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nanoparticlesims/growth_Melting_Silver_ICO_3269/meltingSims/run_21/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_21.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 = 21 ntipo2 = 0
read_input> Finish reading input
main_MD> Allocating global variables
main_MD> Number of outputs that will be created: 1850
main_MD> Size of nv and nvoiz: 21 2100
main_MD> Size of nv and nvoiz: 21 2100
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 = 21
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> -7.3287576670271359E-002 -4.3135673967826041E-002 2.3371530872706797E-002 initial drift of cluster / NP1 for coalescence
init> 0.35931047414213685 0.37804966423326480 0.27920645050355952 scaling for velocity /for coalescence NP1
init.f90 > facguy = 1.7804466310544181E-003
preparo> IN BIGVOI : LIMIT 1.2247448652052084 1.2247448652052084 1.2247448652052084
preparo> END t=0 TIME STEP
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.35841 1.90866 0.67893
force_rgl> df(natom) 0.37108 0.74364 3.28529
preparo> THERMALIZATION PROCESS AT 276.84122861749830
preparo> TOTAL ENERGY, KINETIC EN., POT. ENERGY, DELTA
5000 -49.504992264892905 0.64107784812491797 -50.146070113017821 3.7579317371790472E-004
preparo> END THERMALISATION ON NPAST DEFINE IN PARACLUSTER MODULE
main_MD> Time-loop is starting for melting
main_MD> Now the computation of EXECUTION TIME starts
main_MD> Running from loop 1 to 37
MELTING PROCESS: loop number 1 T-loop= 300.00000000000000
main_MD> interactions number 1 at Temperature= 300.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.07186 1.68600 -0.03314
force_rgl> df(natom) -0.81998 -0.39591 -0.41084
5.0000 -49.92432 -49.32650 0.59782 1.63183 -49.52908 265.71611
10.0000 -50.02978 -49.28235 0.74743 1.65269 -49.37032 297.92161
15.0000 -50.28649 -49.51578 0.77072 1.67183 -49.22462 321.71421
20.0000 -50.13114 -49.28489 0.84625 1.65297 -49.36813 295.41569
25.0000 -49.83600 -49.03554 0.80046 1.65885 -49.32337 310.58947
30.0000 -50.31825 -49.67764 0.64061 1.62812 -49.55731 258.28440
35.0000 -50.35085 -49.64307 0.70778 1.61499 -49.65722 245.80816
40.0000 -50.07604 -49.27728 0.79876 1.64858 -49.40153 293.22006
45.0000 -50.44076 -49.69744 0.74332 1.64813 -49.40502 292.13810
50.0000 -50.07859 -49.36088 0.71771 1.63420 -49.51099 278.15390
55.0000 -50.15384 -49.19954 0.95430 1.66553 -49.27258 312.55966
60.0000 -49.97387 -49.11782 0.85605 1.67515 -49.19931 305.79153
65.0000 -50.06470 -49.33220 0.73250 1.65891 -49.32292 290.68276
70.0000 -49.96453 -49.02765 0.93688 1.67512 -49.19952 318.99331
75.0000 -50.11594 -49.57244 0.54349 1.66142 -49.30383 306.61605
80.0000 -50.39822 -49.81786 0.58036 1.62963 -49.54581 272.09602
85.0000 -50.31618 -49.68774 0.62844 1.62662 -49.56869 262.26039
90.0000 -50.18496 -49.50667 0.67830 1.64692 -49.41423 287.41272
95.0000 -50.37021 -49.52163 0.84858 1.62473 -49.58310 277.13434
100.0000 -50.07673 -49.34553 0.73121 1.65627 -49.34300 302.84829
105.0000 -49.94302 -49.06909 0.87393 1.68976 -49.08809 348.97375
110.0000 -50.25941 -49.65432 0.60509 1.67639 -49.18987 338.92823
115.0000 -50.18493 -49.57906 0.60588 1.61026 -49.69326 239.96970
120.0000 -50.27168 -49.55929 0.71239 1.63617 -49.49599 291.03141
125.0000 -50.36342 -49.79428 0.56914 1.63066 -49.53799 276.88484
130.0000 -50.38891 -49.71834 0.67057 1.61149 -49.68386 246.23020
135.0000 -50.30453 -49.66167 0.64286 1.61387 -49.66573 246.72514
140.0000 -50.30454 -49.55026 0.75429 1.63426 -49.51059 277.37348
145.0000 -50.35588 -49.50985 0.84604 1.63094 -49.53586 282.81657
150.0000 -49.97687 -49.30778 0.66910 1.67359 -49.21121 323.74140
155.0000 -50.06810 -49.14036 0.92775 1.68105 -49.15445 346.67610
160.0000 -49.86104 -49.11672 0.74433 1.68788 -49.10245 358.90132
165.0000 -49.76035 -48.96939 0.79096 1.70298 -48.98746 332.61114
170.0000 -49.75908 -48.75730 1.00178 1.72836 -48.79428 388.98594
175.0000 -49.82087 -48.94082 0.88005 1.72229 -48.84050 375.05144
180.0000 -50.19438 -49.11244 1.08194 1.68532 -49.12190 333.34630
185.0000 -49.70874 -48.87782 0.83092 1.70521 -48.97050 354.80814
190.0000 -50.09228 -49.34007 0.75221 1.69186 -49.07215 356.21972
195.0000 -49.88929 -48.98110 0.90819 1.67527 -49.19838 318.46531
200.0000 -50.19758 -49.44450 0.75308 1.66517 -49.27526 301.28773
205.0000 -50.08370 -49.43177 0.65193 1.63579 -49.49894 272.28609
210.0000 -50.09058 -49.31366 0.77692 1.65198 -49.37571 296.29484
215.0000 -50.23826 -49.57255 0.66571 1.63041 -49.53984 267.40121
220.0000 -50.19707 -49.22719 0.96988 1.64551 -49.42495 283.41834
225.0000 -50.18743 -49.31266 0.87477 1.67531 -49.19810 330.54311
230.0000 -50.20470 -49.29397 0.91073 1.65457 -49.35594 295.76376
235.0000 -50.04716 -49.28218 0.76498 1.68564 -49.11946 345.82906
240.0000 -50.03653 -49.26503 0.77150 1.66080 -49.30856 295.78423
245.0000 -49.87002 -49.23734 0.63268 1.67045 -49.23508 313.75716
250.0000 -49.89353 -49.11553 0.77800 1.66992 -49.23915 309.98346
MELTING PROCESS: loop number 2 T-loop= 325.00000000000000
main_MD> interactions number 2 at Temperature= 325.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 3.00261 1.00301 -0.38921
force_rgl> df(natom) 1.91106 -1.65079 -0.65487
255.0000 -50.14081 -49.37556 0.76525 1.67507 -49.19991 320.57944
260.0000 -50.26776 -49.07688 1.19087 1.66880 -49.24764 326.05000
265.0000 -50.08718 -49.01547 1.07172 1.69213 -49.07007 337.49024
270.0000 -50.03173 -49.31741 0.71432 1.67483 -49.20174 326.10977
275.0000 -50.19090 -49.24668 0.94422 1.66772 -49.25589 309.57957
280.0000 -50.03913 -49.01251 1.02661 1.67363 -49.21089 321.69470
285.0000 -49.99573 -49.05403 0.94170 1.69861 -49.02079 355.81166
290.0000 -49.81746 -48.88136 0.93610 1.71355 -48.90707 379.15595
295.0000 -50.12019 -49.18429 0.93589 1.70365 -48.98242 357.43565
300.0000 -50.15964 -49.23928 0.92036 1.67551 -49.19659 315.01052
305.0000 -49.95267 -48.90132 1.05135 1.69101 -49.07857 342.92761
310.0000 -50.16436 -49.19212 0.97224 1.66082 -49.30842 315.25508
315.0000 -50.09676 -49.28782 0.80894 1.66452 -49.28023 322.19316
320.0000 -50.16105 -49.08788 1.07317 1.67549 -49.19675 332.91333
325.0000 -49.99697 -49.27586 0.72111 1.65290 -49.36865 299.84373
330.0000 -50.07900 -49.38752 0.69148 1.68635 -49.11405 347.55195
335.0000 -49.97048 -48.96218 1.00830 1.68699 -49.10917 342.94484
340.0000 -50.01118 -49.15391 0.85727 1.68456 -49.12767 332.14849
345.0000 -50.20462 -49.27088 0.93375 1.66271 -49.29399 309.08953
350.0000 -49.97061 -49.13881 0.83179 1.66087 -49.30802 300.53874
355.0000 -50.28398 -49.41918 0.86480 1.66117 -49.30571 300.64071
360.0000 -50.07812 -49.42002 0.65811 1.65623 -49.34332 303.01214
365.0000 -50.10508 -49.27612 0.82896 1.65529 -49.35048 299.59298
370.0000 -49.82111 -49.08615 0.73496 1.69044 -49.08297 345.17227
375.0000 -50.07356 -49.30501 0.76855 1.66409 -49.28354 303.77509
380.0000 -50.02661 -49.11537 0.91124 1.66866 -49.24870 318.15214
385.0000 -50.21353 -49.47007 0.74346 1.64297 -49.44429 284.14307
390.0000 -50.18051 -49.23557 0.94494 1.66016 -49.31339 302.11716
395.0000 -50.10207 -49.19220 0.90986 1.68130 -49.15254 333.53184
400.0000 -49.84446 -49.03444 0.81002 1.70240 -48.99188 370.49720
405.0000 -49.88060 -49.10237 0.77823 1.67186 -49.22434 322.15931
410.0000 -49.73652 -48.95493 0.78160 1.68802 -49.10135 335.65893
415.0000 -50.12912 -49.08400 1.04512 1.69295 -49.06386 345.69950
420.0000 -50.19429 -49.01507 1.17923 1.67757 -49.18091 331.39362
425.0000 -49.83101 -48.98851 0.84250 1.69513 -49.04727 347.83253
430.0000 -49.81918 -48.58555 1.23363 1.73321 -48.75736 411.46637
435.0000 -50.15412 -49.10381 1.05031 1.73550 -48.73993 406.22119
440.0000 -50.18369 -48.92805 1.25564 1.69087 -49.07966 346.65720
445.0000 -50.32820 -49.25226 1.07594 1.66423 -49.28242 314.80850
450.0000 -50.05508 -49.21057 0.84451 1.66229 -49.29724 311.03076
455.0000 -50.04401 -49.37453 0.66948 1.69085 -49.07985 356.58753
460.0000 -49.83839 -48.88876 0.94964 1.67017 -49.23727 327.22158
465.0000 -50.22664 -49.46867 0.75797 1.67956 -49.16575 332.74388
470.0000 -49.94886 -49.20611 0.74275 1.68037 -49.15957 330.26703
475.0000 -50.17179 -49.01694 1.15484 1.67166 -49.22590 314.46598
480.0000 -50.02923 -49.21000 0.81923 1.69324 -49.06165 359.38141
485.0000 -50.43805 -49.68858 0.74947 1.64696 -49.41392 291.59298
490.0000 -49.88995 -48.95325 0.93670 1.65344 -49.36454 294.43949
495.0000 -50.32036 -49.49051 0.82985 1.67444 -49.20474 316.02396
500.0000 -50.31960 -49.49982 0.81978 1.63410 -49.51177 280.43073
MELTING PROCESS: loop number 3 T-loop= 350.00000000000000
main_MD> interactions number 3 at Temperature= 350.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.45083 -0.64846 0.62883
force_rgl> df(natom) 1.29355 0.07848 -0.44697
505.0000 -49.89558 -49.06209 0.83348 1.64820 -49.40448 290.37286
510.0000 -50.17444 -49.17485 0.99959 1.69364 -49.05856 369.17620
515.0000 -50.11221 -48.99927 1.11293 1.70539 -48.96911 367.98251
520.0000 -50.36377 -49.34642 1.01735 1.66643 -49.26566 314.94380
525.0000 -49.97871 -48.88036 1.09835 1.67654 -49.18873 318.83422
530.0000 -49.99286 -48.91648 1.07638 1.71287 -48.91218 372.02099
535.0000 -50.03490 -48.98304 1.05186 1.69903 -49.01757 362.54106
540.0000 -49.87027 -48.75284 1.11742 1.70938 -48.93877 355.52667
545.0000 -49.68346 -48.79204 0.89142 1.72264 -48.83785 388.09894
550.0000 -49.75464 -48.80336 0.95128 1.71254 -48.91469 366.65988
555.0000 -49.99298 -48.94982 1.04316 1.71198 -48.91899 365.46004
560.0000 -49.78828 -49.24430 0.54399 1.68940 -49.09083 355.57974
565.0000 -49.94380 -49.06484 0.87896 1.67557 -49.19614 325.23683
570.0000 -50.10047 -48.94542 1.15504 1.69571 -49.04285 371.26956
575.0000 -49.91541 -49.04411 0.87130 1.71717 -48.87947 396.78291
580.0000 -49.96569 -48.82576 1.13993 1.72308 -48.83451 390.03417
585.0000 -50.29977 -49.30251 0.99726 1.67799 -49.17769 322.65379
590.0000 -50.18972 -49.15754 1.03218 1.66057 -49.31033 298.29746
595.0000 -50.32949 -49.42320 0.90629 1.66074 -49.30902 302.21870
600.0000 -50.08018 -49.19313 0.88705 1.63847 -49.47853 272.42230
605.0000 -49.97453 -49.21271 0.76181 1.67200 -49.22333 323.85272
610.0000 -50.16415 -49.37735 0.78680 1.67668 -49.18766 334.48972
615.0000 -50.22406 -49.41579 0.80827 1.67701 -49.18517 347.51702
620.0000 -50.16620 -49.06777 1.09844 1.67185 -49.22440 320.33839
625.0000 -50.09954 -48.97719 1.12235 1.70261 -48.99032 357.15389
630.0000 -50.08024 -49.34658 0.73366 1.69566 -49.04321 345.77162
635.0000 -50.10213 -49.23221 0.86993 1.65093 -49.38368 290.40071
640.0000 -49.74722 -48.77708 0.97014 1.69735 -49.03032 355.53918
645.0000 -49.72432 -48.60318 1.12113 1.73470 -48.74606 401.92512
650.0000 -49.66035 -48.20701 1.45333 1.78209 -48.38535 477.79621
655.0000 -49.65469 -48.49020 1.16450 1.80756 -48.19148 499.60769
660.0000 -50.24547 -49.44475 0.80072 1.67058 -49.23410 319.48324
665.0000 -50.22894 -49.39979 0.82916 1.65588 -49.34602 301.18815
670.0000 -50.22063 -49.51816 0.70247 1.63833 -49.47961 281.36744
675.0000 -50.30308 -49.58582 0.71726 1.63769 -49.48448 278.70207
680.0000 -50.31005 -49.40217 0.90787 1.64807 -49.40546 296.77851
685.0000 -49.92267 -49.05016 0.87251 1.66151 -49.30311 304.12742
690.0000 -49.92424 -48.82253 1.10171 1.68715 -49.10802 333.92047
695.0000 -49.83918 -48.83089 1.00830 1.71831 -48.87084 368.62647
700.0000 -50.03062 -49.01809 1.01252 1.72417 -48.82618 394.47171
705.0000 -50.04576 -49.19411 0.85165 1.69739 -49.03005 362.40302
710.0000 -50.10666 -49.09759 1.00907 1.70274 -48.98933 366.74141
715.0000 -49.79176 -48.88000 0.91176 1.69523 -49.04649 343.91131
720.0000 -49.95435 -48.88963 1.06472 1.72109 -48.84967 374.99785
725.0000 -50.14652 -48.95170 1.19482 1.70947 -48.93809 365.53953
730.0000 -50.06232 -48.87976 1.18256 1.73838 -48.71804 391.74488
735.0000 -49.88512 -48.92372 0.96140 1.71855 -48.86897 383.11055
740.0000 -49.89150 -48.94315 0.94835 1.69781 -49.02684 358.61267
745.0000 -49.87887 -49.00205 0.87681 1.66987 -49.23952 318.30634
750.0000 -49.86887 -48.77458 1.09429 1.72793 -48.79756 407.57546
MELTING PROCESS: loop number 4 T-loop= 375.00000000000000
main_MD> interactions number 4 at Temperature= 375.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.69033 1.87733 1.09679
force_rgl> df(natom) -0.11094 0.94977 1.05716
755.0000 -49.91180 -48.72792 1.18389 1.72805 -48.79666 396.95239
760.0000 -49.96165 -48.58819 1.37346 1.71635 -48.88572 386.78703
765.0000 -49.92740 -48.61751 1.30989 1.73829 -48.71873 430.54053
770.0000 -49.89560 -48.65936 1.23624 1.76077 -48.54761 460.19553
775.0000 -50.15435 -48.98819 1.16616 1.71709 -48.88008 395.31458
780.0000 -50.04384 -49.12013 0.92371 1.69829 -49.02318 352.03929
785.0000 -50.06030 -49.31774 0.74255 1.68751 -49.10525 354.18802
790.0000 -50.19387 -49.37435 0.81952 1.67548 -49.19682 321.09991
795.0000 -50.19586 -49.37799 0.81787 1.65115 -49.38197 299.41278
800.0000 -49.95252 -49.21824 0.73428 1.68059 -49.15793 348.12991
805.0000 -49.53420 -48.59742 0.93678 1.71590 -48.88911 388.12947
810.0000 -49.48202 -48.33237 1.14965 1.75015 -48.62845 420.17425
815.0000 -50.30909 -49.15300 1.15609 1.74799 -48.64491 412.63882
820.0000 -49.81004 -48.79420 1.01583 1.71215 -48.91766 398.16545
825.0000 -50.02357 -49.04898 0.97459 1.71684 -48.88201 387.13283
830.0000 -50.18456 -48.69815 1.48641 1.71192 -48.91946 378.18287
835.0000 -49.93565 -48.84857 1.08708 1.72127 -48.84830 390.43550
840.0000 -49.89637 -48.93920 0.95717 1.69903 -49.01755 357.08360
845.0000 -50.13208 -49.23896 0.89312 1.67336 -49.21294 327.73733
850.0000 -49.98287 -48.82480 1.15807 1.68703 -49.10888 335.02969
855.0000 -49.89111 -48.59968 1.29144 1.72710 -48.80392 395.07442
860.0000 -50.06192 -49.16316 0.89876 1.72261 -48.83810 382.38013
865.0000 -49.93937 -49.23230 0.70707 1.67513 -49.19949 331.90167
870.0000 -49.84005 -48.89613 0.94392 1.71312 -48.91030 360.18399
875.0000 -49.81595 -49.18052 0.63544 1.69891 -49.01848 355.42814
880.0000 -49.78376 -48.76847 1.01529 1.70055 -49.00603 365.37018
885.0000 -50.07289 -48.93592 1.13697 1.70437 -48.97691 377.92705
890.0000 -49.55847 -48.45046 1.10802 1.75950 -48.55729 446.49436
895.0000 -49.69562 -48.63642 1.05920 1.76303 -48.53045 435.45960
900.0000 -49.69414 -48.28787 1.40627 1.76217 -48.53697 442.76904
905.0000 -49.90303 -49.06496 0.83807 1.76909 -48.48431 440.20119
910.0000 -49.97315 -48.84403 1.12912 1.71962 -48.86087 380.79189
915.0000 -49.71316 -48.48859 1.22457 1.74232 -48.68805 403.05691
920.0000 -49.93603 -48.97181 0.96421 1.73941 -48.71023 412.49394
925.0000 -50.29903 -49.56437 0.73466 1.68915 -49.09275 334.48590
930.0000 -49.91511 -49.03566 0.87945 1.67120 -49.22937 320.34921
935.0000 -50.12721 -49.01452 1.11268 1.68551 -49.12044 339.03353
940.0000 -49.78059 -48.71121 1.06939 1.72078 -48.85200 387.03388
945.0000 -49.88582 -48.89739 0.98843 1.72446 -48.82398 361.79850
950.0000 -50.00114 -48.93965 1.06150 1.71842 -48.86996 371.26577
955.0000 -50.18546 -49.17629 1.00917 1.68411 -49.13113 324.32696
960.0000 -50.16699 -49.21402 0.95296 1.67324 -49.21384 321.40885
965.0000 -50.06424 -49.00336 1.06088 1.69723 -49.03124 344.23429
970.0000 -50.08991 -49.02966 1.06026 1.70417 -48.97840 351.98306
975.0000 -50.01650 -49.15442 0.86208 1.71084 -48.92768 369.82765
980.0000 -49.99726 -49.01305 0.98420 1.72093 -48.85085 381.78293
985.0000 -49.98499 -48.95241 1.03257 1.69881 -49.01925 354.64908
990.0000 -49.59850 -48.66925 0.92925 1.73292 -48.75958 392.69756
995.0000 -50.07048 -49.12926 0.94122 1.69132 -49.07621 334.87091
1000.0000 -50.14799 -49.31359 0.83441 1.66429 -49.28202 304.35110
MELTING PROCESS: loop number 5 T-loop= 400.00000000000000
main_MD> interactions number 5 at Temperature= 400.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.00495 -0.08777 -0.01933
force_rgl> df(natom) -1.31398 -2.56174 0.24852
1005.0000 -49.94917 -49.00158 0.94759 1.67591 -49.19355 325.69359
1010.0000 -49.80493 -48.75134 1.05359 1.72899 -48.78950 393.85438
1015.0000 -49.55496 -48.54436 1.01060 1.75675 -48.57824 398.55447
1020.0000 -49.66706 -48.43080 1.23627 1.76625 -48.50592 434.38818
1025.0000 -49.18351 -47.67466 1.50885 1.83002 -48.02052 505.30093
1030.0000 -49.77372 -48.54350 1.23021 1.81319 -48.14860 490.31234
1035.0000 -49.76215 -48.44888 1.31327 1.75255 -48.61015 414.93942
1040.0000 -50.12490 -48.55205 1.57285 1.75542 -48.58831 428.46347
1045.0000 -49.89385 -48.60072 1.29313 1.77710 -48.42331 462.22772
1050.0000 -50.19162 -49.20576 0.98586 1.69912 -49.01683 370.77591
1055.0000 -50.06624 -49.20744 0.85879 1.68377 -49.13371 329.20066
1060.0000 -49.60422 -48.69892 0.90530 1.74318 -48.68150 403.98731
1065.0000 -49.63778 -48.14461 1.49317 1.78376 -48.37260 440.04987
1070.0000 -49.74244 -48.23379 1.50865 1.81535 -48.13219 502.47212
1075.0000 -49.73145 -48.75400 0.97745 1.75057 -48.62526 408.18775
1080.0000 -49.24615 -48.19682 1.04933 1.77142 -48.46651 425.13724
1085.0000 -49.84345 -48.47985 1.36360 1.79439 -48.29170 460.41823
1090.0000 -49.91398 -48.69935 1.21463 1.75223 -48.61260 429.09657
1095.0000 -49.94201 -48.81604 1.12597 1.71073 -48.92851 367.83978
1100.0000 -50.08059 -48.91489 1.16570 1.71353 -48.90719 372.83593
1105.0000 -49.54104 -48.60292 0.93811 1.73138 -48.77133 396.86419
1110.0000 -49.82600 -48.60333 1.22267 1.76935 -48.48227 433.17287
1115.0000 -49.98336 -49.21674 0.76663 1.72118 -48.84894 397.44965
1120.0000 -49.95555 -48.75677 1.19878 1.71135 -48.92381 363.45396
1125.0000 -49.82512 -48.51468 1.31045 1.74227 -48.68841 398.48670
1130.0000 -49.35309 -48.48006 0.87303 1.74806 -48.64435 405.24012
1135.0000 -49.91959 -48.62802 1.29157 1.76437 -48.52019 447.33238
1140.0000 -49.52713 -48.40873 1.11840 1.73844 -48.71761 413.13203
1145.0000 -50.30538 -49.19731 1.10808 1.72098 -48.85046 398.51257
1150.0000 -50.16721 -49.14444 1.02278 1.66924 -49.24427 331.93824
1155.0000 -49.98407 -49.05571 0.92836 1.69444 -49.05246 350.12139
1160.0000 -49.70216 -48.67325 1.02892 1.70339 -48.98439 386.22532
1165.0000 -49.68737 -48.62173 1.06564 1.73389 -48.75220 399.35536
1170.0000 -50.06706 -49.18193 0.88512 1.72810 -48.79631 387.32528
1175.0000 -49.85807 -48.83772 1.02035 1.69596 -49.04096 350.78131
1180.0000 -50.29463 -48.87801 1.41662 1.71888 -48.86646 383.30641
1185.0000 -50.10819 -49.10029 1.00791 1.71409 -48.90292 364.44145
1190.0000 -50.15556 -49.10147 1.05408 1.67925 -49.16808 336.80716
1195.0000 -49.97960 -48.66884 1.31077 1.74118 -48.69672 428.67304
1200.0000 -49.82233 -48.88094 0.94139 1.73641 -48.73301 399.08537
1205.0000 -49.81911 -49.01548 0.80362 1.72319 -48.83368 399.66825
1210.0000 -49.96553 -48.62737 1.33816 1.71996 -48.85821 419.03729
1215.0000 -49.94805 -49.09261 0.85544 1.72006 -48.85751 396.11265
1220.0000 -50.19011 -49.25185 0.93826 1.68558 -49.11996 341.97569
1225.0000 -50.06004 -48.98927 1.07076 1.67904 -49.16971 337.54835
1230.0000 -50.07644 -48.64205 1.43439 1.72480 -48.82142 401.03318
1235.0000 -49.61866 -48.80865 0.81001 1.75940 -48.55805 421.70640
1240.0000 -49.98126 -48.83946 1.14180 1.72978 -48.78353 393.40834
1245.0000 -50.02954 -48.57986 1.44967 1.73920 -48.71177 417.31519
1250.0000 -49.41656 -48.22453 1.19203 1.78204 -48.38574 428.47266
MELTING PROCESS: loop number 6 T-loop= 425.00000000000000
main_MD> interactions number 6 at Temperature= 425.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.09750 -1.81542 -0.75032
force_rgl> df(natom) -0.08634 -0.33685 -1.94742
1255.0000 -49.65761 -48.23930 1.41831 1.80347 -48.22257 463.17333
1260.0000 -49.94278 -49.15052 0.79226 1.73823 -48.71921 420.64968
1265.0000 -49.96359 -48.88653 1.07705 1.70022 -49.00852 359.09336
1270.0000 -49.61953 -48.42541 1.19411 1.76492 -48.51604 446.15420
1275.0000 -49.51771 -48.33106 1.18665 1.79413 -48.29367 483.60112
1280.0000 -49.68184 -48.72737 0.95447 1.74063 -48.70088 402.17254
1285.0000 -49.81910 -48.93071 0.88839 1.72547 -48.81631 390.26046
1290.0000 -49.77459 -48.45468 1.31991 1.71347 -48.90767 362.88603
1295.0000 -49.70595 -48.75902 0.94693 1.76598 -48.50797 424.40643
1300.0000 -50.04524 -48.76100 1.28424 1.74213 -48.68948 417.92317
1305.0000 -50.10716 -49.13256 0.97460 1.72291 -48.83580 384.56168
1310.0000 -49.94147 -48.70090 1.24057 1.70924 -48.93984 376.45552
1315.0000 -49.94398 -48.91642 1.02756 1.73612 -48.73521 418.06862
1320.0000 -49.70233 -48.92967 0.77266 1.71437 -48.90077 369.35137
1325.0000 -50.07728 -49.05936 1.01792 1.69710 -49.03222 353.27451
1330.0000 -49.58615 -48.57360 1.01255 1.70924 -48.93981 379.79992
1335.0000 -49.83322 -48.80240 1.03082 1.74451 -48.67138 400.46007
1340.0000 -49.73442 -48.94205 0.79237 1.70661 -48.95985 367.82169
1345.0000 -49.88505 -49.00885 0.87620 1.71993 -48.85850 379.31968
1350.0000 -49.97048 -48.81769 1.15279 1.70418 -48.97835 369.25097
1355.0000 -49.64071 -48.62873 1.01198 1.74210 -48.68972 414.35915
1360.0000 -49.54222 -48.57351 0.96871 1.77760 -48.41948 456.99456
1365.0000 -49.82817 -48.72720 1.10097 1.74805 -48.64443 422.51712
1370.0000 -50.08158 -48.87223 1.20936 1.74128 -48.69594 431.60272
1375.0000 -50.32989 -49.33734 0.99254 1.69413 -49.05487 358.93287
1380.0000 -49.85323 -48.73871 1.11451 1.69053 -49.08227 356.10126
1385.0000 -49.65919 -48.58551 1.07367 1.74484 -48.66883 417.81410
1390.0000 -49.72337 -48.78132 0.94205 1.77173 -48.46417 455.12247
1395.0000 -50.00251 -48.79920 1.20331 1.74826 -48.64287 420.04931
1400.0000 -49.52027 -48.60074 0.91952 1.73314 -48.75795 412.66026
1405.0000 -50.11612 -49.00964 1.10648 1.72628 -48.81016 382.45132
1410.0000 -49.81154 -48.84620 0.96535 1.72922 -48.78773 405.72348
1415.0000 -49.94668 -48.89302 1.05366 1.73458 -48.74693 413.56746
1420.0000 -50.04424 -48.93239 1.11185 1.74209 -48.68977 409.85208
1425.0000 -49.79918 -48.81633 0.98285 1.72617 -48.81100 387.06685
1430.0000 -49.75773 -48.82635 0.93138 1.72280 -48.83665 389.34765
1435.0000 -49.66245 -48.64251 1.01993 1.74552 -48.66369 410.59166
1440.0000 -49.78362 -48.74261 1.04101 1.74940 -48.63419 421.76970
1445.0000 -49.89352 -48.73880 1.15472 1.70839 -48.94633 369.92926
1450.0000 -49.53049 -48.28377 1.24673 1.75069 -48.62433 409.00651
1455.0000 -49.36490 -48.08591 1.27899 1.80148 -48.23774 479.75010
1460.0000 -49.81646 -48.62392 1.19254 1.77464 -48.44206 449.02088
1465.0000 -50.03554 -48.71646 1.31908 1.75864 -48.56383 418.95038
1470.0000 -49.32918 -48.20011 1.12907 1.74160 -48.69353 406.67651
1475.0000 -49.82114 -48.32583 1.49531 1.78583 -48.35685 431.50449
1480.0000 -49.94853 -48.79376 1.15477 1.75065 -48.62468 415.55459
1485.0000 -49.65250 -48.49429 1.15821 1.73548 -48.74009 397.94556
1490.0000 -50.06965 -48.97417 1.09548 1.73297 -48.75925 394.14972
1495.0000 -49.93713 -48.70364 1.23350 1.71995 -48.85829 388.92087
1500.0000 -49.87548 -48.56904 1.30644 1.74299 -48.68297 420.52118
MELTING PROCESS: loop number 7 T-loop= 450.00000000000000
main_MD> interactions number 7 at Temperature= 450.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.18164 1.29944 -2.77727
force_rgl> df(natom) -1.49488 -1.42321 0.79004
1505.0000 -49.72210 -48.42411 1.29800 1.75485 -48.59265 426.32499
1510.0000 -49.59737 -48.51939 1.07798 1.78752 -48.34397 457.98097
1515.0000 -49.57950 -48.36592 1.21358 1.74751 -48.64856 406.80567
1520.0000 -49.63826 -48.15782 1.48044 1.78959 -48.32827 465.47251
1525.0000 -49.39595 -48.02790 1.36805 1.82537 -48.05593 505.35977
1530.0000 -49.98433 -49.12048 0.86385 1.76485 -48.51658 439.37724
1535.0000 -49.85962 -48.88065 0.97897 1.69983 -49.01149 352.29914
1540.0000 -49.75633 -48.51774 1.23859 1.76074 -48.54785 430.37494
1545.0000 -49.66934 -48.17981 1.48953 1.80378 -48.22023 479.97443
1550.0000 -49.51370 -48.29706 1.21665 1.80058 -48.24460 486.62243
1555.0000 -49.91101 -48.76221 1.14880 1.74342 -48.67964 431.32739
1560.0000 -49.76217 -48.68422 1.07794 1.71876 -48.86739 383.57667
1565.0000 -49.54855 -48.19595 1.35260 1.77748 -48.42041 446.49125
1570.0000 -49.84114 -48.71406 1.12707 1.75868 -48.56353 418.39555
1575.0000 -49.75685 -48.67127 1.08558 1.75683 -48.57761 419.16314
1580.0000 -49.83145 -48.64050 1.19096 1.75742 -48.57309 412.11183
1585.0000 -49.66053 -48.46611 1.19442 1.76622 -48.50615 441.61151
1590.0000 -49.69766 -48.81755 0.88012 1.78419 -48.36937 462.58833
1595.0000 -49.79951 -48.57598 1.22353 1.75178 -48.61602 426.22466
1600.0000 -49.72944 -48.84431 0.88513 1.77389 -48.44778 454.37333
1605.0000 -49.56928 -48.42858 1.14069 1.75774 -48.57071 418.91701
1610.0000 -49.77344 -48.62915 1.14429 1.73365 -48.75403 393.41598
1615.0000 -50.13533 -48.72974 1.40559 1.74178 -48.69218 423.79644
1620.0000 -50.00702 -49.07161 0.93541 1.70918 -48.94027 373.69776
1625.0000 -50.09647 -49.15682 0.93965 1.69430 -49.05354 357.13308
1630.0000 -50.07337 -48.75280 1.32056 1.70748 -48.95321 380.89055
1635.0000 -49.80316 -48.97859 0.82458 1.70061 -49.00556 382.25688
1640.0000 -50.03918 -48.85362 1.18556 1.70306 -48.98687 365.61086
1645.0000 -49.74564 -47.94762 1.79802 1.78412 -48.36990 478.74451
1650.0000 -49.65629 -48.03323 1.62306 1.82379 -48.06795 495.96663
1655.0000 -49.31030 -48.01999 1.29031 1.79727 -48.26978 481.34509
1660.0000 -49.16351 -47.47148 1.69203 1.84726 -47.88930 529.21389
1665.0000 -49.43763 -48.39047 1.04716 1.79651 -48.27555 473.61356
1670.0000 -49.76455 -48.55912 1.20543 1.76303 -48.53044 432.58665
1675.0000 -49.65940 -48.27339 1.38600 1.76307 -48.53008 438.51435
1680.0000 -50.02883 -48.88493 1.14390 1.76829 -48.49039 429.09052
1685.0000 -49.56670 -48.37417 1.19252 1.75774 -48.57069 421.36339
1690.0000 -49.63677 -48.26562 1.37115 1.76924 -48.48315 466.62403
1695.0000 -49.33411 -48.00018 1.33393 1.82238 -48.07869 491.77523
1700.0000 -49.58634 -48.34056 1.24578 1.80850 -48.18431 489.66584
1705.0000 -49.53162 -48.34190 1.18972 1.79450 -48.29084 476.49648
1710.0000 -49.56597 -48.39547 1.17050 1.78345 -48.37498 448.43459
1715.0000 -49.11427 -48.12780 0.98647 1.81537 -48.13202 475.61472
1720.0000 -49.03107 -47.66088 1.37019 1.86128 -47.78256 551.86933
1725.0000 -49.59140 -48.65977 0.93163 1.80211 -48.23292 499.83625
1730.0000 -49.94022 -48.14037 1.79985 1.78387 -48.37178 481.36298
1735.0000 -49.68035 -48.57595 1.10440 1.78464 -48.36596 462.59029
1740.0000 -49.28611 -47.66483 1.62128 1.80560 -48.20637 488.52456
1745.0000 -49.58135 -48.41707 1.16428 1.82100 -48.08917 488.01575
1750.0000 -49.38543 -48.54373 0.84169 1.76166 -48.54080 435.57550
MELTING PROCESS: loop number 8 T-loop= 475.00000000000000
main_MD> interactions number 8 at Temperature= 475.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.97646 -2.63971 -2.21008
force_rgl> df(natom) 0.43460 -1.01005 0.31436
1755.0000 -49.62206 -48.22723 1.39482 1.75505 -48.59118 425.52959
1760.0000 -49.67918 -48.68501 0.99417 1.75983 -48.55478 434.57586
1765.0000 -49.85711 -48.61992 1.23720 1.75003 -48.62938 414.72986
1770.0000 -49.48969 -48.38907 1.10062 1.76746 -48.49669 431.13314
1775.0000 -49.60765 -48.60288 1.00477 1.75825 -48.56678 423.31997
1780.0000 -49.40364 -47.98041 1.42323 1.80016 -48.24779 495.16320
1785.0000 -49.87650 -48.54194 1.33456 1.80884 -48.18169 531.03198
1790.0000 -49.12473 -48.04232 1.08242 1.80409 -48.21787 467.09113
1795.0000 -49.07907 -47.88045 1.19862 1.85797 -47.80778 551.84489
1800.0000 -49.74868 -48.55495 1.19373 1.78388 -48.37173 472.66229
1805.0000 -49.41323 -47.57136 1.84188 1.79047 -48.32157 490.86200
1810.0000 -49.14322 -47.66443 1.47878 1.83951 -47.94826 502.64786
1815.0000 -49.53017 -48.02613 1.50404 1.84705 -47.89092 553.85997
1820.0000 -49.76758 -48.79661 0.97097 1.77120 -48.46819 450.73850
1825.0000 -49.75659 -48.65993 1.09666 1.73312 -48.75806 391.69003
1830.0000 -49.39050 -48.23855 1.15196 1.76143 -48.54258 436.80897
1835.0000 -49.36447 -48.32813 1.03635 1.78920 -48.33121 467.27434
1840.0000 -49.38983 -48.24152 1.14832 1.79316 -48.30109 458.31006
1845.0000 -49.56335 -48.19808 1.36527 1.78565 -48.35825 460.52765
1850.0000 -49.43485 -47.92316 1.51169 1.81563 -48.13002 490.51626
1855.0000 -49.44902 -47.94494 1.50408 1.86384 -47.76309 538.73782
1860.0000 -49.02068 -47.52742 1.49327 1.84964 -47.87118 547.20537
1865.0000 -49.26408 -47.85981 1.40426 1.83874 -47.95414 518.81257
1870.0000 -49.94945 -48.62451 1.32494 1.83272 -47.99997 514.55370
1875.0000 -49.56717 -48.06631 1.50086 1.77822 -48.41481 456.71502
1880.0000 -49.48536 -47.99109 1.49427 1.84004 -47.94424 525.21594
1885.0000 -50.25774 -48.88775 1.36999 1.82687 -48.04447 518.51679
1890.0000 -49.73137 -48.15798 1.57339 1.74908 -48.63657 435.87285
1895.0000 -49.76221 -48.50105 1.26116 1.81438 -48.13956 509.74844
1900.0000 -49.98448 -48.76915 1.21533 1.74783 -48.64607 432.69644
1905.0000 -50.15364 -49.09196 1.06168 1.72049 -48.85419 380.16320
1910.0000 -49.89722 -48.81046 1.08676 1.73344 -48.75563 396.68365
1915.0000 -49.70129 -48.96562 0.73567 1.73509 -48.74308 402.32203
1920.0000 -49.49555 -48.27027 1.22528 1.74942 -48.63397 421.02797
1925.0000 -49.37821 -48.22354 1.15467 1.81761 -48.11499 518.38033
1930.0000 -49.29505 -48.03132 1.26373 1.80690 -48.19647 493.50119
1935.0000 -49.51127 -48.32703 1.18424 1.83180 -48.00699 520.96826
1940.0000 -49.58203 -48.47232 1.10971 1.78393 -48.37134 448.85328
1945.0000 -49.03957 -47.70397 1.33560 1.81851 -48.10812 499.32890
1950.0000 -49.44519 -48.25728 1.18791 1.82579 -48.05272 508.40462
1955.0000 -49.96236 -47.90167 2.06069 1.78210 -48.38522 468.90933
1960.0000 -49.94594 -48.58682 1.35912 1.81497 -48.13506 505.73605
1965.0000 -49.39520 -48.53435 0.86086 1.75097 -48.62221 416.76751
1970.0000 -49.35514 -48.05014 1.30501 1.76137 -48.54305 437.13265
1975.0000 -49.26658 -48.06088 1.20570 1.85113 -47.85983 526.88097
1980.0000 -49.60728 -48.28988 1.31740 1.81548 -48.13122 520.05250
1985.0000 -49.83320 -48.27646 1.55675 1.80505 -48.21058 484.39692
1990.0000 -49.44331 -47.74384 1.69947 1.82005 -48.09642 521.89514
1995.0000 -49.69951 -48.53530 1.16421 1.81710 -48.11888 524.61753
2000.0000 -49.36752 -48.38282 0.98471 1.78030 -48.39894 460.35522
MELTING PROCESS: loop number 9 T-loop= 500.00000000000000
main_MD> interactions number 9 at Temperature= 500.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.04703 -1.71761 1.92783
force_rgl> df(natom) -1.16226 -1.77740 2.71150
2005.0000 -49.70809 -48.50228 1.20581 1.83252 -48.00146 514.56057
2010.0000 -49.28196 -48.07031 1.21166 1.77058 -48.47291 454.20409
2015.0000 -49.66360 -47.90227 1.76133 1.81907 -48.10383 503.83550
2020.0000 -49.42306 -48.13525 1.28781 1.80297 -48.22644 507.25771
2025.0000 -49.60267 -48.37778 1.22489 1.79523 -48.28531 453.11949
2030.0000 -49.24427 -48.04762 1.19665 1.81711 -48.11876 488.69938
2035.0000 -49.60419 -48.05835 1.54585 1.84409 -47.91342 517.61435
2040.0000 -49.37960 -47.85229 1.52731 1.81274 -48.15205 494.01055
2045.0000 -49.07944 -47.78252 1.29691 1.81895 -48.10479 479.67023
2050.0000 -49.62596 -48.14278 1.48318 1.85852 -47.80357 541.88649
2055.0000 -49.71386 -48.36811 1.34575 1.77963 -48.40405 466.75727
2060.0000 -49.68524 -48.29264 1.39259 1.80065 -48.24403 470.65217
2065.0000 -49.38395 -48.06441 1.31954 1.80485 -48.21210 499.98389
2070.0000 -49.41768 -47.59146 1.82622 1.86411 -47.76103 587.64989
2075.0000 -49.49710 -48.32176 1.17534 1.83417 -47.98891 521.85319
2080.0000 -49.77087 -48.19401 1.57686 1.77101 -48.46969 456.33813
2085.0000 -49.59942 -48.23956 1.35986 1.82147 -48.08560 503.33760
2090.0000 -49.23727 -48.16415 1.07312 1.80199 -48.23386 492.42715
2095.0000 -49.66729 -47.93517 1.73212 1.80660 -48.19874 497.66305
2100.0000 -49.51523 -48.09311 1.42212 1.83662 -47.97029 531.41260
2105.0000 -49.86638 -48.78043 1.08595 1.76858 -48.48813 449.51010
2110.0000 -49.77488 -48.16958 1.60530 1.77943 -48.40555 485.19387
2115.0000 -49.95194 -48.68148 1.27045 1.79538 -48.28417 460.51927
2120.0000 -49.58832 -48.30064 1.28769 1.76198 -48.53838 446.66225
2125.0000 -49.05368 -47.69322 1.36046 1.80705 -48.19534 496.24807
2130.0000 -49.77081 -48.11920 1.65161 1.83228 -48.00332 538.41737
2135.0000 -49.44677 -48.43397 1.01279 1.80240 -48.23074 473.81096
2140.0000 -49.25769 -47.92792 1.32977 1.82071 -48.09138 526.37610
2145.0000 -49.60631 -48.15657 1.44974 1.80975 -48.17483 517.69358
2150.0000 -49.68851 -48.35392 1.33459 1.79147 -48.31390 472.40969
2155.0000 -49.79987 -48.48055 1.31932 1.77019 -48.47591 443.85760
2160.0000 -49.76604 -48.75294 1.01309 1.79840 -48.26117 506.06611
2165.0000 -49.34595 -48.31130 1.03465 1.77855 -48.41231 458.02167
2170.0000 -49.60766 -48.36893 1.23874 1.77309 -48.45387 461.67763
2175.0000 -49.58028 -48.35652 1.22376 1.75751 -48.57243 451.84886
2180.0000 -49.59194 -48.25366 1.33829 1.81151 -48.16137 502.08558
2185.0000 -49.89267 -48.40426 1.48841 1.79491 -48.28775 468.24883
2190.0000 -49.33941 -48.15293 1.18648 1.79872 -48.25873 477.05052
2195.0000 -49.68120 -48.17912 1.50208 1.80711 -48.19491 518.98274
2200.0000 -49.98509 -49.03827 0.94681 1.78401 -48.37070 463.62657
2205.0000 -49.91582 -48.56388 1.35194 1.74418 -48.67389 413.28981
2210.0000 -49.54711 -48.26673 1.28039 1.76189 -48.53905 433.71744
2215.0000 -50.09974 -48.54804 1.55169 1.76851 -48.48873 463.44284
2220.0000 -49.20855 -47.60361 1.60494 1.81392 -48.14302 497.25174
2225.0000 -49.20803 -47.78860 1.41944 1.83071 -48.01529 532.12409
2230.0000 -49.49396 -48.08345 1.41051 1.83153 -48.00899 539.11831
2235.0000 -49.55740 -48.45652 1.10088 1.79238 -48.30699 482.93853
2240.0000 -49.63146 -48.32806 1.30341 1.76547 -48.51183 427.71718
2245.0000 -49.83909 -48.32582 1.51327 1.81589 -48.12809 511.52560
2250.0000 -49.21230 -47.88238 1.32992 1.76381 -48.52447 435.76266
MELTING PROCESS: loop number 10 T-loop= 525.00000000000000
main_MD> interactions number 10 at Temperature= 525.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.23067 -2.20098 1.92311
force_rgl> df(natom) -2.28553 -0.97539 -1.67638
2255.0000 -49.04586 -47.37068 1.67519 1.85354 -47.84147 542.98483
2260.0000 -48.91714 -47.29544 1.62170 1.89642 -47.51505 627.10947
2265.0000 -49.35267 -48.13926 1.21341 1.86733 -47.73649 565.65634
2270.0000 -49.34981 -47.48069 1.86912 1.82322 -48.07227 511.57005
2275.0000 -49.33799 -47.29406 2.04393 1.88975 -47.56590 585.80638
2280.0000 -49.19603 -48.03514 1.16089 1.85557 -47.82606 568.11290
2285.0000 -49.35468 -48.26765 1.08703 1.81859 -48.10752 505.44708
2290.0000 -49.59004 -47.93993 1.65011 1.82526 -48.05672 531.89547
2295.0000 -49.52602 -48.42260 1.10343 1.84883 -47.87735 557.13360
2300.0000 -49.37898 -48.02553 1.35345 1.80901 -48.18041 508.72811
2305.0000 -49.92543 -48.66619 1.25924 1.80359 -48.22170 492.17535
2310.0000 -49.83544 -48.13505 1.70039 1.80758 -48.19133 483.94762
2315.0000 -49.40310 -48.04674 1.35635 1.78526 -48.36119 487.93479
2320.0000 -49.11728 -47.71231 1.40498 1.82742 -48.04026 537.74325
2325.0000 -48.65217 -47.24009 1.41208 1.88515 -47.60089 590.37434
2330.0000 -49.22920 -47.73449 1.49471 1.86591 -47.74734 551.49101
2335.0000 -49.72993 -48.17487 1.55506 1.83963 -47.94735 527.49086
2340.0000 -49.33494 -48.25170 1.08324 1.79540 -48.28398 468.35684
2345.0000 -49.60560 -48.12932 1.47628 1.79306 -48.30186 476.36127
2350.0000 -49.27669 -47.97386 1.30283 1.82883 -48.02959 530.42868
2355.0000 -49.62976 -48.40007 1.22969 1.77827 -48.41440 452.57036
2360.0000 -49.26011 -47.71951 1.54060 1.82644 -48.04775 495.88166
2365.0000 -49.39173 -47.94364 1.44810 1.90123 -47.47849 591.32679
2370.0000 -49.20654 -47.64098 1.56556 1.89713 -47.50968 611.91934
2375.0000 -49.28313 -47.74716 1.53597 1.87286 -47.69445 553.98853
2380.0000 -49.30306 -47.94373 1.35934 1.84591 -47.89957 528.07506
2385.0000 -49.42432 -47.72927 1.69505 1.84520 -47.90497 535.09774
2390.0000 -49.68357 -48.19849 1.48508 1.80983 -48.17422 503.54290
2395.0000 -50.01948 -48.40354 1.61594 1.81009 -48.17224 510.68355
2400.0000 -49.20421 -47.65027 1.55394 1.82710 -48.04277 540.81705
2405.0000 -49.61124 -48.06537 1.54587 1.87275 -47.69524 599.04005
2410.0000 -49.68770 -48.30541 1.38229 1.80125 -48.23946 470.16935
2415.0000 -49.48626 -48.29696 1.18930 1.78623 -48.35380 479.93029
2420.0000 -49.43246 -48.00151 1.43095 1.79529 -48.28489 491.45066
2425.0000 -49.06848 -47.63508 1.43340 1.88486 -47.60310 563.49100
2430.0000 -49.36613 -48.18091 1.18522 1.83679 -47.96894 517.56663
2435.0000 -49.89396 -48.33233 1.56164 1.82516 -48.05748 519.06225
2440.0000 -49.47234 -47.81049 1.66185 1.82647 -48.04751 514.12137
2445.0000 -49.35166 -48.25191 1.09975 1.81975 -48.09869 498.58042
2450.0000 -49.67267 -48.55735 1.11532 1.81066 -48.16789 504.34875
2455.0000 -49.35087 -48.28074 1.07013 1.78392 -48.37141 459.44848
2460.0000 -49.57202 -48.05648 1.51553 1.79498 -48.28726 484.19912
2465.0000 -49.89296 -47.59302 2.29994 1.85151 -47.85695 560.26992
2470.0000 -49.59444 -48.17581 1.41863 1.80910 -48.17972 503.96741
2475.0000 -49.53106 -47.88691 1.64415 1.81495 -48.13518 492.10163
2480.0000 -49.74418 -48.19243 1.55175 1.85409 -47.83731 552.27762
2485.0000 -49.63069 -47.84363 1.78707 1.82234 -48.07898 496.68932
2490.0000 -49.86709 -48.12254 1.74455 1.83177 -48.00717 528.90144
2495.0000 -49.86611 -48.52303 1.34307 1.76865 -48.48760 447.13575
2500.0000 -49.64829 -48.49587 1.15242 1.76000 -48.55348 437.60888
MELTING PROCESS: loop number 11 T-loop= 550.00000000000000
main_MD> interactions number 11 at Temperature= 550.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -2.36848 1.34305 -0.21802
force_rgl> df(natom) -1.03869 -1.13447 1.44271
2505.0000 -49.57090 -48.27037 1.30053 1.78197 -48.38626 467.46763
2510.0000 -49.23072 -47.81632 1.41441 1.84899 -47.87611 555.52680
2515.0000 -49.13748 -48.15911 0.97836 1.78411 -48.36998 456.13150
2520.0000 -49.46220 -47.72442 1.73778 1.81423 -48.14067 472.25892
2525.0000 -49.40983 -47.89022 1.51961 1.85656 -47.81847 567.61740
2530.0000 -49.73607 -48.35050 1.38557 1.82454 -48.06223 496.33485
2535.0000 -49.14538 -47.77277 1.37261 1.81015 -48.17175 485.27053
2540.0000 -49.18225 -47.66496 1.51730 1.89576 -47.52008 626.30949
2545.0000 -49.66651 -48.14293 1.52358 1.85488 -47.83124 559.75413
2550.0000 -49.62593 -48.01041 1.61551 1.81569 -48.12956 506.53137
2555.0000 -49.17040 -47.68260 1.48781 1.80268 -48.22862 495.86578
2560.0000 -49.68520 -48.43364 1.25156 1.79004 -48.32479 495.63748
2565.0000 -49.11727 -47.46030 1.65697 1.84752 -47.88727 536.84764
2570.0000 -48.90617 -47.39579 1.51039 1.86430 -47.75957 549.75405
2575.0000 -48.67788 -47.20115 1.47673 1.92274 -47.31474 599.65355
2580.0000 -48.99094 -47.39266 1.59828 1.91976 -47.33740 638.55620
2585.0000 -49.07480 -47.28972 1.78508 1.91719 -47.35698 637.65762
2590.0000 -49.13262 -47.27734 1.85528 1.88996 -47.56430 579.03488
2595.0000 -48.75663 -47.03762 1.71901 1.93781 -47.20008 648.58819
2600.0000 -49.36404 -48.15864 1.20540 1.88070 -47.63478 562.43261
2605.0000 -49.30690 -48.01732 1.28958 1.85770 -47.80982 562.07737
2610.0000 -49.77145 -47.99441 1.77704 1.84512 -47.90554 552.35182
2615.0000 -49.65642 -48.30935 1.34707 1.83195 -48.00585 514.72344
2620.0000 -49.65538 -48.43921 1.21617 1.80199 -48.23387 488.24245
2625.0000 -49.90958 -48.36726 1.54231 1.77269 -48.45685 428.16460
2630.0000 -49.40986 -47.78026 1.62961 1.82469 -48.06106 509.00707
2635.0000 -49.48271 -47.90599 1.57672 1.86294 -47.76990 581.15213
2640.0000 -49.47978 -47.84465 1.63513 1.87636 -47.66776 583.48538
2645.0000 -47.95016 -46.19174 1.75842 1.94302 -47.16037 661.43959
2650.0000 -48.73449 -47.07366 1.66083 2.03065 -46.49340 690.66999
2655.0000 -49.09195 -47.20803 1.88392 1.95044 -47.10393 644.69635
2660.0000 -49.06453 -47.56473 1.49980 1.87716 -47.66169 599.14697
2665.0000 -49.30633 -47.88917 1.41716 1.84550 -47.90268 567.06849
2670.0000 -49.66910 -47.93157 1.73753 1.84274 -47.92367 546.35230
2675.0000 -49.42704 -47.70124 1.72581 1.83430 -47.98795 526.16682
2680.0000 -49.37971 -47.54382 1.83589 1.87276 -47.69520 581.09208
2685.0000 -49.33261 -47.72055 1.61206 1.88311 -47.61641 595.50990
2690.0000 -49.79344 -48.07132 1.72212 1.86240 -47.77402 603.86779
2695.0000 -49.50821 -48.32788 1.18033 1.81709 -48.11891 512.64208
2700.0000 -49.25197 -48.16986 1.08210 1.81009 -48.17222 455.19823
2705.0000 -49.26288 -47.99058 1.27230 1.82519 -48.05725 485.36397
2710.0000 -49.14090 -47.53740 1.60350 1.88392 -47.61027 575.52958
2715.0000 -48.88137 -47.08022 1.80114 1.89094 -47.55681 577.79433
2720.0000 -49.44064 -47.98248 1.45816 1.89945 -47.49203 612.35772
2725.0000 -49.84461 -48.16970 1.67491 1.84887 -47.87699 555.16225
2730.0000 -49.63383 -48.22907 1.40476 1.80243 -48.23048 515.51025
2735.0000 -49.61592 -48.07683 1.53909 1.80422 -48.21685 507.08041
2740.0000 -49.21239 -47.91340 1.29899 1.81025 -48.17102 501.76626
2745.0000 -49.12376 -47.15990 1.96387 1.89388 -47.53446 591.81371
2750.0000 -49.59165 -47.68507 1.90658 1.88492 -47.60264 580.87859
MELTING PROCESS: loop number 12 T-loop= 575.00000000000000
main_MD> interactions number 12 at Temperature= 575.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.60947 0.11986 -1.03799
force_rgl> df(natom) -0.51283 -0.68679 -1.67831
2755.0000 -49.59808 -48.20638 1.39170 1.85293 -47.84613 570.33743
2760.0000 -49.36468 -47.87648 1.48820 1.81991 -48.09743 513.44840
2765.0000 -49.24345 -47.85285 1.39059 1.82686 -48.04459 517.39170
2770.0000 -49.31982 -48.14624 1.17358 1.82974 -48.02266 524.56166
2775.0000 -49.30975 -47.79821 1.51154 1.83578 -47.97665 536.38352
2780.0000 -49.02706 -47.61221 1.41486 1.85420 -47.83643 542.78002
2785.0000 -49.15833 -47.59357 1.56476 1.87159 -47.70411 579.50841
2790.0000 -49.57211 -47.87348 1.69863 1.86569 -47.74897 574.28663
2795.0000 -49.31167 -48.04399 1.26768 1.87859 -47.65084 570.14530
2800.0000 -48.96885 -47.28629 1.68256 1.87837 -47.65249 580.51752
2805.0000 -48.91134 -47.39532 1.51603 1.87564 -47.67323 598.06223
2810.0000 -49.51527 -48.06875 1.44652 1.86636 -47.74392 573.48075
2815.0000 -49.17869 -47.38516 1.79353 1.81892 -48.10502 509.03127
2820.0000 -49.25831 -47.54908 1.70924 1.88818 -47.57778 584.54466
2825.0000 -49.42186 -48.24739 1.17447 1.88434 -47.60706 589.56420
2830.0000 -48.66399 -46.86537 1.79862 1.86356 -47.76518 555.60883
2835.0000 -48.81492 -47.14907 1.66584 1.94653 -47.13365 626.79291
2840.0000 -49.10667 -47.50913 1.59754 1.90307 -47.46447 598.28696
2845.0000 -49.54598 -47.79640 1.74958 1.89014 -47.56288 571.26551
2850.0000 -48.66633 -47.45747 1.20886 1.86310 -47.76874 544.11103
2855.0000 -49.54012 -47.72408 1.81604 1.89174 -47.55071 612.88290
2860.0000 -49.20389 -47.41806 1.78583 1.88148 -47.62878 581.43589
2865.0000 -49.80585 -47.96316 1.84270 1.89680 -47.51223 618.03767
2870.0000 -49.26344 -47.68740 1.57605 1.83520 -47.98104 544.63126
2875.0000 -49.15583 -47.72782 1.42801 1.88338 -47.61432 639.06336
2880.0000 -49.32024 -48.39498 0.92526 1.83444 -47.98685 493.73985
2885.0000 -49.59777 -48.15202 1.44575 1.83545 -47.97919 536.26909
2890.0000 -49.47421 -48.07601 1.39819 1.82071 -48.09139 479.34668
2895.0000 -49.51912 -47.46104 2.05808 1.84590 -47.89966 544.67241
2900.0000 -48.55348 -46.75937 1.79412 1.95605 -47.06119 683.85178
2905.0000 -49.31402 -47.63116 1.68286 1.92196 -47.32066 618.34132
2910.0000 -49.35977 -48.19997 1.15980 1.85175 -47.85514 525.10344
2915.0000 -49.70955 -48.47960 1.22995 1.82257 -48.07724 499.94016
2920.0000 -49.57557 -48.07579 1.49978 1.79258 -48.30546 474.85125
2925.0000 -48.32953 -46.68615 1.64338 1.94909 -47.11420 649.64248
2930.0000 -48.94622 -46.74745 2.19877 2.00677 -46.67516 672.78844
2935.0000 -48.97188 -47.32513 1.64675 1.98421 -46.84689 647.65782
2940.0000 -49.52002 -47.88598 1.63403 1.92254 -47.31628 640.70659
2945.0000 -49.54767 -48.01826 1.52941 1.82904 -48.02797 524.20426
2950.0000 -49.10685 -47.76334 1.34351 1.84075 -47.93885 538.56256
2955.0000 -48.81539 -47.40369 1.41171 1.87633 -47.66800 540.36585
2960.0000 -48.89621 -46.71414 2.18207 1.94971 -47.10949 648.96329
2965.0000 -48.33173 -46.72915 1.60258 2.01369 -46.62244 714.33506
2970.0000 -48.52347 -46.85699 1.66648 1.99251 -46.78372 691.14301
2975.0000 -48.74820 -47.16732 1.58087 1.90616 -47.44096 625.86388
2980.0000 -49.03023 -47.68304 1.34719 1.92996 -47.25978 610.23189
2985.0000 -48.97488 -47.28348 1.69141 1.91655 -47.36189 624.02537
2990.0000 -49.35775 -47.55920 1.79855 1.91119 -47.40267 591.62661
2995.0000 -49.74503 -48.57574 1.16928 1.82998 -48.02077 533.97583
3000.0000 -49.93183 -49.06777 0.86407 1.75099 -48.62205 425.15303
MELTING PROCESS: loop number 13 T-loop= 600.00000000000000
main_MD> interactions number 13 at Temperature= 600.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.36124 0.23250 -0.98593
force_rgl> df(natom) -0.67284 -0.43091 -3.27056
3005.0000 -49.61783 -48.30329 1.31454 1.75127 -48.61990 414.45692
3010.0000 -48.98500 -47.73819 1.24681 1.86406 -47.76140 570.87276
3015.0000 -48.96396 -47.50810 1.45586 1.90421 -47.45581 610.53986
3020.0000 -49.05420 -47.39218 1.66202 1.90442 -47.45419 597.92333
3025.0000 -49.03127 -47.18232 1.84896 1.90908 -47.41873 594.18566
3030.0000 -49.09993 -47.23714 1.86279 1.93584 -47.21505 593.42632
3035.0000 -49.53045 -47.66074 1.86971 1.89380 -47.53505 588.23465
3040.0000 -49.09146 -47.33468 1.75678 1.89562 -47.52120 595.25895
3045.0000 -49.32502 -48.24225 1.08277 1.87244 -47.69760 576.77473
3050.0000 -49.41697 -47.89346 1.52350 1.86001 -47.79224 560.81577
3055.0000 -49.33695 -48.04674 1.29021 1.84499 -47.90654 537.52987
3060.0000 -48.74502 -47.67458 1.07044 1.82742 -48.04026 499.47024
3065.0000 -49.22690 -47.26752 1.95938 1.89266 -47.54369 589.98155
3070.0000 -49.60809 -48.24106 1.36703 1.85036 -47.86569 537.25330
3075.0000 -49.30693 -47.85993 1.44700 1.81010 -48.17215 515.93276
3080.0000 -49.59217 -48.54816 1.04401 1.82589 -48.05193 515.55572
3085.0000 -49.56091 -48.26926 1.29165 1.76567 -48.51030 453.87004
3090.0000 -49.83760 -48.29436 1.54324 1.81495 -48.13522 511.59424
3095.0000 -49.24932 -47.90467 1.34465 1.87274 -47.69535 591.68732
3100.0000 -49.50151 -47.92504 1.57646 1.84798 -47.88384 543.18395
3105.0000 -49.35922 -47.98437 1.37485 1.85202 -47.85307 565.25828
3110.0000 -49.57268 -48.34742 1.22527 1.83466 -47.98517 526.21490
3115.0000 -49.26116 -47.14388 2.11727 1.85363 -47.84083 543.87620
3120.0000 -48.98737 -46.78195 2.20542 1.98417 -46.84714 712.16280
3125.0000 -49.19649 -47.87832 1.31817 1.91965 -47.33824 658.45175
3130.0000 -48.82419 -47.43876 1.38543 1.87866 -47.65028 550.43052
3135.0000 -49.44615 -47.56260 1.88355 1.90596 -47.44249 560.91751
3140.0000 -49.44229 -47.43335 2.00893 1.88095 -47.63288 596.02529
3145.0000 -48.93703 -47.34874 1.58829 1.93221 -47.24269 630.18325
3150.0000 -49.32216 -47.61392 1.70824 1.93459 -47.22457 668.06940
3155.0000 -49.16059 -47.74900 1.41159 1.88610 -47.59361 601.06725
3160.0000 -48.94891 -47.40091 1.54800 1.85519 -47.82893 563.79223
3165.0000 -49.33436 -47.88104 1.45333 1.91163 -47.39934 620.61859
3170.0000 -48.95033 -47.83722 1.11311 1.91953 -47.33920 588.82214
3175.0000 -48.91764 -47.05913 1.85850 1.88452 -47.60569 494.66542
3180.0000 -49.40298 -46.94021 2.46277 1.90540 -47.44673 613.38337
3185.0000 -49.47058 -47.58771 1.88287 1.88458 -47.60519 587.90444
3190.0000 -49.06086 -47.83597 1.22489 1.86750 -47.73520 549.15737
3195.0000 -49.10322 -48.01092 1.09230 1.86387 -47.76285 564.10202
3200.0000 -49.85513 -48.37487 1.48027 1.82050 -48.09296 512.49480
3205.0000 -49.24390 -46.88625 2.35765 1.87135 -47.70592 574.50558
3210.0000 -48.91406 -47.21624 1.69782 1.97204 -46.93952 683.85749
3215.0000 -49.09785 -47.81597 1.28188 1.94106 -47.17531 670.83129
3220.0000 -48.93771 -47.33748 1.60023 1.89641 -47.51520 603.30464
3225.0000 -48.98878 -47.69861 1.29017 1.89526 -47.52389 589.57103
3230.0000 -49.68114 -47.59177 2.08937 1.91870 -47.34549 620.53778
3235.0000 -49.40148 -47.68854 1.71294 1.88604 -47.59412 644.09348
3240.0000 -48.58002 -46.62466 1.95535 1.98796 -46.81831 699.85278
3245.0000 -48.73468 -46.76773 1.96694 1.97618 -46.90797 669.11185
3250.0000 -48.59944 -46.70747 1.89197 2.03800 -46.43745 788.33288
MELTING PROCESS: loop number 14 T-loop= 625.00000000000000
main_MD> interactions number 14 at Temperature= 625.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -2.47299 -1.48628 2.69354
force_rgl> df(natom) 0.39706 -0.13790 2.79828
3255.0000 -49.58767 -46.89345 2.69421 2.03396 -46.46821 746.69939
3260.0000 -49.09574 -47.05255 2.04319 1.92943 -47.26381 665.12993
3265.0000 -49.35581 -47.32144 2.03437 1.95148 -47.09599 691.44678
3270.0000 -49.13436 -47.29553 1.83883 1.93507 -47.22091 634.55598
3275.0000 -49.17650 -47.13990 2.03661 1.92885 -47.26824 650.36558
3280.0000 -48.39242 -47.09389 1.29853 1.95590 -47.06237 650.45515
3285.0000 -49.43636 -47.55336 1.88300 1.91411 -47.38044 611.60650
3290.0000 -48.51139 -47.34822 1.16317 1.88910 -47.57081 594.04465
3295.0000 -49.05882 -47.13139 1.92743 1.93679 -47.20783 653.84396
3300.0000 -48.85233 -47.39958 1.45276 1.87472 -47.68027 598.23828
3305.0000 -49.10092 -46.43939 2.66153 1.95956 -47.03447 694.31705
3310.0000 -47.97026 -46.25082 1.71944 2.06240 -46.25172 765.37609
3315.0000 -48.33444 -46.44124 1.89320 2.03503 -46.46003 769.80736
3320.0000 -48.58139 -46.89621 1.68518 2.01570 -46.60721 756.32477
3325.0000 -49.31510 -47.60052 1.71458 1.93086 -47.25293 644.94475
3330.0000 -49.31608 -47.75759 1.55849 1.92208 -47.31979 642.85423
3335.0000 -49.54544 -48.09129 1.45415 1.85489 -47.83117 523.42370
3340.0000 -49.36582 -47.96566 1.40016 1.81805 -48.11160 487.70177
3345.0000 -49.62932 -47.68791 1.94141 1.85634 -47.82018 559.23729
3350.0000 -49.11725 -47.17815 1.93910 1.92097 -47.32823 643.42045
3355.0000 -49.09685 -47.45522 1.64163 1.88718 -47.58540 591.71514
3360.0000 -48.72640 -47.10358 1.62282 1.92913 -47.26611 638.36070
3365.0000 -49.01067 -46.97251 2.03816 1.96211 -47.01507 668.89534
3370.0000 -49.18502 -47.70089 1.48413 1.92763 -47.27750 651.38470
3375.0000 -48.65817 -46.87651 1.78166 1.91628 -47.36395 593.32580
3380.0000 -49.09953 -47.20381 1.89572 1.97479 -46.91856 700.45764
3385.0000 -48.97983 -47.27789 1.70194 1.96040 -47.02806 672.97552
3390.0000 -48.59572 -46.62304 1.97268 1.93154 -47.24779 670.62670
3395.0000 -47.71376 -46.56793 1.14583 2.01167 -46.63787 734.60247
3400.0000 -48.69635 -47.03958 1.65678 1.98473 -46.84289 664.62062
3405.0000 -49.40620 -47.07115 2.33505 1.96623 -46.98375 690.32030
3410.0000 -49.27780 -47.97905 1.29874 1.83526 -47.98064 556.02392
3415.0000 -48.76195 -46.62135 2.14060 1.92917 -47.26578 646.92896
3420.0000 -48.95060 -46.74153 2.20907 2.01059 -46.64609 732.64409
3425.0000 -48.73486 -47.28173 1.45313 1.99101 -46.79513 705.78042
3430.0000 -48.84272 -47.15989 1.68283 1.91766 -47.35345 631.06151
3435.0000 -48.19090 -46.66970 1.52120 1.97193 -46.94030 678.67590
3440.0000 -48.53499 -46.95648 1.57851 2.04113 -46.41364 736.13758
3445.0000 -49.62157 -47.64851 1.97306 1.91930 -47.34090 588.94037
3450.0000 -49.02083 -47.62703 1.39380 1.86501 -47.75419 531.72885
3455.0000 -49.09505 -47.18854 1.90651 1.89957 -47.49113 579.80384
3460.0000 -48.80898 -46.77149 2.03749 1.94770 -47.12474 658.52173
3465.0000 -48.59733 -46.67313 1.92420 1.98509 -46.84016 721.48194
3470.0000 -49.75663 -47.95500 1.80163 1.89930 -47.49319 584.81382
3475.0000 -49.11808 -47.33888 1.77921 1.88123 -47.63069 589.51057
3480.0000 -49.37863 -47.93103 1.44760 1.87569 -47.67290 571.77697
3485.0000 -48.93894 -47.08267 1.85627 1.90498 -47.44996 597.94267
3490.0000 -48.54050 -47.05333 1.48717 1.92186 -47.32143 619.43986
3495.0000 -48.52024 -46.82899 1.69125 1.95472 -47.07136 597.97004
3500.0000 -49.07806 -47.15624 1.92182 1.90873 -47.42143 576.88798
MELTING PROCESS: loop number 15 T-loop= 650.00000000000000
main_MD> interactions number 15 at Temperature= 650.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -2.36777 -2.08344 -2.01712
force_rgl> df(natom) 0.56442 2.30161 -0.71510
3505.0000 -48.67989 -46.72652 1.95337 1.95243 -47.08873 642.03727
3510.0000 -49.25872 -47.50653 1.75219 1.90839 -47.42401 649.21183
3515.0000 -49.73394 -47.28801 2.44592 1.86476 -47.75605 574.49107
3520.0000 -48.94239 -47.73656 1.20583 1.91619 -47.36460 622.24978
3525.0000 -49.06003 -47.80638 1.25364 1.84491 -47.90714 521.87451
3530.0000 -48.11955 -46.05926 2.06029 1.96021 -47.02957 617.65071
3535.0000 -48.66222 -46.95791 1.70431 2.05685 -46.29397 776.08543
3540.0000 -48.31042 -46.67397 1.63645 1.96757 -46.97355 635.16620
3545.0000 -48.99529 -46.87181 2.12348 1.96319 -47.00683 669.66815
3550.0000 -48.71717 -47.10782 1.60936 1.98707 -46.82512 726.67358
3555.0000 -48.57612 -46.99961 1.57652 1.97902 -46.88635 668.85017
3560.0000 -48.82206 -47.33516 1.48690 1.95611 -47.06077 647.60072
3565.0000 -48.63954 -46.49363 2.14592 1.99564 -46.75986 694.63058
3570.0000 -48.25508 -46.16369 2.09138 2.02545 -46.53299 734.98467
3575.0000 -48.68593 -46.94540 1.74053 2.02917 -46.50464 701.70966
3580.0000 -47.62019 -46.27008 1.35011 2.01253 -46.63133 660.15802
3585.0000 -48.16020 -46.02720 2.13300 2.07537 -46.15299 759.30639
3590.0000 -47.89412 -46.45962 1.43449 2.09363 -46.01398 753.01724
3595.0000 -48.35904 -46.15750 2.20155 2.05476 -46.30984 714.25467
3600.0000 -48.50074 -46.03918 2.46156 2.09312 -46.01785 741.23286
3605.0000 -48.15883 -46.32960 1.82923 2.05271 -46.32545 701.87745
3610.0000 -48.14592 -45.98661 2.15931 2.01355 -46.62350 736.32741
3615.0000 -48.21290 -45.92456 2.28835 2.10765 -45.90728 837.94798
3620.0000 -48.51915 -46.62653 1.89262 2.07342 -46.16781 691.33921
3625.0000 -47.93590 -46.30559 1.63031 2.02352 -46.54764 685.12237
3630.0000 -48.17441 -46.35445 1.81996 2.08387 -46.08825 791.46408
3635.0000 -48.88154 -47.08674 1.79480 1.98204 -46.86335 617.77881
3640.0000 -48.68411 -47.10734 1.57677 1.96496 -46.99340 638.72179
3645.0000 -48.71378 -47.06883 1.64495 1.98792 -46.81863 654.72609
3650.0000 -49.27950 -47.82898 1.45051 1.96874 -46.96460 694.23993
3655.0000 -49.06353 -47.33841 1.72512 1.94182 -47.16953 693.19840
3660.0000 -49.07469 -47.19546 1.87923 1.97361 -46.92757 701.19009
3665.0000 -49.04699 -47.27623 1.77076 1.92147 -47.32445 615.49316
3670.0000 -48.93292 -47.35306 1.57986 1.90037 -47.48503 582.78620
3675.0000 -48.80763 -46.51799 2.28965 2.01666 -46.59985 759.90829
3680.0000 -48.90353 -47.35996 1.54357 1.95416 -47.07561 632.45441
3685.0000 -49.32537 -48.01886 1.30652 1.90306 -47.46452 625.72966
3690.0000 -49.49722 -48.33024 1.16698 1.78617 -48.35426 437.94438
3695.0000 -48.82000 -47.51635 1.30366 1.83641 -47.97183 498.09589
3700.0000 -49.27439 -47.67843 1.59596 1.87227 -47.69894 529.52026
3705.0000 -48.87067 -47.07180 1.79888 1.93729 -47.20401 665.25306
3710.0000 -48.51531 -47.31038 1.20493 1.92951 -47.26321 661.37481
3715.0000 -48.46854 -46.77850 1.69003 1.98191 -46.86438 686.56319
3720.0000 -49.28137 -47.57940 1.70197 1.92053 -47.33155 642.23562
3725.0000 -48.66468 -46.97234 1.69234 1.93677 -47.20793 668.90673
3730.0000 -48.74584 -46.60119 2.14465 2.00868 -46.66060 697.18021
3735.0000 -49.11040 -47.42565 1.68475 1.92075 -47.32991 621.07252
3740.0000 -48.98162 -46.87935 2.10227 2.00070 -46.72136 663.21941
3745.0000 -48.64810 -46.93054 1.71756 1.99921 -46.73269 684.22855
3750.0000 -48.93599 -46.82136 2.11464 1.96954 -46.95854 644.97924
MELTING PROCESS: loop number 16 T-loop= 675.00000000000000
main_MD> interactions number 16 at Temperature= 675.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -4.60121 -2.74643 0.89906
force_rgl> df(natom) 1.13567 0.62246 2.09779
3755.0000 -48.95766 -46.60624 2.35142 1.98088 -46.87218 676.49855
3760.0000 -48.05548 -45.42515 2.63033 2.12143 -45.80243 855.41207
3765.0000 -48.55704 -46.99986 1.55718 2.09639 -45.99297 768.84936
3770.0000 -48.83633 -47.10304 1.73329 2.03788 -46.43833 752.62730
3775.0000 -49.25902 -47.36921 1.88982 1.93874 -47.19294 637.16456
3780.0000 -48.39638 -46.40311 1.99328 1.94298 -47.16066 644.27079
3785.0000 -48.18828 -45.47913 2.70915 2.10485 -45.92860 858.84498
3790.0000 -48.25990 -46.03514 2.22476 2.14452 -45.62664 793.14111
3795.0000 -48.32991 -46.40925 1.92066 2.08055 -46.11352 725.83307
3800.0000 -47.51747 -45.17902 2.33844 2.11083 -45.88307 806.06909
3805.0000 -48.27336 -46.40578 1.86758 2.08902 -46.04911 817.87292
3810.0000 -48.90660 -47.00656 1.90004 1.97956 -46.88224 704.43387
3815.0000 -47.94713 -46.67010 1.27704 1.99077 -46.79693 718.73409
3820.0000 -48.10114 -46.04689 2.05425 2.07417 -46.16208 727.28280
3825.0000 -48.36925 -46.91334 1.45591 2.00172 -46.71361 655.83893
3830.0000 -48.30576 -46.01420 2.29155 2.04450 -46.38793 693.36482
3835.0000 -47.81761 -46.39754 1.42007 2.04542 -46.38092 707.23179
3840.0000 -48.33707 -46.47060 1.86647 2.02142 -46.56360 728.99942
3845.0000 -49.31022 -47.65338 1.65683 1.95846 -47.04287 663.49757
3850.0000 -49.52360 -47.26134 2.26226 1.92994 -47.25996 638.38035
3855.0000 -49.22942 -47.40705 1.82237 1.95648 -47.05797 654.95871
3860.0000 -49.27309 -47.72800 1.54510 1.85911 -47.79909 555.53963
3865.0000 -48.77517 -46.78834 1.98683 1.96656 -46.98120 657.59978
3870.0000 -48.59374 -46.94164 1.65210 1.95219 -47.09061 665.06424
3875.0000 -48.62120 -47.12431 1.49689 1.93419 -47.22759 649.31957
3880.0000 -49.08560 -47.59825 1.48735 1.95081 -47.10107 669.94562
3885.0000 -48.83858 -47.34273 1.49585 1.90051 -47.48396 621.45439
3890.0000 -49.22128 -47.52147 1.69981 1.91141 -47.40103 643.17803
3895.0000 -48.50731 -46.67993 1.82739 1.98048 -46.87526 664.13646
3900.0000 -48.69365 -46.77316 1.92049 2.00699 -46.67344 644.26374
3905.0000 -48.32746 -46.76142 1.56604 1.94557 -47.14099 660.63464
3910.0000 -48.92772 -47.24310 1.68462 1.96258 -47.01151 659.62842
3915.0000 -49.52807 -48.11862 1.40945 1.87980 -47.64159 604.37550
3920.0000 -48.81675 -47.05907 1.75768 1.89576 -47.52013 624.53057
3925.0000 -49.20290 -47.55243 1.65048 1.93456 -47.22477 636.26381
3930.0000 -49.19025 -47.48696 1.70329 1.84376 -47.91594 540.43749
3935.0000 -49.14447 -47.53721 1.60726 1.91943 -47.33998 633.57448
3940.0000 -49.16002 -48.08072 1.07930 1.87457 -47.68144 562.75997
3945.0000 -48.32327 -46.73278 1.59049 1.90900 -47.41934 598.81556
3950.0000 -49.49578 -47.91163 1.58415 1.90503 -47.44956 621.15254
3955.0000 -49.05454 -47.23820 1.81633 1.90931 -47.41694 635.17807
3960.0000 -49.31526 -47.58827 1.72699 1.90952 -47.41537 594.33141
3965.0000 -48.93004 -47.52363 1.40641 1.92513 -47.29654 686.46435
3970.0000 -49.04419 -46.69142 2.35277 1.95049 -47.10350 665.98408
3975.0000 -48.91840 -47.02543 1.89296 1.96159 -47.01905 659.21169
3980.0000 -48.68884 -46.92959 1.75925 1.95639 -47.05861 620.03707
3985.0000 -48.63814 -47.13961 1.49853 1.95911 -47.03793 668.66772
3990.0000 -48.62156 -46.52289 2.09866 1.99010 -46.80204 705.50851
3995.0000 -49.09000 -47.80624 1.28376 1.92431 -47.30281 630.19962
4000.0000 -48.79406 -46.63634 2.15773 1.92773 -47.27674 646.62291
MELTING PROCESS: loop number 17 T-loop= 700.00000000000000
main_MD> interactions number 17 at Temperature= 700.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.00580 1.65256 0.64911
force_rgl> df(natom) 0.84689 2.60821 -1.70039
4005.0000 -49.03546 -47.18081 1.85465 2.00590 -46.68179 711.80392
4010.0000 -48.45173 -46.68958 1.76215 1.95864 -47.04146 624.84669
4015.0000 -48.96920 -47.35213 1.61707 1.91157 -47.39976 650.68280
4020.0000 -49.40753 -47.09967 2.30786 1.95086 -47.10071 678.65386
4025.0000 -48.49315 -47.02466 1.46849 2.00607 -46.68047 755.59572
4030.0000 -48.70884 -47.03335 1.67548 1.97940 -46.88345 722.40389
4035.0000 -48.48762 -46.31131 2.17631 2.01716 -46.59606 739.91025
4040.0000 -48.16491 -46.86154 1.30337 2.04801 -46.36122 712.90326
4045.0000 -48.77622 -46.82931 1.94691 1.97633 -46.90683 606.52078
4050.0000 -48.24142 -46.43387 1.80755 2.05721 -46.29121 713.99517
4055.0000 -49.04365 -47.41989 1.62377 2.01945 -46.57863 683.92595
4060.0000 -48.98322 -47.40113 1.58208 1.92937 -47.26432 625.63520
4065.0000 -48.66787 -47.00531 1.66256 1.92779 -47.27629 620.73201
4070.0000 -49.03348 -47.13622 1.89726 1.91242 -47.39328 602.09959
4075.0000 -48.57108 -46.73691 1.83416 1.93189 -47.24508 650.35194
4080.0000 -49.18308 -47.43457 1.74851 1.94925 -47.11299 692.94741
4085.0000 -48.50512 -46.94045 1.56467 1.96599 -46.98553 699.53239
4090.0000 -48.59872 -46.94320 1.65552 1.98418 -46.84709 687.14176
4095.0000 -49.38824 -47.34906 2.03918 1.91242 -47.39333 621.31255
4100.0000 -49.43769 -47.02255 2.41514 1.96656 -46.98120 701.83549
4105.0000 -48.93687 -47.17215 1.76473 1.96398 -47.00084 680.74374
4110.0000 -48.74650 -47.50191 1.24460 1.92348 -47.30915 636.58000
4115.0000 -48.83295 -47.40511 1.42784 1.90001 -47.48776 605.72491
4120.0000 -48.99022 -47.13284 1.85738 1.96721 -46.97627 674.36882
4125.0000 -48.61475 -46.99864 1.61611 1.96327 -47.00625 703.94927
4130.0000 -49.40580 -46.89608 2.50973 1.98467 -46.84336 677.88280
4135.0000 -49.19895 -47.55231 1.64665 1.92340 -47.30970 646.18975
4140.0000 -48.66774 -47.08165 1.58609 1.91719 -47.35700 645.34295
4145.0000 -48.84040 -46.85241 1.98799 1.99223 -46.78584 702.12657
4150.0000 -48.96203 -47.37641 1.58561 1.91329 -47.38668 633.19513
4155.0000 -48.68009 -47.16889 1.51120 1.89708 -47.51009 622.73137
4160.0000 -49.13289 -47.30319 1.82970 1.94396 -47.15320 668.50305
4165.0000 -48.60386 -47.22023 1.38363 1.95909 -47.03803 675.00822
4170.0000 -48.65361 -46.56466 2.08896 1.96592 -46.98607 672.05793
4175.0000 -48.46753 -46.63354 1.83398 2.03145 -46.48728 733.61976
4180.0000 -48.23011 -46.19360 2.03651 2.07175 -46.18052 747.17483
4185.0000 -48.49375 -46.23553 2.25823 2.07170 -46.18095 757.93118
4190.0000 -48.43879 -45.93559 2.50320 2.07441 -46.16027 759.25501
4195.0000 -48.27870 -46.56138 1.71732 2.09681 -45.98979 783.82871
4200.0000 -48.15206 -46.63031 1.52175 1.98568 -46.83568 599.56370
4205.0000 -48.85170 -46.96105 1.89065 2.06077 -46.26410 757.76773
4210.0000 -49.73194 -48.01116 1.72079 1.88866 -47.57420 583.43640
4215.0000 -49.27819 -46.91095 2.36724 1.92223 -47.31862 653.86369
4220.0000 -48.72349 -47.18125 1.54224 1.95972 -47.03330 657.81507
4225.0000 -49.19713 -47.49569 1.70145 1.89262 -47.54401 598.87200
4230.0000 -48.61705 -47.09344 1.52361 1.91793 -47.35140 609.32672
4235.0000 -49.05747 -46.73813 2.31934 1.95154 -47.09553 616.77175
4240.0000 -48.46796 -46.50577 1.96219 2.03230 -46.48082 708.51729
4245.0000 -47.85097 -46.05944 1.79153 2.10100 -45.95793 775.83254
4250.0000 -48.24391 -46.38266 1.86125 2.04746 -46.36544 761.58733
MELTING PROCESS: loop number 18 T-loop= 725.00000000000000
main_MD> interactions number 18 at Temperature= 725.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.33537 2.05079 -0.38254
force_rgl> df(natom) -0.51922 -3.14203 -1.17416
4255.0000 -48.02108 -45.73931 2.28176 2.09836 -45.97796 751.00595
4260.0000 -48.30777 -45.77951 2.52827 2.11204 -45.87384 774.44377
4265.0000 -47.58360 -45.60326 1.98034 2.10921 -45.89541 771.95322
4270.0000 -47.23786 -45.14340 2.09446 2.19897 -45.21216 868.79355
4275.0000 -47.15832 -44.62476 2.53356 2.26612 -44.70109 906.36596
4280.0000 -47.01219 -44.62007 2.39212 2.27596 -44.62619 972.25343
4285.0000 -48.45369 -45.86606 2.58764 2.22699 -44.99893 889.95199
4290.0000 -48.77994 -46.37079 2.40915 2.10281 -45.94412 811.98888
4295.0000 -48.56484 -46.42088 2.14396 2.01322 -46.62603 701.50758
4300.0000 -48.18932 -45.46965 2.71967 2.11565 -45.84637 842.57399
4305.0000 -48.26001 -46.02287 2.23713 2.12088 -45.80660 845.23792
4310.0000 -48.37006 -46.02786 2.34220 2.08784 -46.05805 811.26671
4315.0000 -48.48071 -46.30651 2.17420 2.07911 -46.12449 798.09305
4320.0000 -48.66365 -46.27650 2.38716 2.08831 -46.05448 860.18875
4325.0000 -47.75725 -45.54944 2.20781 2.09215 -46.02524 810.67592
4330.0000 -48.01511 -46.12076 1.89435 2.15308 -45.56150 826.95540
4335.0000 -47.48546 -45.47932 2.00614 2.14271 -45.64044 800.72000
4340.0000 -48.42258 -46.43141 1.99117 2.11409 -45.85829 789.23977
4345.0000 -48.59844 -46.56205 2.03640 2.04034 -46.41963 726.20429
4350.0000 -49.21326 -47.29905 1.91421 2.00660 -46.67642 708.23259
4355.0000 -48.83666 -46.80320 2.03346 1.92643 -47.28666 641.82780
4360.0000 -47.52355 -45.10538 2.41817 2.14098 -45.65359 860.74509
4365.0000 -47.31798 -45.31180 2.00618 2.20761 -45.14640 888.98658
4370.0000 -47.80428 -45.73388 2.07040 2.18280 -45.33529 879.10754
4375.0000 -48.66082 -46.69282 1.96800 2.11749 -45.83234 848.03819
4380.0000 -48.73199 -47.17596 1.55603 1.89992 -47.48842 598.70113
4385.0000 -48.35974 -45.77666 2.58309 2.04395 -46.39216 820.57320
4390.0000 -48.13715 -45.94797 2.18918 2.10657 -45.91553 829.34363
4395.0000 -48.06199 -46.05880 2.00319 2.07596 -46.14846 760.45954
4400.0000 -47.83082 -45.62233 2.20849 2.08216 -46.10132 738.07090
4405.0000 -48.48850 -46.91925 1.56925 2.10330 -45.94041 800.66073
4410.0000 -48.46032 -46.74684 1.71348 2.02208 -46.55862 734.82348
4415.0000 -48.68395 -46.76536 1.91859 2.01933 -46.57957 729.32608
4420.0000 -48.70815 -46.84462 1.86353 1.98795 -46.81841 710.61231
4425.0000 -48.80901 -47.23318 1.57583 1.95859 -47.04184 673.11881
4430.0000 -49.26124 -46.87041 2.39083 1.95684 -47.05517 646.66231
4435.0000 -48.25372 -46.42123 1.83250 2.01104 -46.64264 688.88093
4440.0000 -48.07374 -45.72508 2.34866 2.05656 -46.29616 678.24064
4445.0000 -48.39479 -46.31280 2.08199 2.08101 -46.11005 778.80836
4450.0000 -48.28481 -45.93283 2.35198 2.06816 -46.20786 744.85177
4455.0000 -49.01598 -46.54259 2.47339 2.05239 -46.32787 795.90354
4460.0000 -48.86578 -46.43592 2.42987 2.05666 -46.29539 782.37215
4465.0000 -48.61131 -46.11294 2.49837 2.05473 -46.31005 752.44449
4470.0000 -49.00128 -47.28880 1.71248 1.97606 -46.90890 674.42219
4475.0000 -48.70565 -47.04937 1.65628 1.92873 -47.26913 655.99410
4480.0000 -48.91540 -46.57556 2.33985 1.96559 -46.98860 706.26429
4485.0000 -48.14699 -46.32818 1.81880 2.04926 -46.35173 802.36303
4490.0000 -48.97973 -46.54537 2.43436 2.06824 -46.20723 769.66746
4495.0000 -49.34012 -47.35630 1.98382 1.97771 -46.89637 712.99492
4500.0000 -49.23076 -46.84837 2.38239 1.95891 -47.03941 670.52356
MELTING PROCESS: loop number 19 T-loop= 750.00000000000000
main_MD> interactions number 19 at Temperature= 750.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -3.34068 0.25045 2.58843
force_rgl> df(natom) 1.85926 0.32636 1.46474
4505.0000 -48.13071 -46.70185 1.42887 1.96943 -46.95938 718.13508
4510.0000 -48.90868 -47.04044 1.86824 1.99044 -46.79946 697.42022
4515.0000 -49.12093 -46.97695 2.14398 2.01091 -46.64361 723.20801
4520.0000 -48.42987 -46.65333 1.77654 1.97487 -46.91792 680.27076
4525.0000 -48.20658 -45.88558 2.32100 2.08796 -46.05713 808.43275
4530.0000 -48.67547 -45.59707 3.07840 2.12096 -45.80599 818.58778
4535.0000 -48.02628 -45.91140 2.11487 2.13561 -45.69447 845.12382
4540.0000 -48.79764 -46.82350 1.97413 2.08217 -46.10121 769.91683
4545.0000 -48.41960 -46.15514 2.26447 2.00053 -46.72263 722.49356
4550.0000 -48.19579 -46.04929 2.14651 2.08242 -46.09935 802.79248
4555.0000 -48.43384 -46.46198 1.97186 2.07229 -46.17640 804.40729
4560.0000 -48.71711 -47.04586 1.67125 2.01174 -46.63734 737.23267
4565.0000 -48.54349 -46.69676 1.84673 1.95220 -47.09055 672.80388
4570.0000 -48.55644 -46.29119 2.26525 2.01414 -46.61908 761.29888
4575.0000 -47.93557 -46.48174 1.45383 2.00733 -46.67088 741.83422
4580.0000 -49.02305 -46.71468 2.30836 1.99933 -46.73179 653.84712
4585.0000 -49.11498 -47.10399 2.01099 2.03075 -46.49265 724.03370
4590.0000 -49.19456 -47.60522 1.58935 1.92077 -47.32978 649.31618
4595.0000 -48.14708 -46.04840 2.09868 2.00184 -46.71270 733.37001
4600.0000 -48.55449 -46.51057 2.04393 2.09019 -46.04019 802.79158
4605.0000 -49.06880 -46.92164 2.14717 1.97946 -46.88299 699.72140
4610.0000 -47.88690 -45.47445 2.41245 2.07227 -46.17660 816.57033
4615.0000 -48.83904 -46.57638 2.26266 2.10363 -45.93788 818.08280
4620.0000 -47.91871 -46.21414 1.70457 2.03161 -46.48610 735.19142
4625.0000 -48.57607 -46.84436 1.73171 1.99330 -46.77765 714.08676
4630.0000 -48.03514 -46.16303 1.87211 2.02928 -46.50379 731.98082
4635.0000 -48.29551 -46.98919 1.30632 2.00044 -46.72331 667.49993
4640.0000 -48.79184 -46.88594 1.90590 1.99154 -46.79103 720.32332
4645.0000 -48.44260 -46.98945 1.45315 2.00037 -46.72384 720.16074
4650.0000 -48.08330 -45.85482 2.22849 2.05876 -46.27940 776.72883
4655.0000 -47.65151 -46.09357 1.55794 2.10096 -45.95819 800.25029
4660.0000 -48.80146 -46.29916 2.50230 2.07920 -46.12385 789.21137
4665.0000 -48.94722 -47.34719 1.60003 1.99125 -46.79330 708.91606
4670.0000 -48.39400 -46.05761 2.33639 2.03401 -46.46780 776.71695
4675.0000 -48.03254 -45.75809 2.27445 2.11413 -45.85799 874.44472
4680.0000 -48.15872 -46.49485 1.66387 2.08697 -46.06468 800.23715
4685.0000 -47.53655 -45.66107 1.87549 2.04379 -46.39336 743.38947
4690.0000 -49.26987 -46.33957 2.93030 2.08057 -46.11342 817.33600
4695.0000 -48.68865 -46.06129 2.62736 2.04928 -46.35155 759.41166
4700.0000 -48.22929 -45.36084 2.86845 2.11317 -45.86528 835.27820
4705.0000 -48.09615 -46.34241 1.75374 2.08163 -46.10537 834.93732
4710.0000 -48.26222 -46.82232 1.43990 2.05464 -46.31076 755.44032
4715.0000 -48.72387 -46.63822 2.08564 2.03063 -46.49355 734.41006
4720.0000 -47.48230 -45.38033 2.10197 2.11757 -45.83179 855.17291
4725.0000 -48.17742 -46.25480 1.92263 2.10108 -45.95727 895.73130
4730.0000 -48.75270 -46.71084 2.04186 1.99643 -46.75386 717.98722
4735.0000 -49.09780 -47.29472 1.80307 1.96688 -46.97881 691.72734
4740.0000 -48.84917 -46.45532 2.39385 1.95808 -47.04574 687.35518
4745.0000 -48.47898 -46.80230 1.67669 2.02814 -46.51251 766.02331
4750.0000 -48.80492 -47.02322 1.78170 2.00521 -46.68703 733.16383
MELTING PROCESS: loop number 20 T-loop= 775.00000000000000
main_MD> interactions number 20 at Temperature= 775.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.64393 -1.26858 -0.81119
force_rgl> df(natom) 0.69316 1.74257 1.35163
4755.0000 -48.61317 -46.40133 2.21184 2.00813 -46.66482 741.06178
4760.0000 -48.41854 -46.11289 2.30565 2.08529 -46.07749 806.57901
4765.0000 -48.04938 -46.96369 1.08569 2.06750 -46.21292 720.10185
4770.0000 -48.51710 -46.16895 2.34815 2.04380 -46.39331 724.23882
4775.0000 -48.44652 -46.32436 2.12216 2.03102 -46.49054 709.11173
4780.0000 -48.45979 -46.15732 2.30247 2.05779 -46.28676 787.66760
4785.0000 -48.36862 -46.17962 2.18900 2.03307 -46.47494 741.08152
4790.0000 -48.14839 -45.62095 2.52745 2.11139 -45.87880 879.27364
4795.0000 -48.30768 -45.89046 2.41722 2.10595 -45.92023 830.29506
4800.0000 -48.12869 -45.77935 2.34934 2.14746 -45.60427 895.93642
4805.0000 -48.20601 -45.84549 2.36052 2.11380 -45.86043 890.05442
4810.0000 -48.68615 -46.94505 1.74110 2.09859 -45.97624 791.43552
4815.0000 -48.11865 -46.43561 1.68304 1.97953 -46.88247 628.70857
4820.0000 -48.11162 -45.62609 2.48553 2.13279 -45.71596 816.88200
4825.0000 -48.86672 -46.85297 2.01375 2.03728 -46.44292 800.44862
4830.0000 -48.47767 -46.98079 1.49687 2.00380 -46.69779 708.91139
4835.0000 -48.30895 -46.33868 1.97027 1.96545 -46.98968 648.39623
4840.0000 -47.66859 -45.11139 2.55720 2.13465 -45.70177 859.00974
4845.0000 -48.46223 -45.82583 2.63640 2.20180 -45.19060 869.63753
4850.0000 -47.77557 -45.80761 1.96796 2.12306 -45.78997 816.76030
4855.0000 -46.69975 -44.48920 2.21056 2.16436 -45.47560 839.60096
4860.0000 -48.27430 -46.10336 2.17094 2.19625 -45.23288 845.84181
4865.0000 -48.43299 -46.44205 1.99094 2.10267 -45.94517 780.89451
4870.0000 -48.90332 -47.21875 1.68457 2.01555 -46.60834 754.74237
4875.0000 -48.76265 -46.84649 1.91616 1.97316 -46.93095 691.36381
4880.0000 -48.59709 -47.20776 1.38933 1.97485 -46.91809 674.49698
4885.0000 -48.13535 -46.57260 1.56276 1.97125 -46.94554 683.17819
4890.0000 -48.24449 -46.10884 2.13565 2.08529 -46.07748 804.29730
4895.0000 -48.28805 -46.15829 2.12976 2.09000 -46.04163 839.72259
4900.0000 -47.93098 -45.42804 2.50295 2.07390 -46.16421 821.19803
4905.0000 -49.08185 -46.51053 2.57133 2.05434 -46.31303 783.00229
4910.0000 -48.73966 -46.40730 2.33236 1.99271 -46.78214 722.93279
4915.0000 -48.93131 -46.53987 2.39144 1.98981 -46.80425 766.47415
4920.0000 -48.87334 -46.85814 2.01520 1.99098 -46.79535 768.46115
4925.0000 -47.63789 -45.96575 1.67215 2.02040 -46.57141 764.74978
4930.0000 -47.84769 -46.09189 1.75580 2.02803 -46.51335 732.58767
4935.0000 -48.53116 -46.15103 2.38013 2.05298 -46.32341 790.33885
4940.0000 -47.12888 -45.56798 1.56090 2.07648 -46.14457 775.82456
4945.0000 -48.22498 -46.58374 1.64125 2.10716 -45.91103 750.15712
4950.0000 -48.68798 -46.46085 2.22712 2.09456 -46.00691 754.13586
4955.0000 -48.46423 -46.01272 2.45152 2.03865 -46.43249 731.80437
4960.0000 -48.12240 -45.88326 2.23913 2.08663 -46.06727 755.76536
4965.0000 -47.42410 -45.21714 2.20696 2.14093 -45.65400 784.28885
4970.0000 -47.17387 -45.51345 1.66042 2.15594 -45.53971 849.60978
4975.0000 -48.15732 -46.42239 1.73493 2.13504 -45.69879 887.98891
4980.0000 -48.53819 -46.27586 2.26233 2.06528 -46.22979 827.22662
4985.0000 -48.34915 -46.26922 2.07994 2.03110 -46.48997 744.90803
4990.0000 -48.79065 -47.23995 1.55070 1.99236 -46.78485 623.74416
4995.0000 -48.53274 -47.10586 1.42687 1.94526 -47.14331 582.33875
5000.0000 -48.10777 -46.01895 2.08882 2.00776 -46.66759 675.35685
MELTING PROCESS: loop number 21 T-loop= 800.00000000000000
main_MD> interactions number 21 at Temperature= 800.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.61972 -0.74030 -2.27285
force_rgl> df(natom) 0.95571 -2.49452 0.29882
5005.0000 -48.60738 -46.78449 1.82289 1.98100 -46.87128 702.19384
5010.0000 -48.33349 -46.48226 1.85122 1.99972 -46.72883 719.22289
5015.0000 -48.08198 -45.33871 2.74327 2.12602 -45.76742 847.23996
5020.0000 -48.52990 -46.18801 2.34189 2.11395 -45.85933 826.79556
5025.0000 -47.46677 -45.26727 2.19950 2.19705 -45.22679 930.75434
5030.0000 -48.14963 -45.74191 2.40773 2.16167 -45.49611 867.03563
5035.0000 -47.77119 -44.79106 2.98014 2.23344 -44.94981 951.04763
5040.0000 -47.80934 -45.57257 2.23677 2.22884 -44.98481 937.97288
5045.0000 -47.06351 -44.89687 2.16664 2.17506 -45.39419 837.41747
5050.0000 -47.56560 -45.47510 2.09050 2.15277 -45.56381 818.76623
5055.0000 -48.59054 -47.14894 1.44160 2.05960 -46.27299 744.66206
5060.0000 -47.69901 -46.19962 1.49939 1.97966 -46.88150 671.56620
5065.0000 -48.24129 -46.11695 2.12433 2.04941 -46.35055 779.12388
5070.0000 -48.21136 -46.55508 1.65628 2.03578 -46.45430 723.42517
5075.0000 -49.13708 -46.57177 2.56531 2.00151 -46.71516 765.26333
5080.0000 -47.92375 -46.19027 1.73348 2.00067 -46.72157 753.39479
5085.0000 -47.30061 -45.32091 1.97970 2.15591 -45.53993 826.10721
5090.0000 -48.41721 -46.10873 2.30848 2.17100 -45.42506 829.96288
5095.0000 -48.35192 -46.89973 1.45219 2.08713 -46.06346 733.77905
5100.0000 -48.38270 -46.02407 2.35864 2.10951 -45.89315 802.05969
5105.0000 -47.72686 -46.05086 1.67600 2.07637 -46.14541 797.53314
5110.0000 -48.06905 -45.93448 2.13456 2.06585 -46.22544 709.75903
5115.0000 -47.85568 -45.49638 2.35930 2.14091 -45.65414 779.60558
5120.0000 -48.02187 -46.14246 1.87941 2.09193 -46.02694 772.65770
5125.0000 -49.37236 -46.98596 2.38640 2.01709 -46.59658 669.12469
5130.0000 -48.77936 -46.49552 2.28384 1.97401 -46.92454 720.52670
5135.0000 -48.44458 -46.01770 2.42688 2.07963 -46.12057 788.59815
5140.0000 -48.32564 -45.87017 2.45547 2.09664 -45.99106 811.75798
5145.0000 -47.47051 -45.12883 2.34168 2.07533 -46.15330 718.31517
5150.0000 -48.57765 -46.51742 2.06023 2.12509 -45.77454 883.28134
5155.0000 -48.11849 -46.40252 1.71598 2.06377 -46.24130 706.79311
5160.0000 -48.94461 -47.09944 1.84517 2.00315 -46.70270 710.17472
5165.0000 -48.85000 -46.66020 2.18979 1.97513 -46.91599 702.58643
5170.0000 -48.78244 -46.63790 2.14454 2.05421 -46.31403 743.57343
5175.0000 -47.62257 -45.69028 1.93229 2.10405 -45.93465 759.15719
5180.0000 -48.34736 -46.64036 1.70700 2.05565 -46.30308 761.23813
5185.0000 -47.90628 -46.04079 1.86548 2.05949 -46.27383 782.26297
5190.0000 -48.06776 -46.24775 1.82000 2.12069 -45.80804 792.23660
5195.0000 -48.50478 -45.86243 2.64234 2.12431 -45.78050 766.69633
5200.0000 -48.61062 -46.09650 2.51412 2.09715 -45.98721 881.08989
5205.0000 -48.69343 -46.70328 1.99015 2.01476 -46.61434 762.97826
5210.0000 -48.38870 -45.62379 2.76492 2.06866 -46.20403 789.81315
5215.0000 -47.76168 -46.11235 1.64933 2.11547 -45.84776 827.82201
5220.0000 -48.01323 -46.20991 1.80332 2.06115 -46.26120 732.87433
5225.0000 -46.96123 -44.97435 1.98688 2.10607 -45.91929 813.26744
5230.0000 -47.47896 -45.58856 1.89040 2.22818 -44.98988 918.89628
5235.0000 -47.63739 -45.39953 2.23786 2.18184 -45.34258 893.97986
5240.0000 -47.80074 -45.49660 2.30414 2.12138 -45.80278 811.04147
5245.0000 -48.00828 -46.19951 1.80877 2.13935 -45.66596 838.42531
5250.0000 -48.04059 -45.65881 2.38178 2.09548 -45.99989 783.65461
MELTING PROCESS: loop number 22 T-loop= 825.00000000000000
main_MD> interactions number 22 at Temperature= 825.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.76263 1.05870 2.25171
force_rgl> df(natom) 0.58231 -0.38612 1.07322
5255.0000 -48.50477 -45.44786 3.05691 2.14857 -45.59581 873.72575
5260.0000 -48.23007 -45.92135 2.30872 2.12041 -45.81018 889.99585
5265.0000 -48.53426 -46.77628 1.75798 2.05406 -46.31519 772.73977
5270.0000 -48.89067 -46.81246 2.07821 2.02836 -46.51079 786.11384
5275.0000 -48.86073 -46.50814 2.35259 2.01507 -46.61193 732.07244
5280.0000 -48.35928 -45.39203 2.96725 2.06159 -46.25784 801.21159
5285.0000 -48.65923 -46.16723 2.49200 2.08267 -46.09745 878.37034
5290.0000 -48.66139 -46.57543 2.08596 2.08522 -46.07800 858.05251
5295.0000 -48.46361 -46.90750 1.55611 1.96943 -46.95937 711.70499
5300.0000 -47.52745 -45.72893 1.79852 2.08562 -46.07495 804.37109
5305.0000 -48.60149 -46.35295 2.24854 2.08859 -46.05237 850.27424
5310.0000 -48.18666 -46.15849 2.02817 2.09426 -46.00920 856.95229
5315.0000 -47.72699 -45.89814 1.82885 2.03947 -46.42626 729.46085
5320.0000 -48.55714 -46.60123 1.95592 2.09381 -46.01264 790.25897
5325.0000 -49.10736 -47.24648 1.86088 1.99877 -46.73605 756.74195
5330.0000 -48.86126 -47.06864 1.79262 1.91578 -47.36772 611.03305
5335.0000 -48.41991 -46.52920 1.89072 1.94732 -47.12766 647.81219
5340.0000 -48.47704 -45.56058 2.91646 2.07236 -46.17586 821.65275
5345.0000 -47.88176 -44.98046 2.90130 2.12813 -45.75141 818.12125
5350.0000 -48.35177 -45.71790 2.63387 2.21047 -45.12463 894.55909
5355.0000 -46.93217 -44.80751 2.12466 2.18583 -45.31217 873.63676
5360.0000 -48.25447 -46.26757 1.98690 2.16586 -45.46424 860.23520
5365.0000 -47.83022 -45.38202 2.44819 2.13027 -45.73507 804.44353
5370.0000 -48.32403 -46.27375 2.05028 2.17465 -45.39729 899.26804
5375.0000 -48.56216 -46.12590 2.43625 2.05359 -46.31877 731.56226
5380.0000 -47.92493 -46.05366 1.87127 2.08920 -46.04771 743.41281
5385.0000 -47.86458 -45.54507 2.31951 2.14011 -45.66021 882.34940
5390.0000 -48.10450 -46.17402 1.93048 2.07460 -46.15882 820.96964
5395.0000 -47.22025 -45.33556 1.88469 2.12984 -45.73836 802.42345
5400.0000 -48.28642 -46.32693 1.95949 2.12260 -45.79352 793.65549
5405.0000 -47.98004 -45.87027 2.10977 2.11918 -45.81952 770.61282
5410.0000 -47.99662 -45.89037 2.10625 2.14404 -45.63030 827.70145
5415.0000 -47.60476 -45.67270 1.93206 2.10225 -45.94840 833.13036
5420.0000 -48.64937 -46.66442 1.98495 2.05670 -46.29506 809.90768
5425.0000 -47.97068 -45.74050 2.23018 2.11216 -45.87296 839.51667
5430.0000 -48.49002 -46.16138 2.32864 2.12428 -45.78070 880.60267
5435.0000 -48.47299 -46.24099 2.23200 2.07150 -46.18241 783.44013
5440.0000 -48.60475 -46.79254 1.81221 1.99469 -46.76711 700.58432
5445.0000 -49.29861 -46.48223 2.81637 1.97548 -46.91330 674.04113
5450.0000 -48.56443 -45.84816 2.71627 2.08533 -46.07717 838.98968
5455.0000 -47.68007 -45.28097 2.39910 2.21293 -45.10594 918.90459
5460.0000 -48.04537 -46.07854 1.96682 2.20745 -45.14767 900.92623
5465.0000 -48.78385 -46.76041 2.02344 2.06644 -46.22098 759.94640
5470.0000 -48.52573 -47.01767 1.50806 2.03280 -46.47703 758.43581
5475.0000 -47.96457 -46.73722 1.22735 2.02648 -46.52512 708.24638
5480.0000 -48.11888 -46.36223 1.75665 1.98295 -46.85644 619.77767
5485.0000 -47.99336 -45.59082 2.40255 2.13990 -45.66183 798.00594
5490.0000 -47.08235 -44.84382 2.23853 2.18029 -45.35436 828.71610
5495.0000 -47.92523 -45.55562 2.36961 2.17405 -45.40183 875.10325
5500.0000 -47.68563 -44.67321 3.01242 2.20805 -45.14303 910.39715
MELTING PROCESS: loop number 23 T-loop= 850.00000000000000
main_MD> interactions number 23 at Temperature= 850.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.88810 1.33235 2.07290
force_rgl> df(natom) -0.84674 0.69428 -1.66984
5505.0000 -47.11478 -44.51839 2.59639 2.33192 -44.20024 1029.26629
5510.0000 -48.51962 -45.44195 3.07767 2.18507 -45.31797 912.70001
5515.0000 -47.59186 -44.65257 2.93929 2.19607 -45.23425 892.02739
5520.0000 -48.06792 -46.02347 2.04445 2.17954 -45.36011 859.00084
5525.0000 -47.48058 -45.45178 2.02880 2.12384 -45.78405 799.02538
5530.0000 -47.96818 -45.54066 2.42752 2.15262 -45.56496 917.87212
5535.0000 -47.53776 -45.30475 2.23301 2.21766 -45.06994 952.72877
5540.0000 -47.94790 -45.83487 2.11303 2.13102 -45.72937 793.45420
5545.0000 -48.75559 -46.47056 2.28503 2.12719 -45.75853 824.66167
5550.0000 -47.56716 -45.18904 2.37812 2.14322 -45.63650 847.12192
5555.0000 -47.80200 -45.23274 2.56926 2.17118 -45.42370 868.79305
5560.0000 -48.35593 -46.01666 2.33927 2.10874 -45.89899 872.01844
5565.0000 -48.33100 -46.41904 1.91196 2.05374 -46.31761 762.49439
5570.0000 -47.08417 -45.17215 1.91202 2.13315 -45.71320 846.70470
5575.0000 -47.81506 -45.23410 2.58096 2.27594 -44.62631 1019.58425
5580.0000 -47.73795 -44.98169 2.75626 2.27067 -44.66640 964.28763
5585.0000 -47.74107 -45.33536 2.40572 2.20044 -45.20096 938.37715
5590.0000 -47.47632 -45.11250 2.36382 2.20694 -45.15148 909.92813
5595.0000 -47.89986 -46.01738 1.88249 2.17253 -45.41345 906.52934
5600.0000 -48.04394 -45.46991 2.57402 2.17448 -45.39858 945.91575
5605.0000 -47.44619 -45.01929 2.42690 2.19962 -45.20726 920.37696
5610.0000 -47.95974 -45.93572 2.02401 2.16273 -45.48800 831.57543
5615.0000 -47.94086 -45.68633 2.25453 2.08569 -46.07441 818.50788
5620.0000 -48.10136 -45.46088 2.64049 2.14277 -45.63997 824.19711
5625.0000 -48.31797 -46.17051 2.14746 2.20356 -45.17724 916.42385
5630.0000 -48.45415 -45.83186 2.62229 2.13407 -45.70617 857.29499
5635.0000 -47.79796 -45.97896 1.81900 2.05544 -46.30470 782.84290
5640.0000 -48.25270 -45.77720 2.47550 2.10273 -45.94476 842.80776
5645.0000 -47.74904 -45.32367 2.42537 2.10759 -45.90773 865.64982
5650.0000 -47.76769 -45.16403 2.60366 2.14588 -45.61630 821.80006
5655.0000 -48.50888 -46.17740 2.33149 2.16075 -45.50307 895.83785
5660.0000 -48.15751 -46.06805 2.08945 2.05791 -46.28591 795.14049
5665.0000 -47.63206 -45.97043 1.66163 2.09431 -46.00883 827.33806
5670.0000 -47.56540 -45.29954 2.26586 2.13026 -45.73516 813.38001
5675.0000 -48.07611 -45.46228 2.61383 2.16397 -45.47858 856.45252
5680.0000 -47.43253 -44.63925 2.79329 2.23300 -44.95314 896.70353
5685.0000 -47.78089 -45.62971 2.15118 2.23089 -44.96919 948.96298
5690.0000 -47.25422 -44.57748 2.67674 2.16683 -45.45683 823.74848
5695.0000 -47.53065 -44.67538 2.85527 2.22049 -45.04838 989.36472
5700.0000 -47.23692 -44.42427 2.81265 2.30718 -44.38853 981.03880
5705.0000 -47.19101 -45.00354 2.18747 2.27803 -44.61039 1000.09224
5710.0000 -46.88898 -44.76489 2.12409 2.21040 -45.12516 886.45762
5715.0000 -46.73599 -44.28536 2.45063 2.27225 -44.65439 935.87541
5720.0000 -48.15186 -46.09318 2.05868 2.25052 -44.81977 984.69964
5725.0000 -47.77516 -45.84788 1.92728 2.08812 -46.05594 725.44598
5730.0000 -48.20509 -44.87425 3.33084 2.14581 -45.61685 857.41909
5735.0000 -47.25456 -45.04813 2.20643 2.23820 -44.91358 888.14210
5740.0000 -47.22245 -44.93247 2.28999 2.18570 -45.31320 840.24500
5745.0000 -48.14402 -46.24310 1.90092 2.16119 -45.49976 870.29683
5750.0000 -48.20061 -46.01302 2.18759 2.07168 -46.18106 780.08205
MELTING PROCESS: loop number 24 T-loop= 875.00000000000000
main_MD> interactions number 24 at Temperature= 875.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.12538 -5.55571 -0.29273
force_rgl> df(natom) -0.94941 -3.45460 1.04861
5755.0000 -48.29797 -46.26370 2.03427 2.12020 -45.81173 830.29201
5760.0000 -48.87419 -46.98841 1.88579 2.05476 -46.30982 782.12854
5765.0000 -47.99431 -46.23768 1.75663 2.02895 -46.50631 729.04304
5770.0000 -47.99720 -45.91665 2.08055 2.10721 -45.91063 811.35424
5775.0000 -47.94960 -45.84373 2.10587 2.06001 -46.26987 772.41168
5780.0000 -47.41549 -44.43672 2.97877 2.21916 -45.05853 942.46375
5785.0000 -47.54027 -45.23807 2.30220 2.30729 -44.38767 939.37212
5790.0000 -47.09211 -45.27072 1.82139 2.17665 -45.38210 836.65489
5795.0000 -47.65601 -45.63774 2.01827 2.12818 -45.75100 832.74516
5800.0000 -48.46745 -46.28323 2.18422 2.11768 -45.83094 801.32100
5805.0000 -48.58777 -46.49909 2.08868 2.05152 -46.33453 758.07399
5810.0000 -47.61778 -45.27287 2.34491 2.12506 -45.77476 892.88698
5815.0000 -46.62927 -44.24042 2.38886 2.24969 -44.82611 989.57958
5820.0000 -48.20109 -45.38251 2.81858 2.23103 -44.96812 906.52578
5825.0000 -46.26390 -44.34259 1.92131 2.21144 -45.11725 941.25643
5830.0000 -46.47983 -44.04077 2.43906 2.35562 -44.01985 950.51499
5835.0000 -48.61082 -45.64977 2.96105 2.19998 -45.20451 861.41269
5840.0000 -48.37249 -46.31214 2.06035 2.14961 -45.58787 851.53804
5845.0000 -48.50100 -46.33081 2.17019 2.09309 -46.01809 790.80864
5850.0000 -48.39603 -46.08862 2.30741 2.03502 -46.46013 797.86070
5855.0000 -47.35508 -45.70630 1.64878 2.11512 -45.85040 807.65694
5860.0000 -47.43114 -45.03471 2.39643 2.18684 -45.30450 868.53453
5865.0000 -48.05431 -45.96231 2.09201 2.11479 -45.85296 821.65979
5870.0000 -47.84545 -45.19846 2.64699 2.13751 -45.68000 917.21250
5875.0000 -47.79143 -45.44296 2.34847 2.15069 -45.57970 879.61839
5880.0000 -48.46509 -46.47997 1.98512 2.09241 -46.02329 786.61119
5885.0000 -47.52027 -45.26946 2.25082 2.18634 -45.30831 881.66762
5890.0000 -48.04891 -45.91868 2.13024 2.17281 -45.41133 889.05887
5895.0000 -48.29638 -46.17057 2.12581 2.07942 -46.12214 810.86471
5900.0000 -47.60350 -44.59373 3.00976 2.13379 -45.70831 820.91253
5905.0000 -47.91937 -45.24315 2.67622 2.29415 -44.48772 1053.07702
5910.0000 -48.73694 -47.30378 1.43316 2.12161 -45.80101 806.57734
5915.0000 -47.44385 -46.19749 1.24635 2.00898 -46.65834 693.58359
5920.0000 -48.43706 -46.22617 2.21089 2.07498 -46.15594 782.67279
5925.0000 -48.12389 -46.26550 1.85839 2.06945 -46.19801 766.64474
5930.0000 -47.18776 -45.16484 2.02292 2.14674 -45.60977 847.29917
5935.0000 -47.25296 -44.52267 2.73029 2.24994 -44.82422 963.21367
5940.0000 -46.44399 -43.74028 2.70371 2.26143 -44.73675 921.49532
5945.0000 -46.69299 -44.11424 2.57875 2.39417 -43.72638 1100.81734
5950.0000 -48.60859 -46.55563 2.05296 2.18423 -45.32441 919.14434
5955.0000 -47.90760 -45.70712 2.20049 2.07232 -46.17618 740.85412
5960.0000 -47.71434 -44.48843 3.22592 2.23064 -44.97111 946.42221
5965.0000 -47.85831 -45.24654 2.61177 2.28484 -44.55857 941.30116
5970.0000 -46.77346 -44.58247 2.19099 2.21935 -45.05707 986.42049
5975.0000 -47.26571 -44.29530 2.97041 2.29097 -44.51192 911.29558
5980.0000 -48.11665 -45.45127 2.66538 2.23743 -44.91941 1002.14557
5985.0000 -48.85125 -46.45797 2.39329 2.08447 -46.08374 817.96856
5990.0000 -47.82759 -46.06244 1.76515 2.05771 -46.28739 748.54009
5995.0000 -46.81682 -44.45446 2.36236 2.21917 -45.05839 890.93158
6000.0000 -46.75515 -44.25381 2.50134 2.32938 -44.21952 1004.23857
MELTING PROCESS: loop number 25 T-loop= 900.00000000000000
main_MD> interactions number 25 at Temperature= 900.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -2.38181 -0.05692 0.85336
force_rgl> df(natom) -0.78021 2.16893 -0.56751
6005.0000 -46.91697 -44.67957 2.23740 2.25170 -44.81085 975.20727
6010.0000 -47.15807 -44.92684 2.23123 2.25595 -44.77850 979.40779
6015.0000 -47.48076 -45.46878 2.01198 2.21786 -45.06842 930.97116
6020.0000 -47.65382 -45.58225 2.07158 2.17920 -45.36269 842.64022
6025.0000 -47.41615 -44.89197 2.52418 2.17469 -45.39696 835.98138
6030.0000 -46.87265 -44.81086 2.06179 2.22990 -44.97674 900.24180
6035.0000 -47.69032 -45.28212 2.40820 2.21649 -45.07881 900.23413
6040.0000 -48.89933 -46.84968 2.04965 2.06199 -46.25481 838.91626
6045.0000 -47.99947 -45.74063 2.25884 2.08207 -46.10200 853.50052
6050.0000 -47.74165 -44.86279 2.87886 2.11673 -45.83819 827.81668
6055.0000 -47.07752 -45.26336 1.81416 2.20558 -45.16191 886.67562
6060.0000 -47.48653 -45.31810 2.16843 2.16606 -45.46265 871.22429
6065.0000 -47.14409 -45.12994 2.01415 2.19616 -45.23357 922.20927
6070.0000 -48.17997 -45.71864 2.46133 2.14558 -45.61859 778.27449
6075.0000 -48.20037 -45.81329 2.38708 2.11980 -45.81482 821.61022
6080.0000 -48.26027 -45.69710 2.56317 2.11504 -45.85101 796.93350
6085.0000 -47.10130 -44.73390 2.36740 2.19762 -45.22246 932.54875
6090.0000 -47.66106 -44.84168 2.81938 2.20143 -45.19343 922.15838
6095.0000 -47.36064 -44.88279 2.47785 2.23212 -44.95989 899.84850
6100.0000 -46.83226 -44.74220 2.09005 2.25034 -44.82119 971.19192
6105.0000 -47.80123 -44.91639 2.88483 2.23193 -44.96128 922.07290
6110.0000 -47.07534 -45.08588 1.98946 2.22543 -45.01074 913.77796
6115.0000 -47.29358 -45.18154 2.11203 2.23245 -44.95732 935.31589
6120.0000 -48.07956 -44.68706 3.39250 2.28455 -44.56079 1002.83745
6125.0000 -47.68111 -45.62421 2.05690 2.15440 -45.55146 875.45433
6130.0000 -47.82909 -46.41230 1.41679 2.05868 -46.27999 739.64096
6135.0000 -48.51613 -46.15489 2.36124 2.08714 -46.06337 761.21627
6140.0000 -47.59253 -45.21520 2.37733 2.17443 -45.39900 888.10843
6145.0000 -47.94816 -45.22289 2.72528 2.19390 -45.25077 936.44137
6150.0000 -48.12470 -45.23927 2.88544 2.23644 -44.92696 855.24303
6155.0000 -47.84390 -45.10824 2.73566 2.20160 -45.19213 873.74601
6160.0000 -47.49983 -45.20499 2.29484 2.24680 -44.84809 980.12394
6165.0000 -47.72526 -44.56636 3.15890 2.20343 -45.17826 923.73372
6170.0000 -46.47062 -43.98303 2.48759 2.31410 -44.33586 1125.40753
6175.0000 -47.12246 -44.46943 2.65303 2.31466 -44.33158 1011.96176
6180.0000 -47.62169 -44.74558 2.87611 2.33409 -44.18372 1035.24342
6185.0000 -47.60633 -45.28258 2.32376 2.17301 -45.40981 874.81117
6190.0000 -47.42992 -45.06663 2.36329 2.16511 -45.46992 893.65875
6195.0000 -48.33814 -45.91839 2.41975 2.14249 -45.64210 897.94794
6200.0000 -46.56778 -43.78047 2.78731 2.26471 -44.71176 989.90794
6205.0000 -47.68528 -45.02822 2.65706 2.27563 -44.62865 967.99347
6210.0000 -47.55112 -44.67063 2.88049 2.20596 -45.15901 902.35170
6215.0000 -46.63384 -43.86290 2.77094 2.30382 -44.41413 980.31819
6220.0000 -48.27758 -45.64128 2.63630 2.26429 -44.71496 975.97128
6225.0000 -48.31740 -45.67766 2.63974 2.21491 -45.09086 952.01645
6230.0000 -47.51571 -44.74130 2.77441 2.25200 -44.80854 992.70014
6235.0000 -46.70468 -44.60594 2.09874 2.17611 -45.38616 938.27862
6240.0000 -47.35857 -45.23597 2.12259 2.27550 -44.62969 964.35637
6245.0000 -47.25127 -45.10187 2.14940 2.18938 -45.28517 851.20130
6250.0000 -48.28598 -45.87420 2.41178 2.13701 -45.68381 885.93986
MELTING PROCESS: loop number 26 T-loop= 925.00000000000000
main_MD> interactions number 26 at Temperature= 925.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.71169 0.74449 -2.77665
force_rgl> df(natom) -1.64521 -1.69825 -0.64711
6255.0000 -48.44275 -46.20412 2.23862 2.12855 -45.74818 862.54499
6260.0000 -47.97827 -44.25426 3.72401 2.13174 -45.72389 857.91329
6265.0000 -47.56726 -44.27399 3.29327 2.38435 -43.80112 1124.34084
6270.0000 -47.80696 -45.22196 2.58500 2.17477 -45.39641 903.48310
6275.0000 -47.24246 -45.47194 1.77053 2.17843 -45.36855 903.28629
6280.0000 -48.43789 -46.10827 2.32962 2.06668 -46.21915 759.75333
6285.0000 -48.16216 -45.70177 2.46039 2.07399 -46.16345 805.95637
6290.0000 -46.51339 -44.03748 2.47591 2.22502 -45.01392 920.85636
6295.0000 -46.52367 -44.18126 2.34241 2.31873 -44.30064 1011.84198
6300.0000 -47.22188 -44.41494 2.80694 2.29651 -44.46972 990.02129
6305.0000 -47.76304 -45.60627 2.15677 2.24048 -44.89621 925.52405
6310.0000 -47.78346 -44.95553 2.82793 2.19408 -45.24938 860.02570
6315.0000 -48.06562 -44.95686 3.10876 2.19206 -45.26481 876.66472
6320.0000 -47.33554 -44.76926 2.56628 2.19393 -45.25058 938.57502
6325.0000 -47.97602 -45.80672 2.16930 2.16311 -45.48515 815.50593
6330.0000 -48.29795 -45.71489 2.58307 2.14939 -45.58960 823.55554
6335.0000 -46.81499 -44.39581 2.41918 2.24370 -44.87173 926.91108
6340.0000 -47.30361 -44.46310 2.84051 2.20788 -45.14437 949.93191
6345.0000 -47.56492 -45.60545 1.95947 2.23344 -44.94982 930.89545
6350.0000 -48.67524 -46.59687 2.07836 2.11317 -45.86526 824.28424
6355.0000 -48.28453 -45.87785 2.40668 2.07755 -46.13637 828.27587
6360.0000 -48.04575 -45.90938 2.13638 2.15685 -45.53277 884.13127
6365.0000 -47.54221 -45.06390 2.47831 2.20062 -45.19960 910.99281
6370.0000 -47.85543 -45.84216 2.01327 2.20262 -45.18443 919.63984
6375.0000 -47.57739 -45.07529 2.50210 2.16425 -45.47647 863.21598
6380.0000 -47.97117 -45.36940 2.60177 2.18867 -45.29054 871.13856
6385.0000 -47.31602 -45.21463 2.10140 2.23106 -44.96790 887.46491
6390.0000 -48.06539 -45.13937 2.92601 2.21373 -45.09983 865.86302
6395.0000 -47.01594 -44.68656 2.32938 2.25412 -44.79238 936.52852
6400.0000 -47.38037 -44.87712 2.50325 2.19785 -45.22068 861.51268
6405.0000 -46.63981 -43.89711 2.74270 2.35277 -44.04147 1032.83182
6410.0000 -47.35698 -44.41080 2.94618 2.31231 -44.34948 1043.23584
6415.0000 -46.95947 -44.83268 2.12679 2.28550 -44.55357 868.05189
6420.0000 -47.75903 -45.28691 2.47212 2.24221 -44.88302 900.64842
6425.0000 -46.93097 -44.37560 2.55537 2.30331 -44.41799 1016.25605
6430.0000 -48.05274 -45.64834 2.40440 2.25845 -44.75946 1041.13479
6435.0000 -47.82019 -45.50228 2.31791 2.15087 -45.57831 808.93572
6440.0000 -46.44067 -43.31484 3.12583 2.29933 -44.44827 1095.31384
6445.0000 -46.83134 -43.91065 2.92069 2.35969 -43.98887 1048.63096
6450.0000 -47.55182 -45.06623 2.48560 2.28303 -44.57234 950.95666
6455.0000 -47.49992 -45.40330 2.09662 2.20293 -45.18204 918.46272
6460.0000 -46.62787 -44.17198 2.45589 2.27737 -44.61546 946.20012
6465.0000 -47.01280 -45.21409 1.79870 2.31642 -44.31820 1019.50590
6470.0000 -47.48714 -45.56517 1.92198 2.22685 -44.99997 930.45659
6475.0000 -47.62343 -44.83352 2.78991 2.18729 -45.30105 942.63446
6480.0000 -47.84141 -45.22798 2.61343 2.23029 -44.97376 1006.47137
6485.0000 -48.21364 -45.44711 2.76653 2.21609 -45.08189 943.30675
6490.0000 -47.07661 -45.50624 1.57037 2.19401 -45.24996 909.91468
6495.0000 -48.30321 -45.93371 2.36950 2.14754 -45.60368 845.77451
6500.0000 -48.16419 -46.42568 1.73851 2.11768 -45.83090 852.68146
MELTING PROCESS: loop number 27 T-loop= 950.00000000000000
main_MD> interactions number 27 at Temperature= 950.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.94224 -0.99963 3.17416
force_rgl> df(natom) 1.90126 -2.39794 1.64428
6505.0000 -47.91707 -45.66628 2.25079 2.10526 -45.92549 856.29999
6510.0000 -47.16134 -44.30984 2.85150 2.22844 -44.98784 983.74914
6515.0000 -47.45049 -44.18116 3.26933 2.34907 -44.06969 1083.94476
6520.0000 -48.27385 -45.24555 3.02830 2.19519 -45.24094 945.74609
6525.0000 -47.53906 -44.79201 2.74705 2.20466 -45.16885 942.46272
6530.0000 -46.71508 -43.78767 2.92742 2.32160 -44.27880 987.80270
6535.0000 -47.39357 -45.02639 2.36718 2.33813 -44.15296 1084.15654
6540.0000 -47.42798 -45.24052 2.18746 2.16261 -45.48891 846.82814
6545.0000 -47.19718 -44.36465 2.83253 2.26936 -44.67641 935.90259
6550.0000 -47.70505 -45.07806 2.62698 2.26922 -44.67744 934.62892
6555.0000 -48.45789 -44.82266 3.63523 2.24991 -44.82444 951.77958
6560.0000 -47.07646 -44.18136 2.89510 2.19617 -45.23353 897.71157
6565.0000 -47.82143 -44.97454 2.84688 2.22978 -44.97766 1026.07157
6570.0000 -47.50525 -44.41521 3.09003 2.27585 -44.62701 1083.81688
6575.0000 -47.21901 -44.41296 2.80605 2.27475 -44.63534 941.43003
6580.0000 -47.17902 -44.24652 2.93249 2.31668 -44.31619 993.73140
6585.0000 -47.53627 -45.03049 2.50577 2.23995 -44.90023 901.01639
6590.0000 -48.47609 -45.74606 2.73003 2.22400 -45.02164 878.25176
6595.0000 -46.73546 -44.42067 2.31479 2.19344 -45.25428 866.48815
6600.0000 -45.66924 -42.83452 2.83471 2.42519 -43.49024 1099.68223
6605.0000 -46.92267 -44.74623 2.17643 2.39073 -43.75254 1070.48747
6610.0000 -47.29332 -44.84532 2.44800 2.23652 -44.92635 868.49643
6615.0000 -45.57920 -42.83971 2.73949 2.42119 -43.52071 1080.52309
6620.0000 -46.26444 -43.28603 2.97841 2.54007 -42.61588 1184.80665
6625.0000 -47.07983 -44.69366 2.38618 2.37320 -43.88602 1084.32773
6630.0000 -47.79301 -45.36116 2.43185 2.24044 -44.89650 965.23773
6635.0000 -47.45034 -44.86124 2.58910 2.21038 -45.12536 919.56127
6640.0000 -47.07180 -43.48211 3.58969 2.39802 -43.69710 1100.25923
6645.0000 -47.18934 -45.07874 2.11061 2.26169 -44.73480 893.76600
6650.0000 -47.92464 -45.72280 2.20184 2.25547 -44.78213 939.69777
6655.0000 -47.81171 -44.21685 3.59486 2.25257 -44.80416 912.60747
6660.0000 -46.34327 -43.87417 2.46910 2.35480 -44.02609 1030.61136
6665.0000 -46.71513 -44.20237 2.51276 2.31631 -44.31905 961.40917
6670.0000 -47.48544 -44.68169 2.80375 2.28021 -44.59380 1023.50021
6675.0000 -47.79555 -45.15757 2.63798 2.27129 -44.66169 950.00352
6680.0000 -48.24321 -45.88175 2.36146 2.22388 -45.02260 899.98160
6685.0000 -47.40706 -44.00650 3.40057 2.22736 -44.99609 876.36184
6690.0000 -46.63164 -44.15515 2.47649 2.32412 -44.25956 1040.13602
6695.0000 -47.45555 -45.13386 2.32169 2.28554 -44.55327 958.34508
6700.0000 -47.75341 -45.96979 1.78361 2.14802 -45.59996 829.08387
6705.0000 -47.70550 -45.39656 2.30894 2.15113 -45.57631 860.82260
6710.0000 -46.55221 -43.63916 2.91306 2.26917 -44.67783 1012.45489
6715.0000 -46.09123 -43.32784 2.76338 2.40607 -43.63583 1113.68362
6720.0000 -46.39474 -43.38615 3.00859 2.38739 -43.77799 1082.32154
6725.0000 -46.00238 -43.82498 2.17740 2.45256 -43.28192 1174.06890
6730.0000 -47.39177 -44.27592 3.11584 2.35644 -44.01361 1084.93496
6735.0000 -47.70874 -45.10635 2.60239 2.16680 -45.45703 823.52297
6740.0000 -48.00425 -45.61926 2.38499 2.19688 -45.22810 834.77081
6745.0000 -47.16995 -44.89411 2.27585 2.16254 -45.48944 883.87312
6750.0000 -47.79058 -45.11183 2.67874 2.23051 -44.97209 936.52676
MELTING PROCESS: loop number 28 T-loop= 975.00000000000000
main_MD> interactions number 28 at Temperature= 975.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.80537 -1.78229 -0.99908
force_rgl> df(natom) -5.38864 2.35419 -3.49043
6755.0000 -48.04718 -45.80016 2.24702 2.15089 -45.57819 872.62457
6760.0000 -47.62667 -44.93985 2.68681 2.18316 -45.33249 949.05066
6765.0000 -47.78672 -45.32701 2.45971 2.17422 -45.40054 843.34231
6770.0000 -47.54593 -45.02587 2.52005 2.22307 -45.02875 885.56342
6775.0000 -47.68813 -44.48896 3.19916 2.22001 -45.05201 901.58671
6780.0000 -47.00464 -44.70573 2.29891 2.23912 -44.90661 915.76283
6785.0000 -48.14154 -46.04466 2.09688 2.24894 -44.83185 1009.92984
6790.0000 -48.42460 -45.73286 2.69174 2.12147 -45.80210 839.45403
6795.0000 -47.00864 -44.72960 2.27904 2.15928 -45.51426 850.90684
6800.0000 -48.20473 -45.92827 2.27646 2.19481 -45.24382 915.62770
6805.0000 -47.75769 -45.24056 2.51713 2.16766 -45.45049 884.99054
6810.0000 -47.23563 -45.19684 2.03879 2.18082 -45.35036 858.10301
6815.0000 -48.37324 -46.22967 2.14357 2.11636 -45.84099 841.80341
6820.0000 -47.47023 -45.47253 1.99770 2.16528 -45.46860 835.71438
6825.0000 -47.11589 -44.57768 2.53821 2.18167 -45.34390 920.31308
6830.0000 -47.24408 -44.60932 2.63476 2.22913 -44.98259 842.49099
6835.0000 -46.57311 -44.07634 2.49677 2.33471 -44.17899 1052.09488
6840.0000 -46.41053 -43.24283 3.16770 2.39611 -43.71158 1019.26726
6845.0000 -46.47628 -43.52560 2.95069 2.43850 -43.38894 1132.95480
6850.0000 -47.88629 -44.93642 2.94987 2.25698 -44.77066 981.21861
6855.0000 -47.86233 -45.46406 2.39826 2.22797 -44.99144 953.37496
6860.0000 -47.81133 -45.87498 1.93635 2.08250 -46.09871 815.74996
6865.0000 -48.47856 -46.12977 2.34880 2.06755 -46.21248 808.55571
6870.0000 -47.80496 -45.40033 2.40463 2.04896 -46.35403 751.67590
6875.0000 -47.69329 -45.62120 2.07209 2.19199 -45.26534 919.20205
6880.0000 -47.16882 -45.08413 2.08469 2.17219 -45.41601 907.77075
6885.0000 -47.42832 -44.51541 2.91291 2.27160 -44.65937 1020.76357
6890.0000 -47.53684 -44.14400 3.39283 2.27854 -44.60649 975.31086
6895.0000 -47.59007 -45.22650 2.36357 2.20660 -45.15408 905.76789
6900.0000 -47.75355 -44.96661 2.78695 2.22464 -45.01676 958.41585
6905.0000 -47.93699 -45.55597 2.38102 2.13168 -45.72434 880.06814
6910.0000 -48.12285 -45.29682 2.82603 2.22823 -44.98943 1003.87463
6915.0000 -46.72524 -44.31359 2.41165 2.24452 -44.86544 882.05096
6920.0000 -47.74021 -44.37093 3.36929 2.35981 -43.98796 993.34086
6925.0000 -47.14874 -44.21152 2.93721 2.33498 -44.17692 1045.05366
6930.0000 -46.35267 -43.77062 2.58205 2.31657 -44.31702 986.31442
6935.0000 -47.71620 -45.03095 2.68525 2.30199 -44.42801 947.12395
6940.0000 -47.42159 -45.10814 2.31345 2.27187 -44.65729 994.76725
6945.0000 -47.64144 -44.61411 3.02733 2.24482 -44.86317 960.12686
6950.0000 -47.44544 -45.86886 1.57658 2.17970 -45.35888 891.80775
6955.0000 -47.75653 -45.73820 2.01833 2.11741 -45.83296 831.28749
6960.0000 -47.37288 -44.74139 2.63149 2.18468 -45.32095 853.62463
6965.0000 -47.40607 -44.60565 2.80043 2.24866 -44.83399 941.21717
6970.0000 -47.49132 -44.39941 3.09192 2.34420 -44.10678 1065.61556
6975.0000 -46.98947 -44.30570 2.68377 2.31697 -44.31403 1048.24528
6980.0000 -47.35723 -44.58933 2.76790 2.30450 -44.40890 1000.15504
6985.0000 -46.79405 -44.27178 2.52227 2.27833 -44.60811 1005.05172
6990.0000 -47.61389 -45.72257 1.89133 2.24216 -44.88344 991.21474
6995.0000 -47.91940 -45.10947 2.80993 2.12491 -45.77589 838.99246
7000.0000 -48.19807 -44.34536 3.85271 2.22731 -44.99648 947.08050
MELTING PROCESS: loop number 29 T-loop= 1000.0000000000000
main_MD> interactions number 29 at Temperature= 1000.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.59782 1.46919 -0.75038
force_rgl> df(natom) 3.41646 -3.43006 1.08818
7005.0000 -46.85725 -44.94985 1.90739 2.26934 -44.67653 970.56600
7010.0000 -47.49414 -45.13695 2.35720 2.18772 -45.29782 923.57737
7015.0000 -48.34787 -45.79567 2.55220 2.20991 -45.12890 958.17614
7020.0000 -47.91228 -45.71102 2.20125 2.15444 -45.55113 860.99452
7025.0000 -47.63822 -43.63899 3.99923 2.20147 -45.19314 965.00602
7030.0000 -46.91914 -43.89264 3.02651 2.38242 -43.81580 1163.95124
7035.0000 -46.54229 -44.41041 2.13189 2.34368 -44.11067 1109.09980
7040.0000 -46.66125 -44.60938 2.05186 2.28979 -44.52088 964.62096
7045.0000 -47.32961 -44.31923 3.01038 2.25180 -44.81006 940.19701
7050.0000 -46.75517 -44.47544 2.27973 2.33418 -44.18304 1001.80079
7055.0000 -47.96461 -44.83857 3.12604 2.28433 -44.56244 933.69956
7060.0000 -47.34267 -43.79129 3.55138 2.33576 -44.17101 1052.63861
7065.0000 -47.25980 -44.59785 2.66195 2.27292 -44.64929 999.74019
7070.0000 -47.25044 -44.50152 2.74892 2.33746 -44.15804 1047.50178
7075.0000 -48.06570 -45.84617 2.21953 2.25024 -44.82195 987.18304
7080.0000 -48.03879 -46.17729 1.86150 2.06525 -46.23000 745.85658
7085.0000 -47.74098 -44.53543 3.20556 2.26108 -44.73939 987.19667
7090.0000 -48.05112 -44.71831 3.33282 2.32237 -44.27287 989.47261
7095.0000 -46.87239 -44.26037 2.61202 2.28829 -44.53227 1003.16687
7100.0000 -47.67960 -45.23146 2.44814 2.26487 -44.71055 1002.54055
7105.0000 -47.34667 -45.49184 1.85483 2.13594 -45.69191 844.06857
7110.0000 -47.18784 -44.01223 3.17561 2.28829 -44.53228 976.69627
7115.0000 -46.45492 -43.91785 2.53707 2.37443 -43.87665 1051.33126
7120.0000 -47.81338 -45.21710 2.59629 2.27607 -44.62532 974.02267
7125.0000 -47.84091 -45.12055 2.72037 2.21944 -45.05638 922.97536
7130.0000 -48.08728 -45.43688 2.65040 2.13000 -45.73718 844.54610
7135.0000 -47.69847 -45.62364 2.07483 2.16633 -45.46066 855.72879
7140.0000 -46.49928 -42.59065 3.90863 2.33640 -44.16610 1012.75352
7145.0000 -46.49032 -43.49801 2.99232 2.45325 -43.27671 1104.16990
7150.0000 -46.05965 -42.20363 3.85602 2.40795 -43.62152 1078.41922
7155.0000 -45.97362 -42.94680 3.02681 2.47533 -43.10863 1164.40063
7160.0000 -46.47174 -43.36485 3.10689 2.43709 -43.39966 1155.10489
7165.0000 -47.56321 -44.04636 3.51685 2.40198 -43.66692 1108.33622
7170.0000 -47.54991 -44.44832 3.10159 2.35772 -44.00383 1036.08079
7175.0000 -46.88544 -44.12017 2.76527 2.38193 -43.81957 1114.80941
7180.0000 -45.80570 -43.11480 2.69090 2.41100 -43.59828 1183.53726
7185.0000 -47.34595 -43.92269 3.42326 2.45469 -43.26576 1092.92030
7190.0000 -45.90959 -43.10184 2.80774 2.34796 -44.07813 1003.92394
7195.0000 -48.43787 -44.73738 3.70048 2.37326 -43.88557 1085.51764
7200.0000 -46.45825 -43.71496 2.74330 2.31588 -44.32230 1012.18593
7205.0000 -47.64217 -44.64650 2.99568 2.38247 -43.81543 1058.79217
7210.0000 -47.46424 -44.80347 2.66077 2.28437 -44.56216 1015.37276
7215.0000 -46.94591 -44.23682 2.70909 2.31831 -44.30382 1049.23455
7220.0000 -47.96535 -44.96376 3.00159 2.30981 -44.36847 949.06730
7225.0000 -47.09859 -43.60245 3.49614 2.31976 -44.29276 980.65820
7230.0000 -46.66222 -43.78300 2.87922 2.38903 -43.76550 1093.58671
7235.0000 -46.09378 -43.29981 2.79396 2.44750 -43.32044 1110.63796
7240.0000 -46.91106 -44.24634 2.66472 2.34778 -44.07951 1048.06976
7245.0000 -47.77789 -44.53618 3.24172 2.32881 -44.22391 1028.96642
7250.0000 -47.39977 -45.16573 2.23403 2.23902 -44.90737 1035.27863
MELTING PROCESS: loop number 30 T-loop= 1025.0000000000000
main_MD> interactions number 30 at Temperature= 1025.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.50783 0.77038 -3.79009
force_rgl> df(natom) -1.60421 0.67637 1.61379
7255.0000 -47.28385 -44.64143 2.64242 2.17488 -45.39553 881.32795
7260.0000 -47.34820 -45.14491 2.20329 2.24408 -44.86885 968.30805
7265.0000 -48.11667 -46.45859 1.65808 2.09097 -46.03421 815.83357
7270.0000 -47.39431 -43.80989 3.58441 2.19668 -45.22961 884.24948
7275.0000 -47.22141 -44.27158 2.94983 2.38974 -43.76009 1040.46334
7280.0000 -47.11087 -44.58323 2.52764 2.28478 -44.55903 1050.95006
7285.0000 -47.39905 -44.59750 2.80155 2.27513 -44.63250 1000.43076
7290.0000 -46.20383 -43.49744 2.70639 2.32958 -44.21805 1044.01367
7295.0000 -47.69889 -44.54417 3.15473 2.45083 -43.29508 1259.23854
7300.0000 -45.98208 -43.24817 2.73391 2.45744 -43.24477 1133.58341
7305.0000 -47.03529 -42.10788 4.92741 2.51770 -42.78609 1270.12867
7310.0000 -46.92918 -44.20557 2.72361 2.40857 -43.61674 1097.99992
7315.0000 -47.35558 -44.50947 2.84611 2.33495 -44.17711 1009.05086
7320.0000 -46.84137 -43.05701 3.78436 2.39049 -43.75440 1064.85970
7325.0000 -47.44890 -44.05983 3.38907 2.43781 -43.39422 1097.68597
7330.0000 -46.41182 -43.14701 3.26481 2.44741 -43.32117 1145.53243
7335.0000 -46.67497 -43.30620 3.36877 2.54562 -42.57361 1199.94827
7340.0000 -46.90476 -44.42611 2.47866 2.33189 -44.20042 971.62665
7345.0000 -46.34959 -43.35328 2.99631 2.40138 -43.67151 1028.85255
7350.0000 -46.93830 -44.34479 2.59351 2.35362 -44.03505 971.60364
7355.0000 -47.06450 -44.45748 2.60701 2.35945 -43.99064 1088.41099
7360.0000 -46.84607 -43.84467 3.00139 2.31201 -44.35173 1027.76726
7365.0000 -47.16699 -43.93924 3.22775 2.38613 -43.78762 1113.04109
7370.0000 -47.18077 -44.60048 2.58029 2.34294 -44.11632 1028.61145
7375.0000 -46.98231 -44.43051 2.55181 2.31259 -44.34738 1021.05707
7380.0000 -47.11670 -44.49003 2.62668 2.37631 -43.86233 1076.84095
7385.0000 -46.67091 -43.62369 3.04722 2.38735 -43.77830 1109.27592
7390.0000 -46.34381 -42.79520 3.54861 2.48521 -43.03342 1202.59025
7395.0000 -47.02956 -44.45400 2.57556 2.37620 -43.86315 1078.10708
7400.0000 -48.13680 -44.94785 3.18895 2.27576 -44.62769 1020.44124
7405.0000 -47.21599 -44.89740 2.31859 2.23241 -44.95767 900.97879
7410.0000 -47.74192 -45.13763 2.60429 2.20170 -45.19142 892.05684
7415.0000 -47.63206 -45.18437 2.44768 2.13392 -45.70735 858.16128
7420.0000 -47.45576 -44.95744 2.49832 2.16312 -45.48509 915.96433
7425.0000 -47.65670 -44.29772 3.35897 2.27384 -44.64233 1077.80086
7430.0000 -46.28035 -43.67662 2.60374 2.36218 -43.96986 1038.14533
7435.0000 -47.08017 -44.21777 2.86240 2.41904 -43.53705 1128.49638
7440.0000 -46.28755 -43.04338 3.24417 2.39470 -43.72238 1054.58003
7445.0000 -47.19392 -44.42544 2.76848 2.32585 -44.24644 1048.71503
7450.0000 -47.36854 -44.89706 2.47148 2.29138 -44.50879 974.14705
7455.0000 -47.22773 -44.52856 2.69917 2.29119 -44.51024 1000.21870
7460.0000 -47.51212 -45.06307 2.44906 2.27943 -44.59972 1106.84623
7465.0000 -47.37405 -45.46448 1.90957 2.19472 -45.24454 896.80766
7470.0000 -47.57752 -45.46742 2.11010 2.11263 -45.86936 777.99150
7475.0000 -47.35577 -44.54606 2.80972 2.25846 -44.75940 1002.38825
7480.0000 -46.87383 -44.24494 2.62889 2.35801 -44.00161 1079.95599
7485.0000 -46.64723 -44.56882 2.07841 2.28672 -44.54427 1030.04894
7490.0000 -46.16919 -43.11170 3.05749 2.40333 -43.65669 1087.33429
7495.0000 -46.92035 -44.13244 2.78791 2.46530 -43.18496 1147.85246
7500.0000 -46.68536 -44.43042 2.25494 2.32394 -44.26097 1056.16741
MELTING PROCESS: loop number 31 T-loop= 1050.0000000000000
main_MD> interactions number 31 at Temperature= 1050.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.40361 0.67436 -0.62954
force_rgl> df(natom) 0.00086 -1.75741 -0.65333
7505.0000 -46.58234 -43.88608 2.69626 2.31000 -44.36708 997.67189
7510.0000 -47.54990 -43.66547 3.88443 2.42232 -43.51210 1196.61463
7515.0000 -46.61726 -43.52182 3.09544 2.43935 -43.38253 1138.07489
7520.0000 -47.12331 -44.59437 2.52894 2.37460 -43.87537 1065.83220
7525.0000 -47.56556 -45.25434 2.31121 2.25738 -44.76757 933.13746
7530.0000 -46.66637 -43.98328 2.68309 2.28308 -44.57194 996.83855
7535.0000 -46.86428 -43.90448 2.95979 2.38778 -43.77499 1100.90742
7540.0000 -48.34301 -45.16108 3.18193 2.31311 -44.34336 1046.52835
7545.0000 -47.31473 -44.64192 2.67281 2.28633 -44.54721 977.20164
7550.0000 -47.34095 -45.08290 2.25805 2.20952 -45.13186 873.65761
7555.0000 -47.48392 -44.27892 3.20500 2.25489 -44.78657 935.62386
7560.0000 -46.23402 -43.21910 3.01492 2.35403 -44.03193 1046.39066
7565.0000 -46.59089 -42.75738 3.83351 2.49417 -42.96523 1272.19757
7570.0000 -47.18033 -44.28471 2.89563 2.35834 -43.99915 1110.32920
7575.0000 -46.85338 -44.23249 2.62089 2.31470 -44.33126 1021.76343
7580.0000 -47.08733 -44.25053 2.83680 2.33358 -44.18760 1030.19278
7585.0000 -47.31978 -44.15528 3.16450 2.26894 -44.67957 1026.41922
7590.0000 -47.00132 -44.65818 2.34314 2.31809 -44.30545 953.39114
7595.0000 -48.04327 -44.75590 3.28737 2.20261 -45.18445 948.72574
7600.0000 -46.89459 -44.10272 2.79187 2.28631 -44.54736 1007.40004
7605.0000 -46.92415 -43.34688 3.57727 2.32482 -44.25422 960.34563
7610.0000 -45.89931 -42.20410 3.69521 2.49882 -42.92980 1252.25075
7615.0000 -46.74693 -44.13939 2.60754 2.52214 -42.75234 1238.47147
7620.0000 -47.15297 -44.47545 2.67752 2.29290 -44.49723 998.11022
7625.0000 -48.02332 -45.15570 2.86762 2.23912 -44.90659 918.78896
7630.0000 -47.57171 -44.71932 2.85240 2.14716 -45.60652 868.04511
7635.0000 -47.65057 -45.32263 2.32794 2.21663 -45.07778 935.09312
7640.0000 -46.80902 -44.87292 1.93610 2.20204 -45.18881 918.89953
7645.0000 -47.25217 -44.49199 2.76018 2.22300 -45.02930 914.48130
7650.0000 -46.35738 -42.61195 3.74543 2.43710 -43.39963 1133.80428
7655.0000 -46.96021 -44.22519 2.73503 2.38674 -43.78294 1122.13943
7660.0000 -47.73712 -44.52305 3.21407 2.24975 -44.82564 947.95475
7665.0000 -47.09943 -43.79381 3.30562 2.30420 -44.41121 978.91154
7670.0000 -47.22298 -44.05666 3.16631 2.38919 -43.76426 1115.06629
7675.0000 -46.65480 -43.74502 2.90978 2.37294 -43.88802 1121.49214
7680.0000 -46.50455 -43.37114 3.13341 2.46355 -43.19828 1207.02355
7685.0000 -47.93868 -45.41225 2.52643 2.28492 -44.55794 1030.13230
7690.0000 -48.57046 -46.14788 2.42258 2.04343 -46.39608 759.87793
7695.0000 -47.31046 -45.38178 1.92869 2.15513 -45.54585 875.55406
7700.0000 -47.57292 -44.52392 3.04900 2.19647 -45.23122 916.10676
7705.0000 -47.07592 -44.04198 3.03394 2.29052 -44.51534 988.71237
7710.0000 -47.19229 -44.59106 2.60123 2.29031 -44.51690 942.22966
7715.0000 -47.16998 -44.62487 2.54511 2.28353 -44.56857 981.25775
7720.0000 -47.51465 -44.21289 3.30176 2.33478 -44.17848 1026.11385
7725.0000 -47.15244 -44.69157 2.46086 2.25578 -44.77977 968.71664
7730.0000 -46.60074 -43.17112 3.42962 2.31152 -44.35546 933.33647
7735.0000 -46.88387 -43.35272 3.53115 2.46593 -43.18021 1164.51162
7740.0000 -46.32119 -43.80076 2.52043 2.41655 -43.55602 1115.23276
7745.0000 -45.73283 -42.72983 3.00300 2.48570 -43.02969 1181.35924
7750.0000 -46.97573 -43.46979 3.50593 2.31912 -44.29766 978.78213
MELTING PROCESS: loop number 32 T-loop= 1075.0000000000000
main_MD> interactions number 32 at Temperature= 1075.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -4.37699 2.86739 0.63183
force_rgl> df(natom) 0.33602 0.11477 -0.21136
7755.0000 -47.37439 -43.74932 3.62507 2.45887 -43.23388 1172.97244
7760.0000 -47.51625 -44.71091 2.80534 2.37239 -43.89213 1058.02545
7765.0000 -47.25157 -44.50581 2.74576 2.26606 -44.70148 994.83183
7770.0000 -47.00999 -44.18484 2.82515 2.29474 -44.48321 1050.77915
7775.0000 -46.33868 -43.85015 2.48854 2.43219 -43.43700 1152.55091
7780.0000 -45.51583 -42.40725 3.10858 2.44322 -43.35302 1132.82512
7785.0000 -46.99279 -43.03112 3.96167 2.57380 -42.35912 1199.00795
7790.0000 -46.15577 -42.18968 3.96608 2.60364 -42.13193 1267.20233
7795.0000 -46.05283 -42.35664 3.69619 2.56444 -42.43036 1229.14451
7800.0000 -47.30739 -44.01096 3.29643 2.44872 -43.31120 1157.18567
7805.0000 -47.15930 -45.38032 1.77897 2.26061 -44.74297 965.79169
7810.0000 -46.14479 -43.25902 2.88577 2.32456 -44.25620 979.50000
7815.0000 -46.49239 -42.78221 3.71018 2.51002 -42.84460 1231.06556
7820.0000 -47.93245 -44.77860 3.15385 2.43951 -43.38130 1206.72859
7825.0000 -47.31956 -44.60722 2.71234 2.29680 -44.46756 1021.02864
7830.0000 -47.39428 -45.40007 1.99422 2.24683 -44.84785 972.82132
7835.0000 -48.42162 -45.68502 2.73660 2.19877 -45.21374 853.20397
7840.0000 -46.62778 -43.76672 2.86107 2.26835 -44.68412 915.93915
7845.0000 -46.76951 -43.20234 3.56717 2.42045 -43.52635 1152.65787
7850.0000 -46.65397 -44.19720 2.45677 2.37487 -43.87331 1038.81287
7855.0000 -46.34829 -43.39432 2.95396 2.44292 -43.35531 1215.06992
7860.0000 -46.79794 -44.11272 2.68522 2.36177 -43.97301 1047.72296
7865.0000 -47.54874 -45.03096 2.51777 2.29507 -44.48073 979.69957
7870.0000 -47.19560 -44.34500 2.85060 2.20417 -45.17259 860.50876
7875.0000 -47.08784 -43.49170 3.59614 2.33867 -44.14885 1105.07600
7880.0000 -47.99598 -43.71700 4.27898 2.35377 -44.03390 1104.78153
7885.0000 -46.92406 -44.07653 2.84753 2.38880 -43.76727 1123.76224
7890.0000 -46.42755 -43.03102 3.39653 2.41118 -43.59690 1197.20319
7895.0000 -45.90201 -42.48191 3.42010 2.48754 -43.01570 1223.43791
7900.0000 -46.47176 -44.14710 2.32466 2.35801 -44.00163 1071.11440
7905.0000 -47.95376 -43.40106 4.55271 2.39179 -43.74448 1144.94699
7910.0000 -47.47700 -44.69103 2.78597 2.28152 -44.58387 944.84915
7915.0000 -47.43540 -44.14100 3.29440 2.28405 -44.56460 1013.79925
7920.0000 -47.20539 -43.82919 3.37620 2.38930 -43.76344 1096.45162
7925.0000 -46.50623 -43.57384 2.93238 2.38998 -43.75827 1098.70961
7930.0000 -46.32451 -43.23682 3.08769 2.42762 -43.47178 1196.85366
7935.0000 -45.93589 -42.96711 2.96878 2.51240 -42.82645 1195.12605
7940.0000 -47.04959 -43.47146 3.57813 2.44989 -43.30229 1122.09929
7945.0000 -47.19212 -44.60573 2.58639 2.38842 -43.77012 1161.30074
7950.0000 -46.39272 -43.09737 3.29535 2.37150 -43.89891 1094.80480
7955.0000 -45.87544 -43.25953 2.61591 2.43788 -43.39365 1099.22365
7960.0000 -46.15174 -44.17237 1.97937 2.38325 -43.80951 1098.25245
7965.0000 -46.28275 -44.08916 2.19359 2.40902 -43.61337 1112.88280
7970.0000 -45.90154 -42.89081 3.01073 2.38003 -43.83404 1035.74826
7975.0000 -46.30615 -44.31523 1.99092 2.38098 -43.82682 1059.14246
7980.0000 -47.05098 -44.02408 3.02690 2.28665 -44.54481 961.89418
7985.0000 -46.53532 -43.81344 2.72189 2.31363 -44.33945 1006.46780
7990.0000 -46.07589 -43.40214 2.67374 2.40158 -43.66997 1075.98460
7995.0000 -47.65014 -45.50828 2.14187 2.31365 -44.33931 1027.31481
8000.0000 -47.68839 -43.58780 4.10059 2.21986 -45.05314 868.46391
MELTING PROCESS: loop number 33 T-loop= 1100.0000000000000
main_MD> interactions number 33 at Temperature= 1100.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.27737 -1.91425 -0.75435
force_rgl> df(natom) 2.91016 -0.63048 9.82359
8005.0000 -47.03499 -44.53584 2.49915 2.39682 -43.70622 1120.82019
8010.0000 -47.94460 -44.02570 3.91890 2.34312 -44.11498 1017.44142
8015.0000 -46.66756 -43.45995 3.20761 2.40657 -43.63202 1093.07705
8020.0000 -47.46384 -44.87492 2.58893 2.32076 -44.28517 1038.97394
8025.0000 -47.30651 -44.37763 2.92888 2.31595 -44.32175 1045.83509
8030.0000 -47.86087 -45.43248 2.42840 2.20390 -45.17468 942.08377
8035.0000 -47.27309 -45.22294 2.05015 2.20704 -45.15072 857.31917
8040.0000 -47.39314 -44.53297 2.86016 2.31758 -44.30935 991.91375
8045.0000 -47.51121 -44.30675 3.20446 2.27944 -44.59971 1085.53851
8050.0000 -46.54495 -43.36056 3.18439 2.37665 -43.85976 1059.29087
8055.0000 -46.58730 -43.29941 3.28789 2.51280 -42.82343 1298.35025
8060.0000 -46.68851 -43.28744 3.40106 2.40537 -43.64114 1113.02404
8065.0000 -46.68363 -43.06751 3.61612 2.44140 -43.36689 1093.45422
8070.0000 -46.19475 -43.19903 2.99572 2.51137 -42.83427 1205.60539
8075.0000 -46.97200 -43.22197 3.75004 2.45855 -43.23638 1187.60281
8080.0000 -47.32984 -44.36174 2.96810 2.38310 -43.81067 1203.79357
8085.0000 -47.21668 -44.40262 2.81407 2.30812 -44.38139 1066.21656
8090.0000 -46.45658 -43.25827 3.19831 2.38678 -43.78263 1090.63027
8095.0000 -45.64035 -41.82447 3.81588 2.54340 -42.59047 1193.90416
8100.0000 -45.85089 -42.92815 2.92274 2.56601 -42.41841 1316.02319
8105.0000 -46.67333 -43.89466 2.77867 2.43583 -43.40929 1117.82615
8110.0000 -46.08429 -43.27170 2.81258 2.38216 -43.81780 1056.32231
8115.0000 -47.41689 -43.72644 3.69045 2.44458 -43.34270 1157.69917
8120.0000 -46.37720 -43.70656 2.67063 2.38283 -43.81272 1087.87813
8125.0000 -47.90394 -44.94045 2.96349 2.40709 -43.62804 1205.98032
8130.0000 -47.39385 -44.87681 2.51704 2.31050 -44.36324 1035.33396
8135.0000 -47.63590 -45.02234 2.61356 2.23145 -44.96498 948.15632
8140.0000 -46.96386 -44.71959 2.24427 2.26161 -44.73537 916.38705
8145.0000 -46.17787 -43.30854 2.86934 2.32713 -44.23665 983.98182
8150.0000 -47.41428 -44.00595 3.40833 2.41791 -43.54572 1115.80543
8155.0000 -47.65089 -43.99419 3.65669 2.35192 -44.04799 1028.56708
8160.0000 -45.77287 -42.98505 2.78782 2.37623 -43.86295 1049.33834
8165.0000 -46.36635 -43.70040 2.66595 2.37574 -43.86668 1089.18535
8170.0000 -46.33518 -43.71703 2.61815 2.36563 -43.94359 1103.85136
8175.0000 -46.30756 -43.38966 2.91790 2.48369 -43.04498 1166.11403
8180.0000 -47.06507 -44.13742 2.92765 2.42315 -43.50582 1216.20295
8185.0000 -46.72094 -43.92010 2.80085 2.42778 -43.47052 1068.11941
8190.0000 -46.07861 -43.24223 2.83638 2.39988 -43.68295 1075.39968
8195.0000 -45.75013 -42.43040 3.31973 2.53149 -42.68113 1210.64946
8200.0000 -45.81683 -43.14063 2.67621 2.49409 -42.96583 1213.68828
8205.0000 -48.06701 -44.79689 3.27012 2.40312 -43.65825 1147.53051
8210.0000 -46.58923 -44.21793 2.37130 2.25962 -44.75050 913.59973
8215.0000 -46.45510 -43.13316 3.32194 2.43953 -43.38113 1110.26364
8220.0000 -47.18152 -43.98498 3.19654 2.36430 -43.95377 1086.78051
8225.0000 -46.90744 -44.16269 2.74475 2.30846 -44.37877 949.29134
8230.0000 -47.75662 -44.43692 3.31970 2.33115 -44.20606 1011.89865
8235.0000 -47.23570 -44.25135 2.98435 2.28566 -44.55230 996.92781
8240.0000 -46.14091 -43.26533 2.87559 2.51257 -42.82517 1206.23290
8245.0000 -47.35205 -44.55416 2.79789 2.33580 -44.17070 937.20298
8250.0000 -47.15650 -43.86523 3.29127 2.35698 -44.00943 1122.23029
MELTING PROCESS: loop number 34 T-loop= 1125.0000000000000
main_MD> interactions number 34 at Temperature= 1125.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.30409 2.79362 4.96634
force_rgl> df(natom) -4.06372 -3.90453 -0.85384
8255.0000 -47.12943 -45.02902 2.10041 2.34425 -44.10633 1091.36981
8260.0000 -46.50050 -44.04038 2.46012 2.27269 -44.65103 1005.47226
8265.0000 -47.55850 -44.44870 3.10980 2.31014 -44.36596 1044.86748
8270.0000 -45.90454 -43.38088 2.52365 2.34358 -44.11150 1070.03812
8275.0000 -46.65395 -44.32734 2.32661 2.41552 -43.56390 1000.60533
8280.0000 -46.55408 -43.57686 2.97722 2.34333 -44.11335 1051.15920
8285.0000 -46.42700 -43.98137 2.44563 2.31895 -44.29892 1025.18690
8290.0000 -45.45033 -42.41693 3.03340 2.48415 -43.04147 1059.15440
8295.0000 -46.11041 -42.56019 3.55022 2.50945 -42.84892 1255.08327
8300.0000 -46.40295 -43.37509 3.02787 2.50436 -42.88766 1178.18103
8305.0000 -45.40675 -43.22860 2.17815 2.48251 -43.05396 1186.83739
8310.0000 -45.27992 -42.15172 3.12820 2.49544 -42.95559 1212.66856
8315.0000 -45.29569 -42.11869 3.17700 2.50803 -42.85971 1138.01286
8320.0000 -45.37098 -42.54884 2.82214 2.53207 -42.67671 1222.91660
8325.0000 -45.59309 -42.21473 3.37836 2.53032 -42.69002 1129.61718
8330.0000 -45.70283 -42.11150 3.59133 2.62347 -41.98105 1365.43877
8335.0000 -47.06814 -43.26297 3.80517 2.44482 -43.34088 1143.45908
8340.0000 -46.48093 -42.91317 3.56775 2.49980 -42.92235 1264.13405
8345.0000 -46.49956 -43.63692 2.86264 2.44547 -43.33588 1166.83534
8350.0000 -45.45384 -41.32373 4.13011 2.51863 -42.77904 1208.35953
8355.0000 -46.04698 -41.79500 4.25198 2.73664 -41.11964 1518.47136
8360.0000 -45.73700 -42.80609 2.93091 2.64386 -41.82583 1322.17276
8365.0000 -45.64881 -42.89480 2.75401 2.51423 -42.81254 1096.49351
8370.0000 -47.62696 -44.48141 3.14555 2.41319 -43.58159 984.33405
8375.0000 -47.06885 -43.57099 3.49786 2.34738 -44.08254 1043.79586
8380.0000 -45.99272 -42.04456 3.94815 2.52297 -42.74600 1197.36866
8385.0000 -46.31852 -43.64994 2.66857 2.48159 -43.06097 1233.36811
8390.0000 -46.93303 -44.39288 2.54015 2.42233 -43.51207 1131.51425
8395.0000 -46.75949 -44.22738 2.53211 2.42202 -43.51438 1085.73694
8400.0000 -46.95339 -44.21272 2.74067 2.32380 -44.26204 1000.67125
8405.0000 -47.36615 -43.07406 4.29209 2.41855 -43.54082 1170.55840
8410.0000 -46.71192 -43.89761 2.81431 2.38307 -43.81088 1016.74896
8415.0000 -47.51875 -44.96512 2.55362 2.35581 -44.01840 1058.32289
8420.0000 -47.59656 -44.78965 2.80691 2.24133 -44.88976 959.90660
8425.0000 -46.41925 -43.78229 2.63696 2.37166 -43.89772 1094.12679
8430.0000 -45.79119 -42.20701 3.58418 2.38482 -43.79758 1103.75977
8435.0000 -45.14343 -42.08737 3.05606 2.54838 -42.55258 1265.94821
8440.0000 -46.62149 -42.79213 3.82936 2.52204 -42.75311 1253.35972
8445.0000 -46.54435 -43.30073 3.24362 2.51792 -42.78446 1194.40084
8450.0000 -45.55449 -42.73853 2.81596 2.54068 -42.61121 1214.98332
8455.0000 -46.45473 -43.33910 3.11563 2.54416 -42.58469 1254.03703
8460.0000 -47.51858 -44.51476 3.00382 2.38181 -43.82048 1126.90193
8465.0000 -47.43567 -43.95464 3.48103 2.32773 -44.23214 1032.18551
8470.0000 -46.08939 -42.46016 3.62923 2.40802 -43.62097 1063.26385
8475.0000 -46.61898 -43.41294 3.20604 2.48954 -43.00045 1167.85151
8480.0000 -46.30025 -42.62047 3.67979 2.50623 -42.87346 1278.69749
8485.0000 -45.98215 -42.70694 3.27521 2.70020 -41.39701 1426.78698
8490.0000 -46.00788 -42.94609 3.06178 2.47330 -43.12406 1169.96689
8495.0000 -47.31755 -44.13195 3.18560 2.48219 -43.05642 1214.51249
8500.0000 -45.37642 -42.52941 2.84701 2.40173 -43.66886 1099.22884
MELTING PROCESS: loop number 35 T-loop= 1150.0000000000000
main_MD> interactions number 35 at Temperature= 1150.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.85544 -2.49668 0.42236
force_rgl> df(natom) 0.07209 3.75021 -2.78684
8505.0000 -46.79386 -42.89475 3.89912 2.51363 -42.81713 1208.82668
8510.0000 -44.21244 -41.42353 2.78891 2.62109 -41.99912 1251.21277
8515.0000 -46.11503 -43.21893 2.89610 2.63881 -41.86424 1350.74142
8520.0000 -45.77693 -42.17007 3.60685 2.54459 -42.58143 1219.72004
8525.0000 -45.62467 -42.12003 3.50464 2.64139 -41.84467 1446.09093
8530.0000 -45.90972 -42.61505 3.29467 2.55433 -42.50731 1286.40303
8535.0000 -46.26521 -42.30001 3.96520 2.58468 -42.27630 1208.51853
8540.0000 -46.60267 -43.47943 3.12324 2.43868 -43.38757 1124.62768
8545.0000 -46.47917 -43.33808 3.14109 2.49299 -42.97423 1147.48494
8550.0000 -46.12198 -42.52062 3.60136 2.50128 -42.91109 1209.65822
8555.0000 -45.63812 -41.97328 3.66485 2.56396 -42.43402 1293.17888
8560.0000 -45.63820 -41.51902 4.11918 2.58671 -42.26081 1331.15960
8565.0000 -47.20046 -42.88957 4.31089 2.54738 -42.56022 1329.12637
8570.0000 -44.91949 -41.25269 3.66679 2.52993 -42.69300 1264.93910
8575.0000 -46.41221 -42.91541 3.49680 2.57448 -42.35396 1353.51132
8580.0000 -46.88903 -44.51158 2.37745 2.40305 -43.65882 1144.06573
8585.0000 -46.90978 -44.58939 2.32040 2.34874 -44.07221 1078.42910
8590.0000 -47.74627 -45.07940 2.66688 2.31210 -44.35107 995.72094
8595.0000 -46.92345 -44.26389 2.65956 2.26148 -44.73638 982.74401
8600.0000 -46.97769 -44.26941 2.70828 2.28611 -44.54891 1022.01697
8605.0000 -46.87269 -43.57294 3.29975 2.44155 -43.36574 1155.56456
8610.0000 -46.78114 -43.52612 3.25501 2.40365 -43.65419 1165.81435
8615.0000 -47.11520 -44.47542 2.63978 2.34137 -44.12828 1103.12207
8620.0000 -47.54274 -44.53931 3.00343 2.31463 -44.33180 1095.15944
8625.0000 -46.64212 -44.31373 2.32839 2.34027 -44.13666 1008.09272
8630.0000 -47.32532 -44.49168 2.83364 2.31756 -44.30949 1001.64300
8635.0000 -46.41292 -43.73486 2.67805 2.35723 -44.00755 1097.44434
8640.0000 -45.82651 -42.93672 2.88979 2.48434 -43.04002 1159.57117
8645.0000 -47.07988 -43.67198 3.40791 2.46984 -43.15041 1158.90610
8650.0000 -45.32451 -42.31107 3.01343 2.51658 -42.79463 1206.78879
8655.0000 -46.22870 -43.85280 2.37590 2.46952 -43.15285 1131.77800
8660.0000 -46.48133 -42.61546 3.86587 2.52363 -42.74101 1216.41554
8665.0000 -44.97569 -41.40552 3.57017 2.61435 -42.05042 1309.24970
8670.0000 -45.34342 -41.96564 3.37778 2.68665 -41.50015 1370.64898
8675.0000 -46.06896 -42.18397 3.88499 2.59851 -42.17100 1277.22359
8680.0000 -46.45418 -42.27318 4.18100 2.57432 -42.35515 1221.69620
8685.0000 -47.70500 -44.49091 3.21409 2.37086 -43.90378 1099.21870
8690.0000 -46.64062 -43.46695 3.17367 2.35554 -44.02044 1041.81056
8695.0000 -46.30376 -43.97116 2.33261 2.42347 -43.50336 1112.94666
8700.0000 -46.00455 -43.81533 2.18922 2.38718 -43.77957 1042.80838
8705.0000 -46.25051 -43.38002 2.87049 2.40462 -43.64683 1121.77103
8710.0000 -45.92809 -43.86161 2.06649 2.35172 -44.04950 1083.65021
8715.0000 -46.31986 -42.76491 3.55494 2.32495 -44.25324 1038.96126
8720.0000 -46.25810 -43.81994 2.43816 2.54284 -42.59474 1216.28237
8725.0000 -46.01201 -43.84407 2.16794 2.37462 -43.87519 1105.76133
8730.0000 -47.55892 -44.17011 3.38881 2.38768 -43.77575 1061.99089
8735.0000 -46.88881 -44.75142 2.13740 2.29466 -44.48383 974.43286
8740.0000 -46.25138 -43.98002 2.27136 2.31056 -44.36280 1006.19645
8745.0000 -46.91112 -43.76697 3.14415 2.31634 -44.31877 1127.31020
8750.0000 -46.79188 -43.97451 2.81737 2.39620 -43.71097 1113.73917
MELTING PROCESS: loop number 36 T-loop= 1175.0000000000000
main_MD> interactions number 36 at Temperature= 1175.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -3.10784 1.45013 -0.46841
force_rgl> df(natom) 3.20691 5.17048 6.75337
8755.0000 -45.85018 -42.05206 3.79811 2.56440 -42.43062 1264.04745
8760.0000 -46.77496 -41.79880 4.97616 2.64198 -41.84011 1263.88971
8765.0000 -47.07758 -43.26277 3.81481 2.51476 -42.80851 1288.71866
8770.0000 -46.41334 -43.10571 3.30764 2.43777 -43.39451 1066.78441
8775.0000 -46.43159 -43.70187 2.72972 2.49700 -42.94369 1224.71089
8780.0000 -47.01655 -43.14145 3.87510 2.39824 -43.69538 1101.46816
8785.0000 -46.53378 -43.86998 2.66380 2.47791 -43.08901 1277.34205
8790.0000 -45.00473 -42.52538 2.47935 2.49880 -42.92995 1141.53366
8795.0000 -45.92247 -42.99778 2.92469 2.50677 -42.86933 1209.19077
8800.0000 -45.84966 -42.58631 3.26335 2.49943 -42.92520 1192.98322
8805.0000 -46.69318 -43.12729 3.56589 2.45879 -43.23452 1130.00345
8810.0000 -47.05034 -44.25769 2.79265 2.44342 -43.35150 1176.18144
8815.0000 -46.27010 -43.51542 2.75467 2.41365 -43.57809 1052.64997
8820.0000 -47.57312 -44.26847 3.30464 2.35045 -44.05914 1006.08638
8825.0000 -45.75888 -42.85858 2.90030 2.36354 -43.95957 1085.10643
8830.0000 -47.00559 -42.65390 4.35169 2.48799 -43.01223 1194.76682
8835.0000 -46.05012 -43.00394 3.04618 2.51666 -42.79400 1240.02180
8840.0000 -45.53272 -42.98622 2.54649 2.59131 -42.22579 1242.46074
8845.0000 -45.33885 -42.06843 3.27042 2.59592 -42.19071 1268.66675
8850.0000 -45.65944 -42.25474 3.40470 2.64430 -41.82247 1288.29068
8855.0000 -45.24099 -41.83742 3.40357 2.61691 -42.03100 1294.90609
8860.0000 -46.06219 -42.09147 3.97072 2.55917 -42.47048 1342.58483
8865.0000 -45.47000 -43.36181 2.10819 2.55690 -42.48774 1224.63007
8870.0000 -45.94795 -42.81747 3.13049 2.55786 -42.48047 1300.04565
8875.0000 -46.66889 -43.80906 2.85983 2.47783 -43.08958 1217.17225
8880.0000 -46.75383 -42.46315 4.29068 2.46816 -43.16323 1193.31016
8885.0000 -45.52301 -42.53104 2.99197 2.57817 -42.32587 1257.27922
8890.0000 -45.51065 -42.59947 2.91118 2.54697 -42.56329 1201.84639
8895.0000 -46.03080 -42.67657 3.35423 2.52779 -42.70934 1269.75999
8900.0000 -45.97449 -41.95554 4.01896 2.57973 -42.31399 1294.37298
8905.0000 -46.03831 -42.27031 3.76799 2.62277 -41.98635 1269.48148
8910.0000 -46.69621 -43.07502 3.62119 2.51187 -42.83048 1241.26198
8915.0000 -46.74043 -43.47884 3.26159 2.36663 -43.93603 1026.80512
8920.0000 -46.58341 -43.00683 3.57658 2.57277 -42.36694 1279.36885
8925.0000 -45.40101 -41.55985 3.84117 2.54366 -42.58849 1223.16467
8930.0000 -45.40325 -41.91715 3.48610 2.65199 -41.76398 1370.28372
8935.0000 -45.93567 -42.51284 3.42283 2.51609 -42.79838 1251.69425
8940.0000 -46.83664 -43.52711 3.30953 2.40791 -43.62184 1153.63613
8945.0000 -45.84774 -42.35723 3.49050 2.59234 -42.21798 1284.82524
8950.0000 -45.97767 -41.74970 4.22798 2.54903 -42.54765 1257.41496
8955.0000 -45.82729 -42.87021 2.95708 2.53031 -42.69016 1196.91006
8960.0000 -46.65950 -43.18389 3.47560 2.49908 -42.92783 1214.20013
8965.0000 -47.16621 -44.19767 2.96854 2.44067 -43.37247 1176.71286
8970.0000 -47.43324 -43.82482 3.60841 2.34057 -44.13434 991.39528
8975.0000 -46.11647 -43.03338 3.08308 2.42033 -43.52727 1105.47878
8980.0000 -47.25254 -44.38851 2.86403 2.42482 -43.49308 1151.08614
8985.0000 -45.83164 -43.95598 1.87566 2.34526 -44.09868 1067.38625
8990.0000 -46.32008 -43.47076 2.84932 2.37533 -43.86976 1115.36974
8995.0000 -46.73884 -43.26483 3.47402 2.38621 -43.78694 1084.27043
9000.0000 -47.18018 -42.03024 5.14994 2.45649 -43.25201 1242.83314
MELTING PROCESS: loop number 37 T-loop= 1200.0000000000000
main_MD> interactions number 37 at Temperature= 1200.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -2.56035 2.04931 -2.88232
force_rgl> df(natom) -0.89989 -0.48370 -1.02319
9005.0000 -46.28687 -42.99298 3.29389 2.50451 -42.88651 1250.34532
9010.0000 -46.63763 -43.69288 2.94475 2.43310 -43.43009 1156.67816
9015.0000 -46.41719 -43.65206 2.76513 2.34630 -44.09077 1061.19509
9020.0000 -45.74420 -43.06577 2.67843 2.42889 -43.46214 1142.37201
9025.0000 -46.66810 -44.44688 2.22121 2.40475 -43.64588 1128.68516
9030.0000 -45.12852 -41.84845 3.28006 2.45606 -43.25532 1156.59370
9035.0000 -45.27343 -42.15824 3.11519 2.67254 -41.60754 1367.43525
9040.0000 -45.76646 -42.70491 3.06155 2.54066 -42.61137 1184.32324
9045.0000 -46.10112 -42.17958 3.92154 2.61913 -42.01409 1348.02582
9050.0000 -45.14668 -41.90347 3.24321 2.54378 -42.58758 1275.94549
9055.0000 -44.97000 -41.20821 3.76179 2.65319 -41.75485 1436.74917
9060.0000 -44.56767 -41.12053 3.44713 2.72350 -41.21962 1392.48926
9065.0000 -44.74253 -41.36556 3.37697 2.71011 -41.32155 1368.21173
9070.0000 -46.10690 -42.15492 3.95198 2.63788 -41.87132 1310.75655
9075.0000 -44.80415 -41.50060 3.30355 2.65906 -41.71016 1347.63660
9080.0000 -45.12828 -42.09944 3.02884 2.67605 -41.58078 1372.79151
9085.0000 -46.85591 -42.27390 4.58201 2.52268 -42.74821 1285.81182
9090.0000 -46.49083 -43.16673 3.32411 2.45992 -43.22592 1156.51694
9095.0000 -47.05654 -43.29880 3.75774 2.45199 -43.28629 1158.81444
9100.0000 -47.12538 -43.23611 3.88926 2.48164 -43.06058 1249.22415
9105.0000 -46.94074 -43.13830 3.80245 2.42895 -43.46168 1106.90170
9110.0000 -46.59073 -43.51856 3.07217 2.49465 -42.96159 1131.57698
9115.0000 -45.84142 -43.42289 2.41853 2.40163 -43.66961 1073.10992
9120.0000 -45.40709 -42.24382 3.16327 2.53290 -42.67041 1229.83844
9125.0000 -46.36833 -43.53172 2.83660 2.41313 -43.58208 1111.46813
9130.0000 -46.76735 -43.65673 3.11062 2.38306 -43.81096 1104.91077
9135.0000 -45.96565 -42.69984 3.26582 2.40676 -43.63055 1121.85108
9140.0000 -46.43049 -42.45428 3.97621 2.56628 -42.41636 1296.59616
9145.0000 -45.05976 -41.62937 3.43039 2.71590 -41.27751 1378.69441
9150.0000 -45.92564 -43.56282 2.36283 2.61226 -42.06637 1250.31423
9155.0000 -46.45918 -43.64100 2.81818 2.41998 -43.52990 1110.82893
9160.0000 -45.77808 -42.60615 3.17193 2.40867 -43.61599 1126.67884
9165.0000 -48.01349 -44.28333 3.73016 2.47718 -43.09454 1181.84660
9170.0000 -47.01843 -44.03634 2.98209 2.33076 -44.20904 969.14285
9175.0000 -46.59729 -42.44215 4.15514 2.44100 -43.36997 1138.32386
9180.0000 -45.40975 -42.49878 2.91097 2.57222 -42.37116 1229.88681
9185.0000 -45.81733 -42.70196 3.11537 2.58172 -42.29884 1232.74519
9190.0000 -46.38187 -42.73189 3.64998 2.49808 -42.93548 1257.62790
9195.0000 -45.92931 -42.59248 3.33683 2.50165 -42.90828 1239.74186
9200.0000 -46.49158 -44.58745 1.90413 2.47316 -43.12513 1171.94127
9205.0000 -46.19925 -42.77427 3.42498 2.42810 -43.46811 1144.67266
9210.0000 -45.29012 -41.66103 3.62909 2.60447 -42.12565 1259.46439
9215.0000 -46.36189 -43.54264 2.81925 2.53666 -42.64177 1238.85546
9220.0000 -46.14693 -43.43715 2.70978 2.44297 -43.35493 1161.05248
9225.0000 -45.01856 -42.16161 2.85695 2.48217 -43.05659 1147.35882
9230.0000 -44.98862 -41.18762 3.80099 2.63158 -41.91933 1283.56623
9235.0000 -44.62618 -41.83061 2.79557 2.65684 -41.72706 1356.11876
9240.0000 -46.25291 -42.79011 3.46280 2.64074 -41.84961 1296.04232
9245.0000 -46.73193 -43.64375 3.08818 2.51425 -42.81241 1211.73313
9250.0000 -45.99656 -43.16914 2.82742 2.41134 -43.59568 1060.98624
main_MD> EXECUTION TIME: 0 [day], 0 [hour], 3 [min], 48.9782825 [s].
main_MD> Deallocating global variables
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