -132.20347 6.39368 2.52127 -133.32207 875.40556
6415.0000 -139.55562 -132.48145 7.07417 2.60860 -132.01351 924.28362
6420.0000 -137.99612 -131.58927 6.40685 2.62243 -131.80634 935.89667
6425.0000 -136.52370 -129.42839 7.09530 2.67594 -131.00456 966.71942
6430.0000 -136.90107 -129.67638 7.22469 2.77394 -129.53617 966.56782
6435.0000 -137.01605 -128.67840 8.33765 2.78242 -129.40908 1033.77410
6440.0000 -136.34443 -128.51460 7.82983 2.87035 -128.09154 1101.62896
6445.0000 -137.30304 -130.33811 6.96493 2.79165 -129.27073 1032.86346
6450.0000 -136.74654 -128.00611 8.74043 2.76213 -129.71316 983.25359
6455.0000 -136.42418 -128.28077 8.14340 2.84438 -128.48073 1085.32903
6460.0000 -137.00629 -129.57195 7.43434 2.83496 -128.62191 1072.84393
6465.0000 -136.18779 -128.72950 7.45830 2.82746 -128.73426 1036.75971
6470.0000 -137.09548 -129.40220 7.69328 2.85314 -128.34942 1040.86970
6475.0000 -137.68472 -130.39846 7.28626 2.72359 -130.29057 967.99689
6480.0000 -138.50563 -131.56266 6.94296 2.69281 -130.75173 987.47112
6485.0000 -136.94036 -128.74695 8.19340 2.73075 -130.18332 997.49825
6490.0000 -137.80654 -129.15865 8.64789 2.79698 -129.19098 1042.76615
6495.0000 -137.94960 -130.02356 7.92604 2.73542 -130.11328 1006.99518
6500.0000 -136.93523 -129.76362 7.17161 2.80438 -129.07998 1060.96422
MELTING PROCESS: loop number 27 T-loop= 990.00000000000000
main_MD> interactions number 27 at Temperature= 990.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -2.96291 -1.86135 1.61057
force_rgl> df(natom) -0.76171 1.10355 2.34189
6505.0000 -137.96936 -130.20036 7.76901 2.73470 -130.12417 1035.08277
6510.0000 -137.82002 -129.91868 7.90133 2.78694 -129.34137 1073.78750
6515.0000 -137.67053 -130.77571 6.89482 2.76143 -129.72359 1036.78918
6520.0000 -137.24405 -130.29951 6.94454 2.71767 -130.37930 1002.64812
6525.0000 -136.27786 -128.17873 8.09913 2.77818 -129.47259 1044.53151
6530.0000 -137.15173 -128.61489 8.53683 2.88495 -127.87279 1138.52177
6535.0000 -137.89411 -130.19275 7.70136 2.72251 -130.30684 998.19254
6540.0000 -138.19205 -130.41966 7.77239 2.75185 -129.86713 990.31470
6545.0000 -138.52486 -130.24303 8.28183 2.81595 -128.90665 1032.46199
6550.0000 -138.20355 -128.91799 9.28556 2.76815 -129.62292 1021.20403
6555.0000 -136.79706 -130.25792 6.53914 2.80347 -129.09367 1041.18607
6560.0000 -137.95409 -129.12375 8.83034 2.76832 -129.62034 1040.72026
6565.0000 -137.30988 -129.31744 7.99245 2.83976 -128.54989 1072.76832
6570.0000 -135.68350 -127.13678 8.54672 2.78364 -129.39085 1021.90815
6575.0000 -137.67042 -129.45925 8.21117 2.80137 -129.12510 1034.67081
6580.0000 -135.79587 -129.15212 6.64376 2.75767 -129.77999 982.12015
6585.0000 -138.56031 -131.30184 7.25847 2.72335 -130.29413 996.93169
6590.0000 -137.59214 -131.00981 6.58233 2.68086 -130.93082 985.52530
6595.0000 -138.57966 -130.10628 8.47338 2.74146 -130.02281 1009.56496
6600.0000 -135.98792 -128.31439 7.67353 2.80757 -129.03226 1077.01531
6605.0000 -138.42342 -130.21009 8.21333 2.80725 -129.03700 1026.86505
6610.0000 -136.67547 -128.66698 8.00849 2.77286 -129.55231 1018.88742
6615.0000 -138.91598 -130.77013 8.14585 2.75239 -129.85911 1048.21977
6620.0000 -138.40391 -131.50158 6.90233 2.67000 -131.09354 950.14712
6625.0000 -137.62408 -131.01654 6.60754 2.63033 -131.68795 944.98499
6630.0000 -138.46220 -130.50347 7.95872 2.71320 -130.44624 967.43458
6635.0000 -137.44475 -130.69150 6.75325 2.63015 -131.69064 909.61657
6640.0000 -137.73952 -129.94783 7.79169 2.68262 -130.90450 954.99571
6645.0000 -137.91413 -129.98723 7.92690 2.81650 -128.89851 1058.11960
6650.0000 -136.36263 -129.57728 6.78535 2.74247 -130.00774 982.47737
6655.0000 -138.49235 -130.28813 8.20422 2.72894 -130.21048 984.93989
6660.0000 -136.28616 -128.12698 8.15918 2.81344 -128.94424 1063.05349
6665.0000 -136.84740 -129.59162 7.25578 2.80365 -129.09097 1044.09406
6670.0000 -137.21760 -130.73444 6.48317 2.77779 -129.47844 1010.63155
6675.0000 -138.03119 -131.59003 6.44116 2.66505 -131.16776 966.87911
6680.0000 -137.82295 -130.69526 7.12769 2.72621 -130.25129 1007.59526
6685.0000 -137.42219 -129.60258 7.81961 2.71572 -130.40857 989.43252
6690.0000 -136.95192 -129.77716 7.17476 2.78028 -129.44114 1065.60972
6695.0000 -136.80143 -129.84032 6.96112 2.75115 -129.87769 1032.01150
6700.0000 -138.90773 -132.92004 5.98769 2.68683 -130.84132 966.32380
6705.0000 -140.11873 -132.54476 7.57397 2.59227 -132.25831 921.14795
6710.0000 -137.46732 -130.32476 7.14255 2.63861 -131.56397 949.51395
6715.0000 -137.76992 -131.05761 6.71231 2.68265 -130.90395 992.51335
6720.0000 -138.13393 -132.11441 6.01952 2.65318 -131.34557 916.28499
6725.0000 -139.30959 -131.75849 7.55110 2.67933 -130.95379 931.17642
6730.0000 -138.86410 -132.86072 6.00338 2.62814 -131.72071 909.96152
6735.0000 -138.69656 -130.93942 7.75714 2.65781 -131.27617 928.82035
6740.0000 -139.08246 -132.92226 6.16020 2.66330 -131.19393 946.13738
6745.0000 -139.88174 -132.93366 6.94807 2.60143 -132.12096 935.23399
6750.0000 -137.70713 -130.00752 7.69961 2.63951 -131.55034 939.51117
MELTING PROCESS: loop number 28 T-loop= 1015.0000000000000
main_MD> interactions number 28 at Temperature= 1015.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -5.87323 0.43147 3.75604
force_rgl> df(natom) 3.38450 4.44456 -0.79073
6755.0000 -138.17042 -129.67917 8.49125 2.72576 -130.25811 1046.14039
6760.0000 -135.92908 -128.78915 7.13993 2.73415 -130.13237 1022.34085
6765.0000 -138.55155 -131.64936 6.90218 2.77423 -129.53178 1043.41284
6770.0000 -138.40178 -130.91153 7.49025 2.71425 -130.43052 967.29303
6775.0000 -136.49533 -128.30253 8.19280 2.73915 -130.05751 966.70891
6780.0000 -134.80309 -127.86853 6.93456 2.81739 -128.88509 1050.32014
6785.0000 -135.76199 -128.57275 7.18925 2.84967 -128.40142 1079.94307
6790.0000 -134.13970 -126.46236 7.67734 2.89847 -127.67016 1105.77282
6795.0000 -136.02772 -129.42860 6.59913 2.85922 -128.25831 1056.98081
6800.0000 -137.62870 -129.73204 7.89667 2.76922 -129.60691 1014.11060
6805.0000 -137.54110 -128.61436 8.92674 2.80323 -129.09727 1038.73887
6810.0000 -137.11979 -128.79702 8.32277 2.85229 -128.36223 1077.02763
6815.0000 -137.15820 -129.51483 7.64337 2.78262 -129.40614 1044.52083
6820.0000 -137.88602 -130.03474 7.85128 2.74411 -129.98318 1041.59644
6825.0000 -138.17087 -130.96097 7.20990 2.67456 -131.02530 979.72016
6830.0000 -139.16759 -130.74439 8.42320 2.65961 -131.24926 952.53089
6835.0000 -137.73445 -130.29760 7.43684 2.70918 -130.50651 1020.82043
6840.0000 -138.45703 -131.01799 7.43904 2.65551 -131.31060 967.32733
6845.0000 -138.78084 -132.25102 6.52982 2.65624 -131.29969 981.78605
6850.0000 -137.21774 -131.53580 5.68194 2.60236 -132.10703 919.83461
6855.0000 -137.98825 -129.05619 8.93206 2.69025 -130.79020 964.17808
6860.0000 -136.14976 -129.13921 7.01055 2.79965 -129.15087 1042.39703
6865.0000 -139.25739 -132.18482 7.07257 2.66766 -131.12869 928.28811
6870.0000 -139.47519 -133.89303 5.58216 2.57791 -132.47340 881.99059
6875.0000 -138.81017 -131.93855 6.87161 2.55539 -132.81091 889.08530
6880.0000 -136.93106 -129.88423 7.04683 2.71198 -130.46457 1008.21373
6885.0000 -137.97224 -130.64732 7.32493 2.76592 -129.65637 1046.69255
6890.0000 -137.72695 -131.32026 6.40669 2.73105 -130.17884 982.17337
6895.0000 -138.26423 -131.23897 7.02526 2.67893 -130.95970 966.23840
6900.0000 -137.81825 -130.16536 7.65289 2.71187 -130.46627 1008.80159
6905.0000 -137.58556 -131.04500 6.54056 2.74554 -129.96167 1015.35538
6910.0000 -138.05057 -131.02226 7.02831 2.68097 -130.92913 954.71221
6915.0000 -138.01778 -130.42777 7.59001 2.68918 -130.80611 934.72523
6920.0000 -138.10062 -130.73072 7.36989 2.69607 -130.70297 977.00898
6925.0000 -138.46220 -131.54833 6.91387 2.66382 -131.18610 952.34387
6930.0000 -137.55915 -129.30395 8.25520 2.67904 -130.95814 1000.00696
6935.0000 -138.87189 -132.22122 6.65066 2.71381 -130.43707 1017.74341
6940.0000 -137.96160 -131.19101 6.77059 2.64599 -131.45336 939.85631
6945.0000 -134.64728 -127.58695 7.06032 2.78974 -129.29936 1056.67387
6950.0000 -134.11930 -127.92077 6.19852 2.88833 -127.82218 1086.99241
6955.0000 -137.43752 -129.42329 8.01423 2.84194 -128.51724 1055.85236
6960.0000 -138.21244 -131.74370 6.46874 2.67840 -130.96768 933.32804
6965.0000 -137.70606 -130.31980 7.38626 2.69821 -130.67085 985.04058
6970.0000 -139.40017 -132.42705 6.97313 2.61971 -131.84707 945.91321
6975.0000 -139.88735 -132.76505 7.12229 2.59125 -132.27356 921.70876
6980.0000 -139.84388 -131.82668 8.01720 2.54246 -133.00454 864.51640
6985.0000 -138.19607 -131.51859 6.67748 2.62347 -131.79080 926.10858
6990.0000 -138.28761 -129.48946 8.79815 2.72089 -130.33106 941.50740
6995.0000 -137.69196 -130.29889 7.39307 2.76776 -129.62881 1029.86906
7000.0000 -136.59631 -129.50295 7.09336 2.74382 -129.98752 978.37998
MELTING PROCESS: loop number 29 T-loop= 1040.0000000000000
main_MD> interactions number 29 at Temperature= 1040.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -2.59761 -1.07418 -4.61921
force_rgl> df(natom) 3.43823 0.25697 0.13629
7005.0000 -137.97180 -132.11691 5.85489 2.71066 -130.48439 995.58596
7010.0000 -138.96592 -132.72428 6.24164 2.59903 -132.15690 904.25767
7015.0000 -138.93395 -132.90149 6.03245 2.62535 -131.76262 915.11794
7020.0000 -137.21955 -131.35721 5.86234 2.58997 -132.29268 895.08839
7025.0000 -137.77359 -129.93501 7.83857 2.69743 -130.68255 964.97562
7030.0000 -137.88298 -129.53434 8.34864 2.77387 -129.53726 1007.21742
7035.0000 -136.77345 -128.62068 8.15278 2.84334 -128.49625 1102.18662
7040.0000 -136.95637 -127.67221 9.28416 2.83455 -128.62800 1107.56530
7045.0000 -136.31148 -126.74532 9.56616 2.93625 -127.10416 1131.58590
7050.0000 -136.79092 -129.29343 7.49749 2.83973 -128.55035 1066.35092
7055.0000 -135.70839 -129.01197 6.69642 2.75243 -129.85840 1021.84393
7060.0000 -137.28034 -128.68091 8.59943 2.85305 -128.35082 1088.15575
7065.0000 -134.99778 -126.76856 8.22921 2.88487 -127.87398 1115.09267
7070.0000 -134.57757 -125.45400 9.12358 2.97937 -126.45811 1177.55037
7075.0000 -137.56071 -128.98169 8.57902 2.86292 -128.20296 1087.78468
7080.0000 -136.64756 -129.07522 7.57234 2.84104 -128.53071 1076.48850
7085.0000 -136.07742 -128.14622 7.93120 2.79591 -129.20703 1032.55080
7090.0000 -136.56760 -128.99530 7.57230 2.87356 -128.04352 1119.03870
7095.0000 -138.09697 -128.90298 9.19398 2.82404 -128.78550 1100.62232
7100.0000 -136.60022 -129.16333 7.43689 2.77564 -129.51065 1001.78347
7105.0000 -138.36055 -130.04771 8.31284 2.77183 -129.56779 998.05881
7110.0000 -137.04171 -129.84629 7.19542 2.78531 -129.36582 1028.91303
7115.0000 -137.33257 -129.13051 8.20206 2.78636 -129.35012 1041.96219
7120.0000 -134.37415 -127.21675 7.15740 2.88115 -127.92972 1115.76574
7125.0000 -134.52714 -125.85131 8.67583 2.97400 -126.53845 1166.32354
7130.0000 -135.53296 -128.57973 6.95323 2.86176 -128.22031 1082.63058
7135.0000 -135.45790 -126.90319 8.55471 2.87751 -127.98434 1119.10853
7140.0000 -137.11991 -128.58715 8.53275 2.85160 -128.37259 1094.86220
7145.0000 -136.73331 -128.53585 8.19747 2.81911 -128.85942 1067.73339
7150.0000 -136.27121 -130.05416 6.21706 2.77332 -129.54550 1023.38175
7155.0000 -137.27582 -129.79524 7.48057 2.80812 -129.02397 1050.53279
7160.0000 -135.95103 -127.46782 8.48321 2.88928 -127.80794 1119.06757
7165.0000 -137.00428 -128.38428 8.62000 2.84562 -128.46213 1097.56789
7170.0000 -138.08207 -129.92353 8.15855 2.81256 -128.95749 1058.61020
7175.0000 -135.82782 -128.29185 7.53597 2.83400 -128.63617 1091.31732
7180.0000 -135.68940 -127.32323 8.36618 2.80749 -129.03343 1052.22607
7185.0000 -136.42409 -127.47543 8.94866 2.92230 -127.31311 1109.44820
7190.0000 -137.50814 -129.34422 8.16392 2.83926 -128.55735 1087.85402
7195.0000 -139.43910 -131.79803 7.64107 2.71828 -130.37011 984.91357
7200.0000 -138.60521 -130.46120 8.14401 2.60934 -132.00246 893.18948
7205.0000 -136.81645 -129.00970 7.80675 2.76464 -129.67554 1034.00990
7210.0000 -135.93158 -127.98334 7.94824 2.85404 -128.33602 1100.86776
7215.0000 -135.39663 -127.95484 7.44178 2.81775 -128.87971 1028.07918
7220.0000 -136.56022 -128.84300 7.71721 2.83509 -128.61983 1081.68614
7225.0000 -136.57852 -129.21227 7.36625 2.79369 -129.24021 1061.32398
7230.0000 -136.49515 -129.33147 7.16368 2.80771 -129.03012 1023.73813
7235.0000 -137.66253 -130.04669 7.61584 2.77581 -129.50810 1021.83916
7240.0000 -136.87488 -129.00494 7.86995 2.75180 -129.86790 1019.21561
7245.0000 -138.31483 -130.75776 7.55707 2.75626 -129.80113 1029.29205
7250.0000 -137.32083 -130.71428 6.60655 2.69847 -130.66700 1001.57302
MELTING PROCESS: loop number 30 T-loop= 1065.0000000000000
main_MD> interactions number 30 at Temperature= 1065.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.66315 0.28641 -1.33169
force_rgl> df(natom) 2.05118 -0.01384 0.40173
7255.0000 -137.09764 -128.57370 8.52395 2.84687 -128.44333 1140.44788
7260.0000 -134.93429 -127.40706 7.52723 2.87746 -127.98498 1093.78621
7265.0000 -138.05522 -130.59487 7.46035 2.77754 -129.48214 1078.79760
7270.0000 -135.96933 -129.22457 6.74476 2.72841 -130.21831 1002.84793
7275.0000 -137.84045 -130.37267 7.46779 2.75679 -129.79320 1006.91120
7280.0000 -138.83740 -131.65130 7.18611 2.74588 -129.95663 995.88625
7285.0000 -138.69342 -130.69008 8.00334 2.65531 -131.31363 925.54688
7290.0000 -137.01521 -128.91361 8.10160 2.75387 -129.83686 1029.01797
7295.0000 -137.95095 -130.01736 7.93359 2.82345 -128.79426 1093.70559
7300.0000 -137.30810 -129.83221 7.47589 2.73936 -130.05422 1005.83000
7305.0000 -138.91260 -130.87530 8.03730 2.66854 -131.11541 945.65072
7310.0000 -138.96345 -130.75160 8.21186 2.73213 -130.16270 989.42363
7315.0000 -137.74979 -130.96657 6.78322 2.66426 -131.17957 981.11777
7320.0000 -138.44706 -130.13998 8.30708 2.67660 -130.99462 936.12476
7325.0000 -137.67756 -130.01001 7.66755 2.75376 -129.83850 1011.72704
7330.0000 -137.26360 -129.77715 7.48645 2.71661 -130.39514 989.87202
7335.0000 -138.21131 -131.22837 6.98294 2.74982 -129.89761 1011.85770
7340.0000 -137.31019 -129.90252 7.40766 2.69699 -130.68909 974.29634
7345.0000 -137.43620 -129.67682 7.75938 2.72477 -130.27288 988.84388
7350.0000 -136.02943 -128.76844 7.26099 2.73149 -130.17225 989.33113
7355.0000 -135.34136 -128.04172 7.29963 2.83576 -128.60989 1034.45592
7360.0000 -136.54066 -128.94741 7.59325 2.81094 -128.98170 1059.94949
7365.0000 -138.04708 -129.15996 8.88712 2.85535 -128.31626 1091.85236
7370.0000 -136.77076 -128.85315 7.91761 2.85774 -128.28057 1068.92919
7375.0000 -136.68933 -128.99100 7.69833 2.79574 -129.20956 996.33237
7380.0000 -135.22725 -127.73056 7.49669 2.85420 -128.33354 1085.20114
7385.0000 -136.32653 -128.58586 7.74067 2.86158 -128.22300 1104.82724
7390.0000 -137.23526 -128.98877 8.24649 2.82448 -128.77888 1056.75511
7395.0000 -135.01063 -126.52205 8.48858 2.88998 -127.79750 1133.77941
7400.0000 -136.80508 -127.07120 9.73388 2.96487 -126.67527 1188.63466
7405.0000 -136.97749 -130.44660 6.53090 2.78519 -129.36766 1048.55591
7410.0000 -136.90297 -127.86666 9.03631 2.80688 -129.04252 1070.93226
7415.0000 -135.99120 -127.51129 8.47991 2.87722 -127.98861 1116.18285
7420.0000 -135.95443 -124.75853 11.19589 2.96685 -126.64566 1189.53132
7425.0000 -136.74444 -128.08947 8.65498 2.96607 -126.65729 1184.94981
7430.0000 -137.89369 -130.74631 7.14738 2.80791 -129.02723 1078.03532
7435.0000 -135.71905 -127.87234 7.84671 2.75112 -129.87808 1000.52725
7440.0000 -136.55592 -129.60719 6.94873 2.82043 -128.83956 1056.59782
7445.0000 -137.73184 -129.82457 7.90726 2.74348 -129.99262 1014.43151
7450.0000 -135.49578 -126.92543 8.57035 2.79567 -129.21052 1045.25523
7455.0000 -137.35117 -130.40781 6.94335 2.84448 -128.47923 1080.43210
7460.0000 -136.10516 -129.01782 7.08734 2.72790 -130.22607 973.38010
7465.0000 -135.05365 -124.91075 10.14290 2.98699 -126.34385 1151.82844
7470.0000 -136.04140 -127.42007 8.62133 2.98999 -126.29889 1207.11991
7475.0000 -138.37657 -130.23645 8.14012 2.76301 -129.69989 1023.26635
7480.0000 -136.99358 -129.62945 7.36413 2.73889 -130.06132 989.97853
7485.0000 -137.70029 -129.31662 8.38367 2.81996 -128.84654 1036.41366
7490.0000 -137.59248 -129.93799 7.65449 2.78055 -129.43717 1028.75501
7495.0000 -135.84284 -127.67817 8.16467 2.81050 -128.98840 1050.11444
7500.0000 -136.53501 -129.47716 7.05785 2.83577 -128.60974 1087.02988
MELTING PROCESS: loop number 31 T-loop= 1090.0000000000000
main_MD> interactions number 31 at Temperature= 1090.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.20992 -1.16422 -4.66657
force_rgl> df(natom) -0.54783 2.03472 0.35309
7505.0000 -134.49759 -126.92076 7.57682 2.86312 -128.19990 1102.49165
7510.0000 -137.24801 -127.91188 9.33613 2.88259 -127.90816 1096.76448
7515.0000 -137.11310 -129.58797 7.52512 2.85840 -128.27066 1145.40124
7520.0000 -137.47465 -129.21805 8.25660 2.81202 -128.96563 1062.50068
7525.0000 -136.85479 -127.42099 9.43380 2.88980 -127.80012 1184.36350
7530.0000 -138.20009 -130.33455 7.86554 2.84123 -128.52787 1026.10746
7535.0000 -137.66688 -130.20544 7.46144 2.73588 -130.10637 960.17226
7540.0000 -137.14587 -128.85027 8.29560 2.81863 -128.86661 1059.22859
7545.0000 -135.00238 -126.35137 8.65100 2.89447 -127.73017 1123.51085
7550.0000 -136.34434 -127.58126 8.76308 2.90474 -127.57631 1110.79780
7555.0000 -136.03400 -129.11533 6.91867 2.87166 -128.07201 1138.64333
7560.0000 -136.37966 -127.80916 8.57050 2.85675 -128.29535 1088.74765
7565.0000 -138.44027 -131.02222 7.41806 2.82161 -128.82190 1059.68902
7570.0000 -136.57209 -128.27734 8.29475 2.74012 -130.04285 999.31534
7575.0000 -136.65148 -127.79762 8.85387 2.83509 -128.61991 1085.38799
7580.0000 -136.13766 -128.16440 7.97327 2.89091 -127.78356 1137.89373
7585.0000 -138.09938 -129.97262 8.12676 2.80192 -129.11697 1060.33907
7590.0000 -136.96457 -129.90375 7.06082 2.74071 -130.03407 975.01230
7595.0000 -137.15150 -129.57624 7.57525 2.70867 -130.51413 984.16794
7600.0000 -136.66416 -127.42836 9.23581 2.93221 -127.16472 1168.13942
7605.0000 -136.49734 -128.46074 8.03660 2.87440 -128.03091 1110.92909
7610.0000 -135.97206 -127.99896 7.97310 2.87578 -128.01028 1097.58579
7615.0000 -135.15404 -127.35937 7.79467 2.92157 -127.32405 1123.82373
7620.0000 -137.76494 -129.57637 8.18857 2.83367 -128.64125 1071.39253
7625.0000 -136.87729 -127.82934 9.04795 2.87160 -128.07282 1056.78181
7630.0000 -136.36563 -127.75217 8.61346 2.95414 -126.83615 1118.04380
7635.0000 -135.02171 -127.00774 8.01398 2.88094 -127.93291 1111.14322
7640.0000 -134.60987 -126.96527 7.64460 2.91107 -127.48139 1109.60737
7645.0000 -133.06093 -123.63377 9.42715 3.03008 -125.69816 1188.76277
7650.0000 -134.25541 -126.25994 7.99547 3.12356 -124.29762 1275.46169
7655.0000 -134.70674 -127.94546 6.76128 2.91865 -127.36791 1141.74871
7660.0000 -136.19295 -127.48438 8.70857 2.84198 -128.51670 1033.92335
7665.0000 -135.39039 -128.26490 7.12549 2.83739 -128.58543 1070.16734
7670.0000 -135.81854 -127.85671 7.96183 2.95740 -126.78720 1135.27528
7675.0000 -136.89457 -129.23576 7.65881 2.82177 -128.81949 1088.53465
7680.0000 -138.79984 -130.83801 7.96183 2.73676 -130.09320 985.91964
7685.0000 -135.67557 -127.12226 8.55331 2.81529 -128.91662 1065.57224
7690.0000 -138.31798 -129.36204 8.95594 2.85053 -128.38852 1105.18981
7695.0000 -136.85341 -129.40114 7.45226 2.77869 -129.46491 1043.86045
7700.0000 -136.34736 -129.72321 6.62415 2.79138 -129.27484 1058.83220
7705.0000 -135.88378 -127.66531 8.21847 2.79392 -129.23674 1067.04725
7710.0000 -136.93960 -126.87574 10.06385 2.91705 -127.39183 1140.60807
7715.0000 -135.54288 -126.69086 8.85202 3.00192 -126.12024 1193.91393
7720.0000 -136.18417 -127.90429 8.27988 3.00923 -126.01063 1208.78523
7725.0000 -134.60035 -126.17665 8.42369 2.95284 -126.85556 1146.38703
7730.0000 -135.59523 -126.37892 9.21632 2.97685 -126.49588 1177.46344
7735.0000 -135.18832 -127.16616 8.02215 2.97042 -126.59216 1206.02723
7740.0000 -135.74699 -126.11551 9.63148 2.99859 -126.17003 1193.13461
7745.0000 -135.48484 -127.60303 7.88181 2.98133 -126.42864 1177.03132
7750.0000 -134.26101 -125.98316 8.27785 2.90153 -127.62442 1083.35763
MELTING PROCESS: loop number 32 T-loop= 1115.0000000000000
main_MD> interactions number 32 at Temperature= 1115.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -2.71153 2.83029 2.66251
force_rgl> df(natom) -1.57454 -2.07943 -2.47480
7755.0000 -135.96512 -127.61129 8.35383 2.99345 -126.24713 1161.42377
7760.0000 -138.95053 -131.47633 7.47420 2.75693 -129.79109 1006.66434
7765.0000 -138.50057 -131.22024 7.28033 2.70933 -130.50431 985.78641
7770.0000 -135.89755 -127.39245 8.50510 2.81065 -128.98607 1050.16234
7775.0000 -136.23412 -126.39848 9.83563 2.97232 -126.56370 1165.36172
7780.0000 -136.76030 -128.90704 7.85326 2.88212 -127.91526 1114.65249
7785.0000 -135.65147 -129.03888 6.61259 2.80439 -129.07984 1072.25864
7790.0000 -136.42893 -127.56863 8.86029 2.90599 -127.55749 1165.78845
7795.0000 -136.89352 -127.51731 9.37620 2.91040 -127.49154 1136.31627
7800.0000 -136.91540 -128.64514 8.27026 2.88151 -127.92431 1093.42847
7805.0000 -134.84380 -126.60258 8.24123 2.86035 -128.24147 1082.64891
7810.0000 -134.38079 -125.93519 8.44560 2.97805 -126.47779 1149.89845
7815.0000 -137.80884 -128.56286 9.24598 2.90851 -127.51975 1168.56127
7820.0000 -137.47214 -129.30912 8.16303 2.77359 -129.54139 1011.85275
7825.0000 -134.83102 -126.89244 7.93858 2.85407 -128.33552 1092.36151
7830.0000 -135.82514 -127.83746 7.98768 2.97522 -126.52029 1135.24322
7835.0000 -136.13807 -128.40310 7.73497 2.85998 -128.24693 1112.76826
7840.0000 -137.42712 -129.41734 8.00978 2.78953 -129.30249 1042.55173
7845.0000 -136.14098 -128.06754 8.07344 2.91642 -127.40130 1138.09988
7850.0000 -137.54455 -128.95929 8.58526 2.77099 -129.58029 1013.55030
7855.0000 -136.56040 -129.25218 7.30822 2.79909 -129.15924 1056.16592
7860.0000 -135.64993 -126.89223 8.75771 2.82502 -128.77081 1075.99699
7865.0000 -136.87465 -128.09714 8.77751 2.89135 -127.77693 1115.28504
7870.0000 -138.85032 -130.51660 8.33373 2.81994 -128.84697 1064.43477
7875.0000 -136.22047 -127.45998 8.76048 2.80635 -129.05050 1029.64471
7880.0000 -136.28935 -127.99419 8.29515 2.90800 -127.52749 1139.92538
7885.0000 -136.20825 -127.45710 8.75116 2.91778 -127.38097 1101.24485
7890.0000 -137.41643 -129.72734 7.68909 2.85502 -128.32125 1085.09377
7895.0000 -136.09633 -126.31681 9.77952 2.87419 -128.03398 1123.23092
7900.0000 -137.39687 -130.68253 6.71433 2.79272 -129.25476 1013.97886
7905.0000 -136.79596 -130.24580 6.55016 2.69872 -130.66317 963.12541
7910.0000 -136.00881 -128.38261 7.62620 2.87735 -127.98672 1069.63712
7915.0000 -137.09299 -128.95036 8.14263 2.85245 -128.35971 1074.89278
7920.0000 -135.55855 -125.26431 10.29425 2.94131 -127.02832 1138.20588
7925.0000 -137.85159 -129.84969 8.00190 2.92221 -127.31446 1175.39396
7930.0000 -136.10884 -127.63871 8.47013 2.80207 -129.11471 1049.21051
7935.0000 -136.17824 -127.95139 8.22685 2.87874 -127.96592 1130.47295
7940.0000 -138.32789 -130.24377 8.08412 2.77795 -129.47604 1048.33664
7945.0000 -136.24847 -128.74228 7.50619 2.83856 -128.56788 1055.39667
7950.0000 -134.83726 -127.75335 7.08391 2.86197 -128.21715 1098.52289
7955.0000 -136.70630 -127.91955 8.78675 2.90578 -127.56077 1149.49842
7960.0000 -135.82596 -125.01019 10.81578 2.93927 -127.05894 1143.84586
7965.0000 -135.96323 -125.39862 10.56461 3.06382 -125.19273 1237.35548
7970.0000 -135.52920 -125.75220 9.77701 3.06145 -125.22822 1240.45114
7975.0000 -135.93169 -128.02660 7.90509 2.90961 -127.50337 1153.82901
7980.0000 -136.21876 -126.04033 10.17843 2.95816 -126.77580 1173.78790
7985.0000 -136.85157 -126.78078 10.07079 2.98328 -126.39940 1207.45976
7990.0000 -134.46415 -124.31457 10.14959 3.00163 -126.12453 1224.57421
7995.0000 -136.29531 -127.98833 8.30698 2.93569 -127.11250 1140.60432
8000.0000 -136.85673 -128.29357 8.56316 2.83042 -128.68993 1081.96362
MELTING PROCESS: loop number 33 T-loop= 1140.0000000000000
main_MD> interactions number 33 at Temperature= 1140.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.66876 -0.04837 2.84108
force_rgl> df(natom) -1.17137 -0.50785 -1.61733
8005.0000 -138.44428 -129.19515 9.24913 2.82295 -128.80181 1085.77303
8010.0000 -137.10165 -129.55206 7.54958 2.76645 -129.64844 1032.02057
8015.0000 -134.81389 -127.40190 7.41199 2.90065 -127.63752 1104.63664
8020.0000 -136.26081 -127.58044 8.68037 2.85727 -128.28758 1085.08665
8025.0000 -137.35382 -128.64214 8.71168 2.86731 -128.13715 1087.27506
8030.0000 -135.83143 -127.29600 8.53543 2.91326 -127.44857 1107.58366
8035.0000 -133.83496 -124.98884 8.84611 2.96439 -126.68245 1175.85248
8040.0000 -135.01433 -125.49774 9.51659 2.99427 -126.23478 1202.75594
8045.0000 -135.30766 -126.55073 8.75693 2.97835 -126.47335 1183.50307
8050.0000 -136.87599 -127.89480 8.98120 2.93548 -127.11570 1154.82812
8055.0000 -136.82883 -128.97141 7.85743 2.83370 -128.64080 1086.86685
8060.0000 -135.63341 -127.49507 8.13834 2.84103 -128.53096 1121.85165
8065.0000 -133.72398 -126.11611 7.60787 2.98432 -126.38384 1168.12299
8070.0000 -135.13592 -125.15077 9.98515 3.03346 -125.64752 1178.74071
8075.0000 -135.71475 -127.17308 8.54168 2.98833 -126.32384 1186.10959
8080.0000 -134.15577 -125.33876 8.81701 3.03768 -125.58436 1266.93917
8085.0000 -133.71102 -124.88094 8.83008 3.04593 -125.46079 1247.19358
8090.0000 -134.92542 -126.34855 8.57687 3.00566 -126.06406 1198.57747
8095.0000 -134.86636 -125.78417 9.08219 3.07474 -125.02908 1244.60327
8100.0000 -135.43360 -127.18487 8.24873 3.00810 -126.02752 1243.43081
8105.0000 -135.26759 -127.19776 8.06983 2.87586 -128.00906 1116.50969
8110.0000 -136.98622 -128.58196 8.40426 2.94640 -126.95211 1138.05704
8115.0000 -135.27716 -127.37176 7.90539 2.84874 -128.41541 1088.07636
8120.0000 -136.27385 -128.82697 7.44688 2.88441 -127.88090 1136.04325
8125.0000 -134.63173 -124.79920 9.83253 2.94173 -127.02208 1178.31242
8130.0000 -135.43925 -126.54595 8.89329 3.03315 -125.65230 1211.92976
8135.0000 -137.11605 -128.05134 9.06471 2.97256 -126.56008 1180.60196
8140.0000 -134.89215 -127.62843 7.26372 2.88333 -127.89714 1118.68337
8145.0000 -134.15921 -126.31629 7.84292 2.94775 -126.93180 1137.95515
8150.0000 -134.22617 -125.35304 8.87313 3.05914 -125.26284 1198.29095
8155.0000 -136.85706 -127.11559 9.74147 2.97605 -126.50777 1204.83859
8160.0000 -136.50417 -127.63271 8.87146 2.90258 -127.60860 1167.32814
8165.0000 -135.82305 -127.35239 8.47066 2.86916 -128.10939 1131.05062
8170.0000 -134.21273 -124.47192 9.74081 2.97778 -126.48195 1158.11590
8175.0000 -134.07560 -126.58606 7.48954 2.99654 -126.20073 1174.27202
8180.0000 -135.27505 -125.89618 9.37888 2.98687 -126.34573 1171.63484
8185.0000 -135.92116 -128.41046 7.51070 2.91287 -127.45448 1131.94122
8190.0000 -136.53204 -129.30523 7.22681 2.87040 -128.09087 1097.06142
8195.0000 -137.95981 -129.26297 8.69684 2.81629 -128.90155 1041.77654
8200.0000 -135.26911 -126.27124 8.99787 2.82115 -128.82878 1087.14336
8205.0000 -138.86223 -130.28306 8.57917 2.77123 -129.57679 1060.47443
8210.0000 -136.57096 -128.49191 8.07905 2.80436 -129.08040 1074.24771
8215.0000 -136.14805 -128.02024 8.12780 2.82583 -128.75861 1120.62024
8220.0000 -136.76985 -127.77737 8.99248 2.90834 -127.52241 1127.25949
8225.0000 -134.31882 -126.79105 7.52777 2.87960 -127.95302 1078.70607
8230.0000 -137.32927 -129.62845 7.70083 2.90200 -127.61732 1087.49409
8235.0000 -137.34070 -128.98469 8.35601 2.77285 -129.55252 1033.93659
8240.0000 -136.14753 -128.13369 8.01383 2.80106 -129.12980 1065.58047
8245.0000 -136.16480 -128.77503 7.38977 2.83407 -128.63518 1089.54519
8250.0000 -135.57496 -126.61634 8.95862 2.98603 -126.35820 1232.23475
MELTING PROCESS: loop number 34 T-loop= 1165.0000000000000
main_MD> interactions number 34 at Temperature= 1165.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.28315 -2.70754 -3.76200
force_rgl> df(natom) -1.00719 -3.03979 0.78007
8255.0000 -134.92272 -127.34191 7.58080 2.95104 -126.88257 1160.31580
8260.0000 -136.71971 -129.01545 7.70426 2.88357 -127.89350 1130.45943
8265.0000 -137.14860 -128.76355 8.38506 2.81631 -128.90132 1037.02288
8270.0000 -135.07537 -127.89600 7.17937 2.86163 -128.22218 1112.84406
8275.0000 -135.05499 -127.61408 7.44090 2.88258 -127.90831 1117.30007
8280.0000 -135.39616 -125.87987 9.51629 2.92156 -127.32419 1129.71700
8285.0000 -135.92103 -125.63219 10.28885 2.94181 -127.02090 1112.00716
8290.0000 -134.71710 -126.82382 7.89329 2.97568 -126.51329 1192.66281
8295.0000 -135.36778 -127.23919 8.12859 2.94769 -126.93267 1145.66435
8300.0000 -136.61052 -129.17826 7.43225 2.94527 -126.96901 1128.02533
8305.0000 -136.23830 -127.21420 9.02410 2.87778 -127.98023 1110.62769
8310.0000 -136.33058 -127.47028 8.86031 2.90288 -127.60418 1117.09705
8315.0000 -135.84315 -127.06149 8.78166 2.93352 -127.14511 1146.04965
8320.0000 -135.33920 -126.48243 8.85677 2.93080 -127.18583 1158.26445
8325.0000 -135.87319 -126.85861 9.01457 3.01251 -125.96153 1229.70293
8330.0000 -135.00275 -126.86316 8.13959 2.98958 -126.30508 1201.65177
8335.0000 -136.34942 -127.62003 8.72939 2.91915 -127.36033 1138.40813
8340.0000 -136.33326 -127.60149 8.73177 2.90503 -127.57192 1136.37311
8345.0000 -132.81376 -125.06454 7.74922 2.89331 -127.74754 1094.26683
8350.0000 -135.01841 -126.06763 8.95078 3.01866 -125.86939 1213.58268
8355.0000 -134.71497 -124.00060 10.71437 3.02886 -125.71647 1216.21908
8360.0000 -132.05851 -121.08279 10.97571 3.34023 -121.05107 1446.28140
8365.0000 -131.52034 -120.67415 10.84619 3.36261 -120.71568 1487.00060
8370.0000 -132.65734 -123.84443 8.81291 3.19548 -123.21990 1304.46369
8375.0000 -134.79929 -126.09884 8.70045 3.12120 -124.33286 1257.89145
8380.0000 -134.47638 -126.19348 8.28290 2.96524 -126.66981 1157.74816
8385.0000 -134.40891 -125.51661 8.89230 3.00245 -126.11224 1182.06978
8390.0000 -133.10493 -125.21193 7.89301 3.08049 -124.94287 1216.24964
8395.0000 -134.59134 -125.53901 9.05233 3.04101 -125.53451 1217.04964
8400.0000 -136.37403 -127.17407 9.19996 3.00576 -126.06265 1166.53926
8405.0000 -135.50544 -126.51488 8.99056 3.00395 -126.08972 1192.55779
8410.0000 -134.55491 -126.33359 8.22132 2.97432 -126.53372 1188.01192
8415.0000 -135.48114 -126.49260 8.98854 2.96558 -126.66465 1182.45683
8420.0000 -135.58378 -126.42429 9.15949 2.94093 -127.03396 1157.65349
8425.0000 -134.00403 -124.17823 9.82581 3.02923 -125.71098 1219.88456
8430.0000 -135.57598 -125.71704 9.85894 3.11750 -124.38843 1311.48172
8435.0000 -137.00458 -127.18710 9.81748 2.98371 -126.39307 1198.98799
8440.0000 -134.35669 -126.57807 7.77862 2.99636 -126.20349 1196.92271
8445.0000 -136.90406 -126.61875 10.28530 3.02918 -125.71170 1209.37263
8450.0000 -135.84627 -126.40690 9.43937 2.95170 -126.87264 1174.72557
8455.0000 -134.17647 -126.90121 7.27527 2.98024 -126.44505 1173.67374
8460.0000 -134.49076 -124.81279 9.67797 2.93712 -127.09117 1110.25525
8465.0000 -134.61932 -125.94837 8.67095 3.09780 -124.68352 1257.30447
8470.0000 -135.98431 -127.88555 8.09876 2.96055 -126.74012 1168.03628
8475.0000 -135.67368 -126.33982 9.33386 2.98415 -126.38648 1197.99405
8480.0000 -134.00691 -124.15324 9.85367 3.07213 -125.06818 1232.93315
8485.0000 -133.84531 -125.92477 7.92053 3.06913 -125.11309 1246.41218
8490.0000 -135.67741 -125.60015 10.07726 2.95461 -126.82902 1163.66042
8495.0000 -135.57725 -127.01684 8.56041 3.01645 -125.90250 1183.70175
8500.0000 -134.54670 -126.11688 8.42983 2.96333 -126.69844 1165.30576
MELTING PROCESS: loop number 35 T-loop= 1190.0000000000000
main_MD> interactions number 35 at Temperature= 1190.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -2.59661 0.94851 -0.23709
force_rgl> df(natom) -2.54999 0.45437 -0.00362
8505.0000 -135.62742 -125.08905 10.53837 3.03392 -125.64069 1224.88102
8510.0000 -135.19364 -127.34817 7.84547 3.00200 -126.11894 1179.32716
8515.0000 -137.02793 -127.54303 9.48490 2.86999 -128.09694 1097.47785
8520.0000 -134.49161 -126.94896 7.54265 2.89129 -127.77784 1125.36596
8525.0000 -133.83180 -125.43271 8.39909 2.99928 -126.15966 1174.77317
8530.0000 -134.27431 -126.92179 7.35253 2.99516 -126.22151 1167.58313
8535.0000 -134.73389 -125.99979 8.73409 2.99653 -126.20098 1180.78253
8540.0000 -136.79780 -124.35966 12.43814 3.08393 -124.89135 1227.31026
8545.0000 -136.26615 -126.10784 10.15831 3.08044 -124.94361 1273.53519
8550.0000 -135.72398 -126.96746 8.75652 2.99813 -126.17697 1210.14361
8555.0000 -135.61386 -126.75128 8.86259 2.94805 -126.92731 1155.84448
8560.0000 -136.01822 -128.23804 7.78019 2.89328 -127.74795 1101.30344
8565.0000 -135.92797 -128.93398 6.99399 2.86124 -128.22806 1111.25379
8570.0000 -135.98365 -127.12901 8.85464 2.88868 -127.81690 1146.37203
8575.0000 -135.48586 -127.76596 7.71990 2.93726 -127.08909 1115.00339
8580.0000 -135.85629 -126.82247 9.03382 2.91939 -127.35681 1127.64871
8585.0000 -135.46851 -125.42596 10.04255 2.99564 -126.21431 1219.53110
8590.0000 -133.85690 -125.17749 8.67941 3.08532 -124.87059 1285.23488
8595.0000 -135.51634 -124.99757 10.51877 3.00573 -126.06315 1211.37953
8600.0000 -134.78824 -125.56799 9.22025 3.06226 -125.21604 1241.98651
8605.0000 -132.73517 -124.39193 8.34323 3.09044 -124.79380 1276.88402
8610.0000 -136.91515 -126.75270 10.16246 2.97755 -126.48525 1172.21871
8615.0000 -137.33286 -128.44504 8.88782 2.94726 -126.93917 1158.49432
8620.0000 -137.50432 -128.00330 9.50102 2.88903 -127.81163 1117.31633
8625.0000 -135.81599 -127.58235 8.23364 2.87141 -128.07569 1085.48368
8630.0000 -136.22041 -126.97589 9.24453 2.92470 -127.27718 1144.36227
8635.0000 -134.97202 -125.48992 9.48211 3.03349 -125.64716 1188.18600
8640.0000 -134.16159 -124.66939 9.49220 3.00171 -126.12330 1186.76720
8645.0000 -134.90572 -126.25957 8.64615 3.11055 -124.49246 1275.59708
8650.0000 -137.05822 -126.88700 10.17122 2.94459 -126.97914 1141.64286
8655.0000 -134.48055 -125.41895 9.06160 3.00255 -126.11071 1179.16533
8660.0000 -136.81823 -127.05355 9.76469 2.98182 -126.42139 1176.06079
8665.0000 -133.67823 -126.20649 7.47174 2.93027 -127.19380 1158.88915
8670.0000 -135.46269 -126.14492 9.31777 3.02086 -125.83646 1173.32232
8675.0000 -136.82415 -129.12385 7.70030 2.93563 -127.11339 1162.52776
8680.0000 -135.55783 -126.39899 9.15884 2.91850 -127.37011 1127.63787
8685.0000 -135.94405 -127.12567 8.81838 3.01673 -125.89825 1214.54669
8690.0000 -137.18240 -127.75983 9.42257 3.00153 -126.12604 1219.92478
8695.0000 -134.61405 -127.52778 7.08627 2.91727 -127.38855 1140.72169
8700.0000 -136.63330 -128.21507 8.41822 2.91425 -127.43384 1122.34408
8705.0000 -136.84562 -128.50477 8.34085 2.89668 -127.69699 1136.31609
8710.0000 -134.24494 -125.20477 9.04017 2.98537 -126.36816 1209.69295
8715.0000 -134.47370 -124.42244 10.05126 3.10573 -124.56473 1266.25278
8720.0000 -135.49583 -124.53472 10.96111 3.10953 -124.50781 1276.40902
8725.0000 -131.86692 -122.71508 9.15184 3.05570 -125.31440 1255.45446
8730.0000 -134.41007 -124.13255 10.27753 3.12719 -124.24317 1295.02765
8735.0000 -133.74330 -123.67028 10.07302 3.14770 -123.93592 1279.00011
8740.0000 -134.86647 -125.00287 9.86360 3.11311 -124.45409 1243.81816
8745.0000 -133.29888 -124.58920 8.70969 3.13607 -124.11011 1284.91971
8750.0000 -132.91767 -122.72873 10.18894 3.14734 -123.94124 1319.25055
main_MD> EXECUTION TIME: 0 [day], 0 [hour], 12 [min], 22.0281586 [s].
main_MD> Deallocating global variables
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