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nanoparticlesims/growth_Melting_Silver_ICO_3269/meltingSims/run_51/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_51.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 = 51 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: 51 5100
main_MD> Size of nv and nvoiz: 51 5100
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 = 51
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> -5.1592772156972303E-003 -1.8086431602181052E-002 -4.2972518141967654E-002 initial drift of cluster / NP1 for coalescence
init> 0.29514942717749582 0.30436800518324736 0.29384333567155924 scaling for velocity /for coalescence NP1
init.f90 > facguy = 1.7707084725314005E-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) -0.33534 -0.83426 0.52690
force_rgl> df(natom) -1.28709 0.29387 1.32769
preparo> THERMALIZATION PROCESS AT 271.94335951108860
preparo> TOTAL ENERGY, KINETIC EN., POT. ENERGY, DELTA
5000 -127.16743129970511 1.8421556291113863 -129.00958692881650 3.6451868637232669E-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= 297.00000000000000
main_MD> interactions number 1 at Temperature= 297.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.39842 -1.60121 -1.01141
force_rgl> df(natom) -0.06122 0.80079 0.57352
5.0000 -128.80224 -127.06560 1.73665 1.71789 -126.82475 304.74623
10.0000 -128.69640 -126.44518 2.25122 1.71732 -126.83261 309.19207
15.0000 -128.97548 -127.06631 1.90918 1.73192 -126.63183 320.03610
20.0000 -128.71333 -126.76727 1.94606 1.71313 -126.89031 296.92694
25.0000 -128.80464 -126.55703 2.24761 1.72120 -126.77933 304.15257
30.0000 -128.93482 -126.89951 2.03531 1.71924 -126.80625 306.37409
35.0000 -128.85950 -127.08914 1.77036 1.69371 -127.15730 280.72767
40.0000 -128.85980 -126.59796 2.26184 1.72464 -126.73191 317.62426
45.0000 -128.63181 -126.60110 2.03071 1.73266 -126.62166 323.43143
50.0000 -129.26571 -126.83401 2.43171 1.72344 -126.74847 306.53151
55.0000 -128.88248 -127.17834 1.70414 1.71891 -126.81080 306.21633
60.0000 -128.56777 -127.04517 1.52260 1.69643 -127.11988 281.76901
65.0000 -129.09800 -126.81404 2.28396 1.71987 -126.79764 307.25451
70.0000 -129.10566 -127.23313 1.87253 1.71403 -126.87787 301.74180
75.0000 -128.69148 -126.96370 1.72777 1.69707 -127.11115 285.10871
80.0000 -129.03696 -127.26325 1.77371 1.70038 -127.06567 288.71687
85.0000 -128.86295 -127.21225 1.65070 1.68725 -127.24611 276.07045
90.0000 -128.95457 -127.15982 1.79475 1.68982 -127.21080 274.07585
95.0000 -129.03496 -126.84470 2.19026 1.69667 -127.11666 285.56053
100.0000 -128.76692 -127.05761 1.70931 1.71397 -126.87868 300.38875
105.0000 -128.75988 -126.64674 2.11314 1.73492 -126.59056 320.39004
110.0000 -129.00464 -126.87226 2.13238 1.72915 -126.66995 318.02909
115.0000 -128.84488 -126.83926 2.00562 1.72069 -126.78629 304.90904
120.0000 -128.80649 -126.85993 1.94656 1.71723 -126.83388 303.32191
125.0000 -128.98399 -126.71063 2.27336 1.73481 -126.59214 317.21062
130.0000 -129.09063 -127.27671 1.81392 1.71416 -126.87605 304.10520
135.0000 -129.08329 -127.25392 1.82937 1.69372 -127.15718 283.23447
140.0000 -129.12107 -127.21403 1.90705 1.68776 -127.23913 274.36300
145.0000 -128.84948 -126.74677 2.10271 1.69904 -127.08400 288.44087
150.0000 -129.25700 -126.87549 2.38151 1.69740 -127.10656 282.29384
155.0000 -129.23605 -127.15203 2.08402 1.71156 -126.91191 296.84617
160.0000 -129.00045 -127.02113 1.97932 1.69091 -127.19585 278.54110
165.0000 -128.64887 -126.47161 2.17726 1.72425 -126.73734 314.49827
170.0000 -128.94113 -126.84032 2.10080 1.72189 -126.76976 307.07917
175.0000 -129.02631 -126.86907 2.15723 1.70027 -127.06709 287.06087
180.0000 -128.98807 -126.90759 2.08048 1.71295 -126.89279 303.85797
185.0000 -128.79040 -126.93882 1.85159 1.72017 -126.79346 312.15100
190.0000 -128.79888 -126.72990 2.06898 1.70746 -126.96829 296.55606
195.0000 -128.42309 -126.18530 2.23779 1.74140 -126.50153 333.07435
200.0000 -128.97071 -127.19846 1.77225 1.71579 -126.85363 299.80759
205.0000 -129.07263 -127.27885 1.79377 1.69064 -127.19955 276.65005
210.0000 -128.62739 -126.99985 1.62754 1.69622 -127.12276 282.54474
215.0000 -128.97791 -127.09106 1.88685 1.71147 -126.91303 296.22898
220.0000 -128.86621 -126.98121 1.88499 1.69692 -127.11319 286.98126
225.0000 -128.59300 -126.66553 1.92747 1.70904 -126.94654 301.48598
230.0000 -128.56763 -126.88898 1.67865 1.72412 -126.73910 310.27920
235.0000 -128.74794 -126.77131 1.97663 1.71594 -126.85155 306.85018
240.0000 -128.52139 -126.39106 2.13032 1.72669 -126.70384 312.09904
245.0000 -128.91118 -126.86054 2.05064 1.73321 -126.61408 319.10747
250.0000 -128.87653 -127.37749 1.49905 1.70693 -126.97551 296.25762
MELTING PROCESS: loop number 2 T-loop= 322.00000000000000
main_MD> interactions number 2 at Temperature= 322.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.38088 -0.84265 -0.73383
force_rgl> df(natom) 1.39837 -0.40478 -1.04077
255.0000 -128.97571 -127.12606 1.84965 1.67304 -127.44156 260.85353
260.0000 -128.36099 -126.34327 2.01772 1.71459 -126.87023 303.22661
265.0000 -128.71616 -126.81885 1.89731 1.74671 -126.42844 332.59355
270.0000 -128.43368 -126.38408 2.04960 1.73368 -126.60771 319.44896
275.0000 -129.01866 -126.82783 2.19083 1.73648 -126.56920 321.78304
280.0000 -129.12092 -126.87229 2.24863 1.71845 -126.81716 305.59800
285.0000 -128.43782 -126.39582 2.04200 1.72843 -126.67989 316.28490
290.0000 -128.75842 -126.90417 1.85424 1.72912 -126.67032 314.91608
295.0000 -128.73522 -126.05223 2.68298 1.75614 -126.29875 338.85915
300.0000 -128.62022 -125.73936 2.88087 1.80695 -125.60004 389.13309
305.0000 -128.67291 -126.87786 1.79505 1.77834 -125.99344 349.51634
310.0000 -129.18220 -127.00101 2.18119 1.71577 -126.85389 301.22661
315.0000 -128.72761 -126.74516 1.98244 1.71768 -126.82763 302.19999
320.0000 -128.67508 -126.99431 1.68077 1.71064 -126.92445 290.32248
325.0000 -128.52327 -126.71049 1.81277 1.71906 -126.80874 296.83351
330.0000 -128.76473 -126.61229 2.15243 1.74009 -126.51951 315.65880
335.0000 -128.83933 -126.32394 2.51539 1.74352 -126.47239 321.77550
340.0000 -128.64675 -126.74539 1.90136 1.72044 -126.78976 300.82093
345.0000 -128.65259 -126.16273 2.48987 1.75557 -126.30663 328.44495
350.0000 -127.88196 -125.92085 1.96111 1.79347 -125.78540 365.58466
355.0000 -128.53863 -126.46061 2.07802 1.76659 -126.15501 343.48264
360.0000 -128.64632 -126.45739 2.18893 1.74524 -126.44861 326.21680
365.0000 -127.86008 -125.53193 2.32815 1.78185 -125.94522 354.95612
370.0000 -128.31523 -125.90301 2.41222 1.79132 -125.81490 362.32662
375.0000 -127.97405 -125.79856 2.17549 1.78948 -125.84027 362.69943
380.0000 -128.17037 -126.40479 1.76557 1.77357 -126.05912 350.00834
385.0000 -128.52004 -126.52528 1.99475 1.74906 -126.39610 318.39442
390.0000 -128.79216 -126.55178 2.24038 1.75985 -126.24774 331.38633
395.0000 -128.44875 -126.32433 2.12442 1.75395 -126.32886 323.86098
400.0000 -128.54457 -126.83205 1.71253 1.72767 -126.69028 302.94254
405.0000 -129.12399 -127.12909 1.99489 1.70833 -126.95630 280.62010
410.0000 -128.83712 -126.64256 2.19456 1.69761 -127.10375 276.22013
415.0000 -128.89220 -127.18040 1.71180 1.70341 -127.02387 284.64649
420.0000 -129.27910 -126.83643 2.44267 1.72295 -126.75516 303.79151
425.0000 -128.50770 -126.41690 2.09080 1.74745 -126.41832 333.36214
430.0000 -128.66894 -126.58882 2.08012 1.70211 -127.04183 279.18256
435.0000 -128.46005 -126.40822 2.05183 1.73700 -126.56197 315.47136
440.0000 -128.24152 -125.59180 2.64972 1.76580 -126.16592 337.27617
445.0000 -128.49707 -126.77785 1.71922 1.77756 -126.00426 346.25041
450.0000 -128.28422 -125.94506 2.33916 1.75917 -126.25707 330.90603
455.0000 -129.15906 -126.90639 2.25267 1.74003 -126.52033 309.81680
460.0000 -128.67388 -126.65824 2.01565 1.72406 -126.73990 301.31121
465.0000 -128.57949 -126.67653 1.90296 1.73440 -126.59769 317.43343
470.0000 -128.84328 -127.06941 1.77388 1.71521 -126.86159 292.03267
475.0000 -128.88105 -126.95955 1.92150 1.70267 -127.03411 278.94226
480.0000 -128.75884 -126.60539 2.15345 1.72214 -126.76640 293.72377
485.0000 -128.46995 -126.13721 2.33274 1.73004 -126.65777 302.90738
490.0000 -128.08597 -126.33671 1.74926 1.76844 -126.12958 340.33398
495.0000 -128.41047 -126.35776 2.05271 1.73078 -126.64754 302.83570
500.0000 -128.39969 -126.59565 1.80404 1.76856 -126.12803 325.77732
MELTING PROCESS: loop number 3 T-loop= 347.00000000000000
main_MD> interactions number 3 at Temperature= 347.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.73747 0.63477 0.50855
force_rgl> df(natom) -0.30255 0.13880 -0.97684
505.0000 -128.12246 -126.18110 1.94136 1.74456 -126.45801 317.11349
510.0000 -128.10893 -125.47627 2.63267 1.79397 -125.77856 370.43667
515.0000 -128.37687 -126.39703 1.97985 1.78369 -125.91991 362.75917
520.0000 -128.74914 -126.93092 1.81822 1.74476 -126.45526 319.11815
525.0000 -128.40952 -126.39858 2.01094 1.73163 -126.63591 310.25368
530.0000 -128.39120 -126.16985 2.22135 1.75710 -126.28556 341.10463
535.0000 -128.32946 -126.42726 1.90220 1.74633 -126.43372 319.47618
540.0000 -128.48031 -126.16000 2.32031 1.76713 -126.14761 336.08585
545.0000 -128.51746 -126.38965 2.12781 1.76335 -126.19961 342.80537
550.0000 -128.04279 -126.01275 2.03004 1.75977 -126.24883 340.91086
555.0000 -128.40596 -126.32826 2.07770 1.74724 -126.42110 334.11322
560.0000 -128.73043 -126.32195 2.40848 1.72807 -126.68478 315.00312
565.0000 -128.33123 -125.95702 2.37421 1.78545 -125.89567 366.96831
570.0000 -128.49643 -125.96917 2.52726 1.77793 -125.99914 358.48504
575.0000 -128.50711 -126.20585 2.30126 1.77266 -126.07157 356.37068
580.0000 -128.84911 -126.19925 2.64986 1.74533 -126.44741 333.54440
585.0000 -127.83000 -125.43007 2.39994 1.76816 -126.13353 350.67912
590.0000 -128.20544 -125.68707 2.51837 1.80626 -125.60954 385.22223
595.0000 -128.38524 -126.40167 1.98357 1.79397 -125.77848 364.37738
600.0000 -128.24889 -125.72894 2.51995 1.78451 -125.90855 354.76762
605.0000 -128.52863 -126.20320 2.32544 1.77324 -126.06365 355.23786
610.0000 -128.66611 -125.91231 2.75381 1.78508 -125.90078 366.71229
615.0000 -128.86086 -126.48676 2.37409 1.75825 -126.26976 348.18387
620.0000 -129.00152 -126.63110 2.37042 1.74190 -126.49464 330.81629
625.0000 -128.22752 -125.96418 2.26334 1.77397 -126.05354 360.53125
630.0000 -128.23002 -125.94717 2.28285 1.78587 -125.88991 363.93741
635.0000 -128.11111 -125.42326 2.68785 1.79701 -125.73668 380.27657
640.0000 -128.05959 -125.24511 2.81447 1.81849 -125.44125 400.78994
645.0000 -128.14861 -125.80727 2.34134 1.80530 -125.62266 388.73086
650.0000 -128.28561 -125.98748 2.29813 1.77680 -126.01460 360.52960
655.0000 -128.40550 -126.27345 2.13205 1.76707 -126.14851 348.90225
660.0000 -127.97125 -125.70642 2.26483 1.77118 -126.09195 352.37462
665.0000 -128.17617 -125.96374 2.21243 1.80824 -125.58222 378.04222
670.0000 -128.17116 -125.61340 2.55775 1.78630 -125.88403 350.43471
675.0000 -128.29810 -125.78220 2.51590 1.82282 -125.38172 391.58002
680.0000 -128.67977 -126.20798 2.47179 1.78118 -125.95438 356.08297
685.0000 -128.51536 -125.87739 2.63797 1.75018 -126.38075 327.50465
690.0000 -128.41348 -125.66535 2.74813 1.79680 -125.73961 378.36134
695.0000 -128.48527 -126.07618 2.40909 1.78272 -125.93317 375.66292
700.0000 -128.57689 -126.54991 2.02697 1.75314 -126.34008 340.71826
705.0000 -128.64345 -125.89768 2.74577 1.75033 -126.37864 334.51893
710.0000 -128.92904 -126.84133 2.08771 1.75805 -126.27250 340.93069
715.0000 -128.96427 -127.18244 1.78183 1.71413 -126.87647 303.44748
720.0000 -128.22080 -125.98556 2.23523 1.76775 -126.13907 353.86150
725.0000 -128.78642 -126.28987 2.49655 1.77335 -126.06209 359.16393
730.0000 -128.53027 -126.20708 2.32319 1.77263 -126.07202 355.63661
735.0000 -128.45177 -126.01447 2.43730 1.76905 -126.12124 362.99082
740.0000 -128.12021 -125.69722 2.42299 1.80306 -125.65355 385.90437
745.0000 -128.24330 -125.43990 2.80339 1.79725 -125.73335 379.06540
750.0000 -128.30965 -125.84362 2.46604 1.80999 -125.55813 386.86102
MELTING PROCESS: loop number 4 T-loop= 372.00000000000000
main_MD> interactions number 4 at Temperature= 372.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.49148 -0.57381 0.04511
force_rgl> df(natom) 0.23337 0.42710 0.36803
755.0000 -127.65465 -125.51201 2.14264 1.80725 -125.59590 381.91234
760.0000 -127.91644 -125.84341 2.07302 1.80748 -125.59272 371.53646
765.0000 -128.43667 -126.09405 2.34261 1.80857 -125.57769 377.29534
770.0000 -128.51006 -126.22754 2.28252 1.77138 -126.08919 341.75155
775.0000 -128.52025 -125.86801 2.65224 1.76603 -126.16272 337.12587
780.0000 -128.10768 -126.17772 1.92995 1.78440 -125.91007 365.05452
785.0000 -128.36798 -126.64521 1.72276 1.75571 -126.30465 334.12774
790.0000 -127.56704 -125.25680 2.31024 1.77023 -126.10498 338.62320
795.0000 -127.85810 -125.29770 2.56040 1.82691 -125.32550 398.39902
800.0000 -128.15724 -125.37594 2.78130 1.80695 -125.60007 381.50002
805.0000 -128.55348 -125.79450 2.75898 1.80648 -125.60644 387.63149
810.0000 -128.35166 -126.18006 2.17160 1.79459 -125.76996 379.94392
815.0000 -127.75405 -125.81862 1.93543 1.76198 -126.21840 348.60312
820.0000 -128.16667 -126.06911 2.09756 1.77932 -125.98005 358.29345
825.0000 -128.58984 -126.09411 2.49573 1.78652 -125.88094 358.83649
830.0000 -128.36746 -125.93848 2.42897 1.78208 -125.94204 352.87428
835.0000 -127.95319 -125.92996 2.02323 1.78628 -125.88429 355.30692
840.0000 -127.64737 -125.20292 2.44445 1.77986 -125.97250 347.62727
845.0000 -128.18404 -125.74678 2.43726 1.81970 -125.42466 390.08121
850.0000 -127.91167 -125.21077 2.70090 1.79624 -125.74733 358.77543
855.0000 -127.18771 -124.76710 2.42061 1.83194 -125.25632 404.25318
860.0000 -127.97595 -125.29274 2.68321 1.84103 -125.13129 409.24751
865.0000 -127.92548 -125.66160 2.26387 1.83814 -125.17106 405.10855
870.0000 -128.31058 -125.80012 2.51046 1.79024 -125.82986 366.80507
875.0000 -128.14443 -125.86524 2.27919 1.77149 -126.08772 356.29071
880.0000 -128.28299 -125.90672 2.37627 1.77420 -126.05038 347.83221
885.0000 -128.52211 -125.71259 2.80952 1.80302 -125.65403 371.46507
890.0000 -128.23816 -126.04764 2.19052 1.78089 -125.95846 343.45057
895.0000 -128.20693 -125.72978 2.47714 1.79009 -125.83188 357.14007
900.0000 -127.96465 -125.35350 2.61114 1.80768 -125.58999 378.84398
905.0000 -128.02736 -125.89214 2.13522 1.79784 -125.72526 376.23041
910.0000 -128.37453 -125.84359 2.53094 1.79545 -125.75816 367.32260
915.0000 -128.16984 -125.21725 2.95259 1.80472 -125.63066 383.02580
920.0000 -127.98420 -125.64377 2.34043 1.80340 -125.64882 370.45408
925.0000 -127.98362 -125.55125 2.43237 1.82065 -125.41158 387.50347
930.0000 -128.29115 -126.02600 2.26515 1.78819 -125.85806 360.85254
935.0000 -128.39623 -126.23506 2.16117 1.76849 -126.12894 351.90579
940.0000 -128.42631 -126.13461 2.29171 1.73885 -126.53657 321.62680
945.0000 -128.55049 -126.11424 2.43625 1.77740 -126.00643 360.48367
950.0000 -128.40194 -126.05694 2.34499 1.78933 -125.84232 372.40641
955.0000 -128.68838 -126.24094 2.44744 1.77608 -126.02452 351.80720
960.0000 -128.42073 -126.17248 2.24825 1.77669 -126.01615 369.62346
965.0000 -128.35286 -126.13008 2.22278 1.74901 -126.39677 333.14455
970.0000 -128.36206 -125.99153 2.37053 1.78435 -125.91087 366.78312
975.0000 -128.94496 -126.16880 2.77617 1.77570 -126.02975 359.65908
980.0000 -128.42256 -126.37764 2.04492 1.75314 -126.34008 338.62017
985.0000 -128.05440 -125.59568 2.45871 1.78381 -125.91818 362.34935
990.0000 -127.59882 -124.76709 2.83173 1.82645 -125.33185 411.33094
995.0000 -127.91118 -125.27172 2.63946 1.83190 -125.25683 414.10598
1000.0000 -127.88269 -125.41407 2.46862 1.81454 -125.49558 393.80254
MELTING PROCESS: loop number 5 T-loop= 397.00000000000000
main_MD> interactions number 5 at Temperature= 397.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.04347 -1.36193 1.03048
force_rgl> df(natom) 0.41657 0.36684 -1.33851
1005.0000 -128.08189 -125.78894 2.29295 1.80043 -125.68963 376.01878
1010.0000 -128.34882 -126.09055 2.25827 1.77523 -126.03625 359.13906
1015.0000 -127.64470 -124.55028 3.09442 1.81874 -125.43780 399.89486
1020.0000 -127.38811 -125.16742 2.22069 1.88824 -124.48209 443.47335
1025.0000 -127.43412 -124.64454 2.78958 1.84609 -125.06173 411.19599
1030.0000 -127.55998 -124.64868 2.91130 1.86097 -124.85705 421.07545
1035.0000 -128.45222 -126.06971 2.38251 1.86272 -124.83305 422.83982
1040.0000 -128.24112 -126.25965 1.98147 1.75174 -126.35932 337.57072
1045.0000 -127.75593 -125.09678 2.65915 1.82267 -125.38383 402.91814
1050.0000 -128.08068 -125.72256 2.35812 1.82625 -125.33458 409.37406
1055.0000 -128.19973 -125.66436 2.53537 1.78098 -125.95711 362.55755
1060.0000 -127.70959 -125.28157 2.42802 1.83903 -125.15886 420.67860
1065.0000 -128.57934 -125.64811 2.93123 1.82368 -125.36996 396.63333
1070.0000 -128.19808 -125.95433 2.24375 1.79424 -125.77475 363.83649
1075.0000 -128.04472 -125.88111 2.16362 1.80747 -125.59279 374.43930
1080.0000 -127.89467 -125.25798 2.63670 1.81133 -125.53981 379.55518
1085.0000 -127.95407 -125.72720 2.22687 1.81477 -125.49251 392.96905
1090.0000 -128.07067 -125.15402 2.91666 1.84521 -125.07382 413.66980
1095.0000 -127.56401 -124.75161 2.81240 1.85996 -124.87104 423.19392
1100.0000 -128.37778 -124.36019 4.01759 1.86605 -124.78719 423.01404
1105.0000 -127.79692 -124.61394 3.18298 1.89127 -124.44040 458.00597
1110.0000 -127.88317 -125.39558 2.48759 1.85222 -124.97737 418.76138
1115.0000 -128.40213 -125.52209 2.88004 1.80253 -125.66079 382.57467
1120.0000 -127.29826 -124.23077 3.06749 1.84314 -125.10229 412.92895
1125.0000 -127.96174 -125.46593 2.49582 1.87648 -124.64381 438.14035
1130.0000 -128.23485 -125.54566 2.68919 1.78999 -125.83321 361.11886
1135.0000 -127.72862 -125.43115 2.29746 1.81143 -125.53839 376.25643
1140.0000 -127.87645 -125.42497 2.45147 1.81362 -125.50833 384.96382
1145.0000 -128.15636 -125.58665 2.56971 1.81088 -125.54597 380.56075
1150.0000 -127.95498 -125.61512 2.33986 1.83513 -125.21249 396.10840
1155.0000 -127.67246 -125.16144 2.51102 1.83486 -125.21623 399.00806
1160.0000 -128.15498 -125.23314 2.92183 1.82573 -125.34171 394.74418
1165.0000 -127.82823 -125.41214 2.41609 1.82383 -125.36783 392.25593
1170.0000 -128.07121 -125.80679 2.26442 1.80506 -125.62601 376.90816
1175.0000 -128.63152 -125.88013 2.75139 1.79579 -125.75347 371.05090
1180.0000 -128.41410 -126.16189 2.25221 1.79011 -125.83161 355.03152
1185.0000 -128.08489 -125.68439 2.40050 1.78160 -125.94869 358.61905
1190.0000 -128.30019 -126.16986 2.13032 1.79988 -125.69728 380.12895
1195.0000 -128.22977 -125.91034 2.31944 1.77430 -126.04907 354.70645
1200.0000 -128.20523 -125.95850 2.24673 1.76864 -126.12691 350.35506
1205.0000 -128.34282 -126.08447 2.25835 1.76993 -126.10915 359.27284
1210.0000 -127.88292 -125.62610 2.25683 1.77267 -126.07145 356.75067
1215.0000 -127.75491 -125.12680 2.62811 1.81306 -125.51603 392.82908
1220.0000 -127.98376 -125.35718 2.62658 1.82152 -125.39968 392.02709
1225.0000 -127.76781 -125.64830 2.11951 1.84517 -125.07438 408.33790
1230.0000 -127.86489 -125.11839 2.74650 1.81015 -125.55594 370.96390
1235.0000 -128.00791 -126.03837 1.96954 1.80642 -125.60732 377.17639
1240.0000 -127.75216 -125.54335 2.20881 1.80097 -125.68224 362.03085
1245.0000 -128.17650 -125.64600 2.53050 1.79764 -125.72801 362.06115
1250.0000 -128.23658 -125.47980 2.75678 1.80304 -125.65377 375.05157
MELTING PROCESS: loop number 6 T-loop= 422.00000000000000
main_MD> interactions number 6 at Temperature= 422.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.70589 -0.95406 0.47227
force_rgl> df(natom) -3.19040 3.62988 -0.08226
1255.0000 -128.27104 -125.27378 2.99726 1.84106 -125.13095 415.72630
1260.0000 -127.76261 -125.05077 2.71184 1.85375 -124.95633 433.91071
1265.0000 -127.41661 -124.56974 2.84686 1.87865 -124.61395 448.87851
1270.0000 -127.50465 -124.80441 2.70025 1.86467 -124.80626 423.48267
1275.0000 -127.04241 -124.20045 2.84196 1.89779 -124.35076 448.44205
1280.0000 -127.38424 -124.22885 3.15539 1.90930 -124.19241 468.80162
1285.0000 -127.05891 -124.08701 2.97190 1.90930 -124.19244 481.68343
1290.0000 -126.93599 -124.24075 2.69524 1.90633 -124.23332 469.54137
1295.0000 -127.84314 -125.36544 2.47770 1.86334 -124.82444 424.88352
1300.0000 -128.47963 -125.90918 2.57045 1.82985 -125.28502 399.89998
1305.0000 -127.21904 -124.17561 3.04343 1.82027 -125.41684 389.33698
1310.0000 -127.65647 -125.10482 2.55165 1.87144 -124.71318 437.26478
1315.0000 -127.21884 -124.46704 2.75180 1.87084 -124.72142 419.59281
1320.0000 -127.22228 -124.30953 2.91275 1.91839 -124.06738 450.68942
1325.0000 -126.40777 -123.29130 3.11647 1.93690 -123.81284 477.09088
1330.0000 -127.15411 -124.25249 2.90162 1.91970 -124.04940 479.00504
1335.0000 -127.19717 -123.45437 3.74280 1.93137 -123.88892 491.37928
1340.0000 -127.97250 -124.38911 3.58338 1.91094 -124.16994 471.43796
1345.0000 -127.58266 -124.76622 2.81644 1.86975 -124.73635 445.49851
1350.0000 -127.83203 -124.91827 2.91376 1.88414 -124.53851 444.86897
1355.0000 -127.78738 -124.86067 2.92671 1.87294 -124.69249 433.31294
1360.0000 -128.12639 -125.55325 2.57314 1.84801 -125.03533 417.02324
1365.0000 -127.83063 -124.79529 3.03534 1.84257 -125.11011 409.68645
1370.0000 -127.89323 -124.86530 3.02794 1.86453 -124.80821 431.09889
1375.0000 -127.41049 -124.80741 2.60308 1.86010 -124.86913 421.65732
1380.0000 -127.70326 -124.52693 3.17633 1.86998 -124.73313 429.38748
1385.0000 -127.71609 -124.97999 2.73610 1.87124 -124.71585 441.95863
1390.0000 -127.85420 -124.84848 3.00572 1.85590 -124.92676 421.07675
1395.0000 -127.38599 -124.79402 2.59197 1.85644 -124.91944 412.85358
1400.0000 -127.18469 -124.66522 2.51948 1.86752 -124.76706 413.61787
1405.0000 -127.67879 -125.50169 2.17710 1.84159 -125.12361 393.69807
1410.0000 -127.96957 -125.20775 2.76181 1.82555 -125.34419 404.06371
1415.0000 -127.13399 -123.85254 3.28144 1.88012 -124.59377 434.78644
1420.0000 -126.95831 -123.66110 3.29722 1.91227 -124.15164 441.47036
1425.0000 -127.58626 -124.81143 2.77483 1.90859 -124.20220 456.08830
1430.0000 -127.55629 -124.59037 2.96592 1.88352 -124.54693 432.03568
1435.0000 -128.10447 -125.46044 2.64403 1.84329 -125.10021 400.80018
1440.0000 -127.68405 -124.96123 2.72281 1.84961 -125.01330 399.80026
1445.0000 -127.91726 -125.37674 2.54052 1.85560 -124.93091 404.20341
1450.0000 -127.96090 -125.28398 2.67692 1.82180 -125.39583 398.34707
1455.0000 -128.28304 -125.64494 2.63810 1.82503 -125.35135 405.18107
1460.0000 -127.81133 -125.26333 2.54799 1.79373 -125.78181 377.93553
1465.0000 -127.93242 -125.40439 2.52803 1.81020 -125.55537 392.82720
1470.0000 -127.23363 -124.30511 2.92852 1.86708 -124.77305 444.71406
1475.0000 -127.28924 -123.93164 3.35760 1.90491 -124.25281 481.50540
1480.0000 -127.88654 -125.83239 2.05415 1.86168 -124.84731 443.05043
1485.0000 -128.11670 -124.70591 3.41079 1.83517 -125.21187 422.05580
1490.0000 -127.78453 -124.77914 3.00539 1.86253 -124.83570 444.34115
1495.0000 -127.88730 -125.29579 2.59150 1.84380 -125.09320 421.17462
1500.0000 -127.87016 -124.39967 3.47048 1.86483 -124.80397 442.99600
MELTING PROCESS: loop number 7 T-loop= 447.00000000000000
main_MD> interactions number 7 at Temperature= 447.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.39514 0.97130 1.50281
force_rgl> df(natom) -1.86980 -1.28416 0.60849
1505.0000 -127.53994 -124.31092 3.22902 1.92031 -124.04105 495.90561
1510.0000 -127.35900 -124.24416 3.11485 1.89846 -124.34159 453.05587
1515.0000 -127.91559 -124.82063 3.09496 1.90045 -124.31419 449.23052
1520.0000 -128.03477 -124.62155 3.41321 1.87110 -124.71778 455.40493
1525.0000 -127.71527 -124.97349 2.74178 1.88147 -124.57511 470.67634
1530.0000 -127.48211 -124.50042 2.98168 1.86387 -124.81724 450.67614
1535.0000 -127.26089 -124.35977 2.90112 1.86164 -124.84786 442.39563
1540.0000 -127.49228 -125.09776 2.39452 1.86482 -124.80421 444.34042
1545.0000 -128.03067 -125.36813 2.66254 1.82285 -125.38131 407.69184
1550.0000 -128.54961 -125.97089 2.57872 1.80005 -125.69490 388.10125
1555.0000 -128.11621 -125.21951 2.89670 1.80591 -125.61436 398.38078
1560.0000 -127.68754 -125.03662 2.65092 1.83366 -125.23272 419.20206
1565.0000 -127.36767 -124.38309 2.98458 1.84870 -125.02584 431.93683
1570.0000 -127.78960 -124.85332 2.93629 1.87269 -124.69592 456.65863
1575.0000 -127.69430 -124.64349 3.05082 1.86230 -124.83885 451.27068
1580.0000 -127.93067 -124.88432 3.04635 1.85977 -124.87361 443.98109
1585.0000 -127.49135 -124.10825 3.38310 1.90487 -124.25338 489.83113
1590.0000 -127.14493 -124.30474 2.84019 1.92239 -124.01243 490.87742
1595.0000 -127.35095 -123.78105 3.56990 1.91608 -124.09926 498.35009
1600.0000 -128.05020 -125.15336 2.89684 1.88525 -124.52316 468.81132
1605.0000 -128.26878 -125.58786 2.68092 1.82289 -125.38082 409.25030
1610.0000 -127.68151 -124.70697 2.97454 1.84551 -125.06967 433.39277
1615.0000 -128.31355 -125.41953 2.89402 1.83583 -125.20284 424.38522
1620.0000 -128.18255 -125.47773 2.70483 1.79701 -125.73677 383.71669
1625.0000 -128.22358 -125.78412 2.43947 1.81791 -125.44925 405.81509
1630.0000 -127.62978 -124.69989 2.92989 1.83680 -125.18952 425.52887
1635.0000 -128.17177 -125.74500 2.42677 1.82098 -125.40708 407.31932
1640.0000 -128.02627 -125.19901 2.82725 1.82390 -125.36685 410.48995
1645.0000 -128.23222 -125.01953 3.21269 1.83433 -125.22341 419.89235
1650.0000 -127.44650 -124.58296 2.86354 1.87632 -124.64600 457.83113
1655.0000 -127.00098 -124.08707 2.91391 1.93002 -123.90748 493.23648
1660.0000 -128.34362 -125.64559 2.69803 1.89031 -124.45356 472.71217
1665.0000 -127.98321 -125.19223 2.79098 1.82358 -125.37132 412.28882
1670.0000 -127.96206 -125.57684 2.38522 1.80299 -125.65452 389.79496
1675.0000 -127.43228 -124.18243 3.24985 1.84769 -125.03974 434.63320
1680.0000 -127.28929 -124.39150 2.89779 1.90479 -124.25450 484.58017
1685.0000 -126.77365 -123.94394 2.82971 1.89312 -124.41502 463.65100
1690.0000 -127.55260 -124.38175 3.17084 1.92584 -123.96491 501.76881
1695.0000 -128.18470 -124.82614 3.35856 1.88066 -124.58627 453.44167
1700.0000 -126.96145 -124.27981 2.68164 1.89154 -124.43666 470.67074
1705.0000 -127.57734 -124.01482 3.56252 1.92457 -123.98251 503.20464
1710.0000 -126.26709 -122.96752 3.29957 1.95790 -123.52413 511.68795
1715.0000 -127.51086 -124.08345 3.42741 1.96495 -123.42719 497.50472
1720.0000 -127.32797 -123.90445 3.42351 1.91824 -124.06951 482.54827
1725.0000 -127.08209 -124.03830 3.04379 1.96894 -123.37228 525.79830
1730.0000 -127.26570 -124.84254 2.42316 1.87041 -124.72728 435.94281
1735.0000 -127.31879 -124.29206 3.02673 1.91168 -124.15975 463.46784
1740.0000 -127.80226 -124.51162 3.29064 1.89780 -124.35061 466.93416
1745.0000 -127.93667 -124.54937 3.38730 1.87702 -124.63635 446.15639
1750.0000 -127.37187 -124.43335 2.93852 1.88723 -124.49594 451.14532
MELTING PROCESS: loop number 8 T-loop= 472.00000000000000
main_MD> interactions number 8 at Temperature= 472.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.84118 -5.46661 0.68255
force_rgl> df(natom) -2.55370 2.45917 0.70998
1755.0000 -127.39097 -124.05916 3.33182 1.91081 -124.17164 473.01290
1760.0000 -127.54369 -124.09839 3.44530 1.93335 -123.86171 490.99269
1765.0000 -126.75298 -123.68340 3.06957 1.94710 -123.67256 479.52715
1770.0000 -126.40475 -124.05759 2.34716 1.94318 -123.72655 469.53452
1775.0000 -127.23466 -123.53127 3.70339 1.93685 -123.81357 457.71519
1780.0000 -126.89231 -123.96324 2.92907 1.95216 -123.60303 475.32229
1785.0000 -127.45571 -124.35187 3.10385 1.91180 -124.15806 433.59030
1790.0000 -125.91393 -122.79912 3.11481 1.94754 -123.66658 463.70845
1795.0000 -126.77439 -123.59079 3.18360 1.98343 -123.17300 499.12975
1800.0000 -126.80848 -123.25448 3.55400 1.96707 -123.39800 494.58189
1805.0000 -127.26619 -124.30036 2.96583 1.94693 -123.67488 475.94171
1810.0000 -127.56776 -124.71827 2.84949 1.89808 -124.34670 449.54583
1815.0000 -127.03477 -124.28279 2.75197 1.87736 -124.63166 417.53800
1820.0000 -127.20808 -123.89150 3.31658 1.93062 -123.89920 474.24474
1825.0000 -126.83601 -122.86286 3.97315 1.97693 -123.26236 504.57042
1830.0000 -126.74091 -123.82600 2.91491 1.98163 -123.19776 506.45484
1835.0000 -126.92314 -124.07518 2.84796 1.91216 -124.15306 449.58726
1840.0000 -127.07911 -123.40834 3.67077 1.94866 -123.65114 492.32836
1845.0000 -127.16258 -123.87456 3.28802 1.96133 -123.47691 492.65909
1850.0000 -126.02047 -123.21259 2.80788 1.93554 -123.83159 471.69686
1855.0000 -127.28346 -123.51561 3.76786 1.97418 -123.30014 507.34718
1860.0000 -126.42718 -122.98074 3.44644 1.96215 -123.46559 497.47301
1865.0000 -126.03707 -122.88168 3.15539 1.99427 -123.02383 511.51321
1870.0000 -126.36242 -122.37582 3.98660 1.99341 -123.03569 495.86683
1875.0000 -127.24042 -124.25695 2.98347 1.96875 -123.37486 479.69196
1880.0000 -127.22018 -124.35585 2.86433 1.90220 -124.29004 442.56612
1885.0000 -127.06122 -124.04736 3.01387 1.90620 -124.23508 444.60600
1890.0000 -127.51977 -124.62137 2.89840 1.90740 -124.21851 444.59118
1895.0000 -127.11428 -124.28134 2.83294 1.90041 -124.31471 441.38335
1900.0000 -127.16640 -124.39510 2.77130 1.92535 -123.97166 470.05195
1905.0000 -127.57427 -124.19636 3.37791 1.93375 -123.85614 476.09893
1910.0000 -126.98791 -123.60428 3.38362 1.90611 -124.23631 469.14261
1915.0000 -127.74237 -124.15905 3.58332 1.94722 -123.67095 497.95149
1920.0000 -126.87447 -123.59772 3.27675 1.92695 -123.94973 486.84534
1925.0000 -126.82040 -123.49384 3.32657 1.94126 -123.75294 485.69003
1930.0000 -127.07655 -124.35691 2.71964 1.92728 -123.94524 468.37146
1935.0000 -127.68632 -124.73713 2.94918 1.87929 -124.60522 429.76276
1940.0000 -126.70051 -123.50124 3.19927 1.89785 -124.34992 448.14210
1945.0000 -126.26986 -123.51188 2.75798 1.94763 -123.66534 475.72489
1950.0000 -127.29100 -124.34733 2.94367 1.92188 -124.01949 475.36002
1955.0000 -127.03031 -124.25368 2.77663 1.93291 -123.86776 450.59814
1960.0000 -126.64219 -123.30558 3.33662 1.92621 -123.95983 446.00292
1965.0000 -127.00083 -124.14515 2.85568 1.94101 -123.75639 478.80505
1970.0000 -127.13002 -123.77046 3.35956 1.92073 -124.03527 456.96857
1975.0000 -126.79725 -123.75809 3.03915 1.96259 -123.45952 488.53420
1980.0000 -126.34897 -123.82870 2.52027 1.94497 -123.70185 452.08314
1985.0000 -126.84923 -123.76173 3.08750 1.92607 -123.96188 443.82704
1990.0000 -126.65883 -123.66901 2.98982 1.90994 -124.18371 448.04456
1995.0000 -126.07526 -123.00207 3.07320 1.96310 -123.45258 459.43808
2000.0000 -126.01475 -122.58175 3.43300 1.99202 -123.05485 484.34890
MELTING PROCESS: loop number 9 T-loop= 497.00000000000000
main_MD> interactions number 9 at Temperature= 497.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.32622 1.88754 1.13586
force_rgl> df(natom) 0.14414 1.65616 0.76167
2005.0000 -125.59498 -122.56740 3.02758 2.03894 -122.40961 521.83336
2010.0000 -126.95811 -123.58477 3.37333 1.97069 -123.34824 475.60460
2015.0000 -126.53593 -123.03585 3.50008 1.98006 -123.21938 518.00176
2020.0000 -126.25135 -123.07810 3.17325 1.97810 -123.24622 515.32615
2025.0000 -126.33587 -123.38255 2.95332 1.98348 -123.17228 523.19932
2030.0000 -125.86288 -122.93721 2.92567 2.00012 -122.94345 513.25081
2035.0000 -126.84114 -123.76496 3.07618 1.96218 -123.46523 483.63402
2040.0000 -126.69450 -124.29530 2.39920 1.88957 -124.46384 425.10200
2045.0000 -126.41723 -123.24719 3.17004 1.93911 -123.78250 456.36069
2050.0000 -126.70303 -123.70144 3.00159 1.94114 -123.75457 448.36830
2055.0000 -126.66887 -123.93772 2.73115 1.92928 -123.91764 448.62045
2060.0000 -126.21681 -123.12361 3.09319 1.96608 -123.41157 467.21440
2065.0000 -126.50132 -123.35375 3.14758 1.98111 -123.20494 485.62212
2070.0000 -125.73586 -122.34445 3.39141 2.02669 -122.57807 521.16623
2075.0000 -126.41730 -122.77798 3.63932 2.04716 -122.29647 539.69652
2080.0000 -126.50875 -123.03300 3.47575 2.01186 -122.78201 504.73095
2085.0000 -125.75971 -122.25101 3.50870 2.02286 -122.63074 498.57547
2090.0000 -126.51551 -123.28853 3.22698 2.01403 -122.75217 498.96242
2095.0000 -126.33913 -123.45623 2.88290 1.96114 -123.47948 453.48683
2100.0000 -126.68657 -123.07825 3.60832 1.94295 -123.72965 450.62932
2105.0000 -126.48325 -123.26285 3.22040 2.01264 -122.77123 531.62511
2110.0000 -126.67099 -123.49930 3.17169 1.99017 -123.08027 502.17866
2115.0000 -127.94111 -124.23217 3.70894 1.95176 -123.60846 487.67118
2120.0000 -127.89002 -124.60489 3.28513 1.90450 -124.25850 450.62997
2125.0000 -126.93869 -123.68051 3.25819 1.89719 -124.35903 438.29335
2130.0000 -126.73508 -123.48035 3.25473 1.96447 -123.43376 493.08822
2135.0000 -126.93543 -124.24580 2.68964 1.95562 -123.55548 462.94206
2140.0000 -126.03254 -123.37353 2.65901 1.93030 -123.90361 439.22779
2145.0000 -126.10893 -122.63393 3.47501 2.00240 -122.91210 508.14138
2150.0000 -126.85410 -123.24860 3.60551 1.98457 -123.15726 499.47632
2155.0000 -126.42958 -122.87630 3.55329 2.00172 -122.92140 494.10071
2160.0000 -126.48148 -123.13143 3.35005 2.01334 -122.76168 552.58536
2165.0000 -127.35327 -124.24977 3.10350 1.95167 -123.60970 479.66600
2170.0000 -126.70353 -123.85007 2.85347 1.90009 -124.31915 437.02617
2175.0000 -126.53676 -122.97464 3.56212 1.98588 -123.13927 522.65688
2180.0000 -126.55122 -122.82970 3.72152 2.01476 -122.74210 523.31894
2185.0000 -126.24799 -122.84308 3.40491 1.98439 -123.15972 478.15451
2190.0000 -126.21442 -123.05609 3.15833 1.99807 -122.97166 489.32551
2195.0000 -126.38184 -122.21266 4.16918 2.01922 -122.68079 531.11564
2200.0000 -126.65604 -123.03809 3.61795 2.03043 -122.52660 549.98684
2205.0000 -126.20232 -122.69246 3.50986 2.00199 -122.91771 529.84727
2210.0000 -125.73572 -122.95046 2.78526 2.00097 -122.93175 517.41143
2215.0000 -127.24031 -123.82136 3.41894 1.97995 -123.22087 524.39492
2220.0000 -126.74055 -123.95510 2.78545 1.92370 -123.99446 480.78228
2225.0000 -126.65370 -123.42286 3.23084 1.95787 -123.52444 495.16959
2230.0000 -126.83926 -123.57180 3.26745 1.95928 -123.50515 515.96606
2235.0000 -126.93172 -123.77591 3.15582 1.94643 -123.68184 511.42041
2240.0000 -127.71674 -124.27751 3.43923 1.89964 -124.32533 470.57662
2245.0000 -127.47787 -124.14514 3.33274 1.94955 -123.63891 508.21011
2250.0000 -126.46606 -123.21868 3.24738 1.94747 -123.66752 490.99495
MELTING PROCESS: loop number 10 T-loop= 522.00000000000000
main_MD> interactions number 10 at Temperature= 522.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.70781 0.49832 -4.72974
force_rgl> df(natom) -2.48098 0.98659 3.13511
2255.0000 -126.93920 -123.50141 3.43779 1.96623 -123.40953 520.14613
2260.0000 -127.02790 -123.53161 3.49629 1.96048 -123.48855 531.32077
2265.0000 -127.09859 -123.33897 3.75962 1.95375 -123.58118 515.63896
2270.0000 -125.81164 -122.04024 3.77140 2.00742 -122.84311 539.05460
2275.0000 -126.35630 -122.62177 3.73453 2.07219 -121.95235 579.42740
2280.0000 -125.89792 -122.35127 3.54666 2.00783 -122.83740 540.34374
2285.0000 -126.83842 -123.73917 3.09925 1.99014 -123.08065 520.42201
2290.0000 -126.89986 -123.54815 3.35171 1.96558 -123.41850 503.38859
2295.0000 -127.18348 -123.36892 3.81456 1.95869 -123.51323 485.21915
2300.0000 -126.51915 -123.25749 3.26166 1.96585 -123.41477 501.56300
2305.0000 -126.84960 -123.58392 3.26567 1.94543 -123.69560 482.69946
2310.0000 -126.58380 -123.20809 3.37570 1.98818 -123.10764 511.96472
2315.0000 -126.65604 -123.31503 3.34101 2.00408 -122.88904 512.52500
2320.0000 -126.04057 -121.94229 4.09828 1.97104 -123.34343 486.73096
2325.0000 -126.19798 -122.59950 3.59848 2.04001 -122.39489 556.82450
2330.0000 -125.83859 -122.31247 3.52612 2.04755 -122.29110 543.95913
2335.0000 -125.81358 -122.67038 3.14320 2.01499 -122.73893 500.99115
2340.0000 -125.53816 -122.29280 3.24536 2.06284 -122.08089 527.43294
2345.0000 -125.81561 -122.45492 3.36068 2.04809 -122.28374 520.91840
2350.0000 -126.91237 -122.96324 3.94913 2.01604 -122.72450 526.44082
2355.0000 -125.66298 -122.29912 3.36386 1.99594 -123.00095 506.08014
2360.0000 -126.78679 -123.89156 2.89523 2.02275 -122.63223 541.39805
2365.0000 -126.13190 -122.97275 3.15916 1.96212 -123.46601 478.89897
2370.0000 -125.78180 -121.87366 3.90814 2.04726 -122.29516 546.18370
2375.0000 -125.46731 -122.40009 3.06722 2.07630 -121.89578 562.74677
2380.0000 -126.09709 -121.95354 4.14356 2.02880 -122.54907 533.31761
2385.0000 -125.61344 -121.91139 3.70205 2.06796 -122.01047 554.98055
2390.0000 -126.00529 -122.13274 3.87255 2.05580 -122.17777 553.03343
2395.0000 -126.11867 -122.87075 3.24793 2.00516 -122.87411 516.36506
2400.0000 -126.58708 -123.53957 3.04751 1.97922 -123.23094 499.28643
2405.0000 -126.10327 -123.34119 2.76208 1.96147 -123.47494 484.70090
2410.0000 -126.72941 -123.37036 3.35905 1.97133 -123.33941 487.54663
2415.0000 -127.22141 -124.20805 3.01336 1.90260 -124.28458 430.97072
2420.0000 -126.76166 -124.00764 2.75402 1.92032 -124.04085 436.08922
2425.0000 -127.40588 -124.52871 2.87717 1.91027 -124.17910 439.04921
2430.0000 -126.94233 -123.61050 3.33183 1.93622 -123.82225 465.43997
2435.0000 -125.50392 -122.02284 3.48108 2.00852 -122.82795 538.24066
2440.0000 -126.66640 -122.90621 3.76018 2.01984 -122.67224 526.95052
2445.0000 -125.45135 -121.74792 3.70343 2.04209 -122.36628 539.07147
2450.0000 -126.15134 -123.17076 2.98058 2.03674 -122.43981 534.95640
2455.0000 -126.24303 -122.56880 3.67423 1.99345 -123.03513 495.71825
2460.0000 -126.53750 -122.81005 3.72745 2.00896 -122.82183 499.49127
2465.0000 -125.27158 -121.81142 3.46017 2.05454 -122.19507 539.70977
2470.0000 -125.65929 -121.50117 4.15812 2.07609 -121.89862 544.64929
2475.0000 -125.27174 -121.94181 3.32993 2.09757 -121.60332 578.03628
2480.0000 -125.30554 -121.31744 3.98810 2.09568 -121.62923 557.97067
2485.0000 -125.91574 -122.51137 3.40437 2.04731 -122.29441 541.12415
2490.0000 -126.23132 -122.29473 3.93659 2.05351 -122.20920 541.71082
2495.0000 -125.20576 -121.75545 3.45031 2.06606 -122.03662 564.22839
2500.0000 -126.57517 -123.12044 3.45473 2.02824 -122.55675 535.94153
MELTING PROCESS: loop number 11 T-loop= 547.00000000000000
main_MD> interactions number 11 at Temperature= 547.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.42702 -0.56659 3.30910
force_rgl> df(natom) -3.81298 -1.49039 -0.90532
2505.0000 -125.87505 -121.80544 4.06960 2.02214 -122.64061 523.34453
2510.0000 -125.34774 -121.77585 3.57189 2.07409 -121.92616 564.77184
2515.0000 -125.63834 -122.64116 2.99718 2.03404 -122.47700 524.63707
2520.0000 -125.69941 -121.80976 3.88966 2.07732 -121.88179 579.09427
2525.0000 -126.23067 -123.40698 2.82369 2.03285 -122.49330 537.14006
2530.0000 -125.87781 -122.59318 3.28464 1.98847 -123.10367 492.34685
2535.0000 -126.47352 -122.93960 3.53392 2.00465 -122.88113 510.27420
2540.0000 -126.62017 -123.22725 3.39292 2.02396 -122.61553 546.46723
2545.0000 -127.03214 -122.98674 4.04541 1.97282 -123.31888 494.79862
2550.0000 -125.20511 -121.93993 3.26518 2.06373 -122.06870 574.61804
2555.0000 -126.31846 -122.73610 3.58236 2.04037 -122.38985 529.93019
2560.0000 -125.58212 -121.89500 3.68713 2.03496 -122.46433 516.46925
2565.0000 -124.72768 -120.31254 4.41514 2.13202 -121.12952 599.61851
2570.0000 -125.42051 -121.49041 3.93010 2.13376 -121.10553 617.37914
2575.0000 -125.48620 -122.26790 3.21830 2.10117 -121.55373 598.13132
2580.0000 -126.49442 -122.18902 4.30540 2.08073 -121.83482 577.82075
2585.0000 -125.61827 -121.78932 3.82895 2.06106 -122.10541 550.26715
2590.0000 -125.70470 -122.41335 3.29135 2.05231 -122.22574 540.24564
2595.0000 -125.64746 -121.89742 3.75005 2.06258 -122.08451 554.71484
2600.0000 -125.74020 -122.35636 3.38384 2.06376 -122.06818 537.03538
2605.0000 -126.14492 -122.42538 3.71954 2.02067 -122.66081 516.17642
2610.0000 -125.30942 -121.77655 3.53287 2.08576 -121.76565 588.79700
2615.0000 -124.89197 -120.72660 4.16537 2.11109 -121.41740 581.43438
2620.0000 -126.53721 -122.71779 3.81942 2.06424 -122.06157 548.80060
2625.0000 -125.70726 -121.95370 3.75356 2.02945 -122.54012 526.42393
2630.0000 -125.34648 -122.30016 3.04632 2.04311 -122.35227 535.23199
2635.0000 -125.12697 -121.04870 4.07827 2.08955 -121.71359 566.42246
2640.0000 -125.81172 -122.35111 3.46060 2.07788 -121.87408 544.16229
2645.0000 -125.28680 -121.48578 3.80101 2.08788 -121.73656 545.52613
2650.0000 -126.07860 -121.66246 4.41614 2.05675 -122.16462 544.55559
2655.0000 -125.39110 -122.46383 2.92727 2.06568 -122.04183 539.71101
2660.0000 -125.69696 -122.01274 3.68423 2.04590 -122.31385 535.21169
2665.0000 -125.28390 -121.66333 3.62057 2.06874 -121.99981 561.03268
2670.0000 -125.93779 -122.36383 3.57396 2.07768 -121.87682 563.90604
2675.0000 -125.71950 -121.77268 3.94682 2.07864 -121.86367 559.56284
2680.0000 -125.46137 -121.28342 4.17795 2.11585 -121.35193 600.54636
2685.0000 -125.82874 -122.25623 3.57251 2.12444 -121.23379 595.89991
2690.0000 -125.20372 -121.66322 3.54050 2.06327 -122.07493 555.77969
2695.0000 -124.75676 -121.62655 3.13021 2.09698 -121.61140 584.65462
2700.0000 -125.22126 -122.08967 3.13159 2.05609 -122.17375 544.01904
2705.0000 -125.72407 -122.43858 3.28550 2.04931 -122.26701 545.53549
2710.0000 -126.56528 -123.34161 3.22367 2.02152 -122.64916 503.39118
2715.0000 -125.99709 -122.51433 3.48276 2.02735 -122.56902 517.70729
2720.0000 -125.36706 -122.34367 3.02339 2.07601 -121.89971 546.18739
2725.0000 -125.42497 -122.57887 2.84610 2.01632 -122.72065 501.66445
2730.0000 -125.97489 -122.80293 3.17197 2.02954 -122.53879 532.86235
2735.0000 -126.21273 -123.06503 3.14770 2.04443 -122.33413 524.88244
2740.0000 -125.78842 -122.50074 3.28768 1.97699 -123.26155 482.34237
2745.0000 -126.44725 -122.47315 3.97410 2.04388 -122.34161 559.53097
2750.0000 -125.83076 -121.99426 3.83650 2.05591 -122.17621 591.04296
MELTING PROCESS: loop number 12 T-loop= 572.00000000000000
main_MD> interactions number 12 at Temperature= 572.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 3.46525 1.17222 -0.03610
force_rgl> df(natom) -1.61670 -0.43095 0.32157
2755.0000 -126.01009 -122.18164 3.82844 2.04406 -122.33923 538.74519
2760.0000 -125.68963 -121.79064 3.89899 2.05383 -122.20484 540.94557
2765.0000 -126.03633 -122.25312 3.78322 2.06081 -122.10879 535.52340
2770.0000 -125.82386 -122.12574 3.69812 2.08798 -121.73521 570.24185
2775.0000 -126.45993 -123.09573 3.36420 2.04695 -122.29945 542.31527
2780.0000 -126.18906 -121.95514 4.23393 2.01921 -122.68088 533.69678
2785.0000 -125.68023 -122.34427 3.33596 2.04806 -122.28412 544.90270
2790.0000 -125.96457 -122.39828 3.56630 2.03326 -122.48765 519.58236
2795.0000 -125.71078 -122.20791 3.50287 2.03913 -122.40702 531.95761
2800.0000 -126.05872 -122.67153 3.38719 2.04235 -122.36268 532.32792
2805.0000 -125.62848 -122.82535 2.80314 2.04817 -122.28268 543.93433
2810.0000 -125.30594 -122.18121 3.12473 2.05765 -122.15223 550.26482
2815.0000 -125.49178 -121.60999 3.88179 2.06586 -122.03942 531.43331
2820.0000 -125.20819 -121.57793 3.63026 2.07140 -121.96321 556.27555
2825.0000 -125.79053 -122.29490 3.49563 2.07255 -121.94736 571.13975
2830.0000 -125.62446 -122.28350 3.34096 2.05690 -122.16262 557.42409
2835.0000 -125.74391 -121.58322 4.16068 2.09553 -121.63137 598.85531
2840.0000 -126.21018 -123.11168 3.09850 2.04420 -122.33721 550.98160
2845.0000 -125.98319 -122.18686 3.79632 2.03925 -122.40530 531.70481
2850.0000 -125.39949 -121.51175 3.88774 2.08684 -121.75084 561.07822
2855.0000 -124.58866 -120.45902 4.12964 2.10867 -121.45062 583.41547
2860.0000 -125.46652 -122.18873 3.27779 2.11451 -121.37034 588.17909
2865.0000 -125.40430 -121.43382 3.97049 2.09189 -121.68142 565.03957
2870.0000 -124.70103 -121.41481 3.28621 2.12319 -121.25090 585.51229
2875.0000 -124.02820 -120.06787 3.96032 2.17808 -120.49601 630.86764
2880.0000 -124.37843 -120.55148 3.82695 2.16135 -120.72607 607.06141
2885.0000 -125.43670 -122.13021 3.30649 2.15945 -120.75226 617.38587
2890.0000 -124.94955 -121.99361 2.95594 2.09441 -121.64678 579.02711
2895.0000 -125.91864 -122.03320 3.88544 2.05153 -122.23649 546.36171
2900.0000 -126.09699 -122.41158 3.68542 2.05563 -122.18008 557.07461
2905.0000 -125.89119 -122.14063 3.75056 2.05582 -122.17745 564.75920
2910.0000 -125.44963 -121.57522 3.87441 2.07050 -121.97552 541.87772
2915.0000 -125.57928 -122.10112 3.47815 2.06646 -122.03105 526.95311
2920.0000 -125.14451 -120.94705 4.19745 2.08694 -121.74951 563.29525
2925.0000 -125.52843 -121.76712 3.76130 2.12301 -121.25335 603.09219
2930.0000 -124.14897 -120.29569 3.85328 2.12817 -121.18239 602.23678
2935.0000 -124.28374 -120.07751 4.20623 2.19920 -120.20565 653.04511
2940.0000 -125.07130 -121.03569 4.03561 2.15296 -120.84150 605.88963
2945.0000 -125.05533 -120.51643 4.53890 2.14086 -121.00795 600.61558
2950.0000 -125.44464 -121.67815 3.76650 2.11800 -121.32233 574.88826
2955.0000 -125.69613 -122.29780 3.39833 2.05971 -122.12392 530.46931
2960.0000 -125.41242 -121.85998 3.55245 2.10650 -121.48042 593.41772
2965.0000 -125.37610 -121.45669 3.91940 2.11364 -121.38232 591.99587
2970.0000 -124.86883 -120.72615 4.14268 2.13439 -121.09690 606.76663
2975.0000 -125.28074 -121.23188 4.04886 2.10018 -121.56735 567.73883
2980.0000 -125.50433 -122.26010 3.24424 2.07206 -121.95411 534.94538
2985.0000 -124.34502 -120.76493 3.58010 2.09316 -121.66387 544.12032
2990.0000 -125.31606 -121.23819 4.07787 2.16396 -120.69025 605.74895
2995.0000 -125.49273 -122.12688 3.36585 2.08534 -121.77150 580.36745
3000.0000 -126.34992 -122.95337 3.39655 2.01523 -122.73560 512.32175
MELTING PROCESS: loop number 13 T-loop= 597.00000000000000
main_MD> interactions number 13 at Temperature= 597.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.47276 -0.54147 2.20226
force_rgl> df(natom) 0.35304 -1.00695 3.68139
3005.0000 -126.26130 -122.20886 4.05244 2.02009 -122.66877 519.54764
3010.0000 -124.74168 -120.45529 4.28639 2.06465 -122.05603 556.35460
3015.0000 -125.88616 -122.45954 3.42662 2.10614 -121.48543 600.66446
3020.0000 -126.03237 -122.23586 3.79651 2.07791 -121.87370 590.35308
3025.0000 -125.41237 -121.89048 3.52189 2.06549 -122.04450 542.94140
3030.0000 -125.77262 -122.27125 3.50138 2.10995 -121.43295 590.55336
3035.0000 -126.02512 -122.25565 3.76947 2.04558 -122.31820 547.90506
3040.0000 -124.72794 -120.90853 3.81941 2.05407 -122.20145 560.94722
3045.0000 -125.11727 -121.45739 3.65988 2.12569 -121.21662 625.87726
3050.0000 -125.60546 -121.60838 3.99708 2.11813 -121.32053 611.24967
3055.0000 -125.95079 -122.04847 3.90232 2.08932 -121.71670 577.73012
3060.0000 -125.22825 -120.09924 5.12901 2.12027 -121.29109 603.85290
3065.0000 -126.11523 -121.61726 4.49797 2.12929 -121.16702 593.23603
3070.0000 -125.74317 -121.71559 4.02757 2.06758 -122.01566 557.99005
3075.0000 -125.26578 -120.92037 4.34541 2.08980 -121.71012 582.27988
3080.0000 -124.74452 -120.77942 3.96510 2.13441 -121.09657 614.38370
3085.0000 -124.67719 -121.05002 3.62717 2.14635 -120.93245 626.99264
3090.0000 -125.18168 -121.09657 4.08511 2.17923 -120.48021 660.06030
3095.0000 -125.93844 -122.36934 3.56910 2.08454 -121.78248 561.09887
3100.0000 -125.16667 -121.41775 3.74891 2.09757 -121.60325 584.46957
3105.0000 -126.56523 -122.35893 4.20629 2.06055 -122.11242 570.86540
3110.0000 -124.99072 -121.15301 3.83771 2.08543 -121.77020 570.73506
3115.0000 -124.55290 -120.21095 4.34195 2.16668 -120.65284 628.53421
3120.0000 -125.21257 -121.04294 4.16963 2.16325 -120.69998 631.36931
3125.0000 -125.47374 -121.13908 4.33466 2.14276 -120.98173 590.11807
3130.0000 -125.20290 -121.31914 3.88376 2.09648 -121.61821 588.43008
3135.0000 -124.86848 -119.84419 5.02428 2.19526 -120.25975 639.67188
3140.0000 -125.33343 -121.82311 3.51032 2.13225 -121.12640 609.98097
3145.0000 -125.28535 -121.01210 4.27325 2.14186 -120.99416 608.00745
3150.0000 -125.69924 -121.80241 3.89684 2.10760 -121.46529 583.45562
3155.0000 -125.70880 -122.07259 3.63621 2.05258 -122.22198 532.39727
3160.0000 -125.69724 -121.03519 4.66204 2.08041 -121.83930 560.57853
3165.0000 -125.82508 -122.46404 3.36103 2.07547 -121.90716 569.52778
3170.0000 -124.95678 -120.61069 4.34610 2.10221 -121.53946 589.13475
3175.0000 -124.38406 -120.19843 4.18563 2.20536 -120.12086 687.81931
3180.0000 -124.95936 -120.46942 4.48994 2.20326 -120.14983 668.77613
3185.0000 -124.99081 -121.43322 3.55759 2.12465 -121.23090 581.40055
3190.0000 -124.44778 -120.25203 4.19576 2.15909 -120.75723 644.70089
3195.0000 -125.25927 -120.75257 4.50670 2.19309 -120.28966 642.54475
3200.0000 -125.10763 -121.12767 3.97996 2.16285 -120.70546 628.83213
3205.0000 -124.11984 -120.31180 3.80804 2.19120 -120.31565 619.44624
3210.0000 -124.98258 -121.27607 3.70651 2.15641 -120.79403 581.40241
3215.0000 -125.08321 -121.77715 3.30606 2.10891 -121.44731 582.41019
3220.0000 -125.73019 -121.69047 4.03973 2.09517 -121.63630 553.40083
3225.0000 -125.35511 -121.19427 4.16084 2.12200 -121.26726 588.58681
3230.0000 -125.22166 -121.46314 3.75852 2.09194 -121.68071 566.49521
3235.0000 -124.80864 -121.54142 3.26722 2.09905 -121.58288 542.65681
3240.0000 -125.11389 -120.95752 4.15637 2.12605 -121.21164 560.64557
3245.0000 -124.74340 -120.47923 4.26416 2.17081 -120.59601 636.84241
3250.0000 -125.35694 -120.96173 4.39521 2.14088 -121.00759 591.72309
MELTING PROCESS: loop number 14 T-loop= 622.00000000000000
main_MD> interactions number 14 at Temperature= 622.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.89665 -1.45381 2.38368
force_rgl> df(natom) -2.09987 -0.74144 -0.03802
3255.0000 -124.78738 -120.34427 4.44311 2.14912 -120.89436 599.99366
3260.0000 -123.24147 -119.17421 4.06726 2.21288 -120.01754 679.90502
3265.0000 -124.32836 -120.22087 4.10749 2.21736 -119.95587 681.92078
3270.0000 -125.00239 -120.18058 4.82181 2.15740 -120.78043 636.20227
3275.0000 -124.32379 -120.74046 3.58333 2.20526 -120.12222 641.17061
3280.0000 -123.72349 -119.20319 4.52030 2.19310 -120.28945 625.94215
3285.0000 -125.02703 -120.34439 4.68264 2.18320 -120.42566 644.52837
3290.0000 -125.51407 -121.56932 3.94476 2.15056 -120.87458 623.43634
3295.0000 -124.36430 -119.72206 4.64224 2.19189 -120.30620 638.16057
3300.0000 -123.92288 -119.89517 4.02771 2.20097 -120.18126 633.42321
3305.0000 -124.77120 -120.71969 4.05150 2.19051 -120.32518 646.34459
3310.0000 -123.70596 -119.67853 4.02743 2.22781 -119.81214 670.94711
3315.0000 -124.89287 -121.07948 3.81338 2.14907 -120.89505 620.01931
3320.0000 -125.44532 -121.25526 4.19005 2.10870 -121.45025 586.39200
3325.0000 -124.49907 -120.79431 3.70476 2.13881 -121.03617 585.93898
3330.0000 -125.89155 -121.69495 4.19660 2.11787 -121.32416 576.54529
3335.0000 -124.80021 -121.69224 3.10797 2.12377 -121.24301 595.85967
3340.0000 -125.16512 -121.47435 3.69077 2.09253 -121.67255 581.61157
3345.0000 -124.49632 -120.15946 4.33686 2.16187 -120.71899 628.14740
3350.0000 -125.14580 -120.24631 4.89948 2.16952 -120.61373 659.54249
3355.0000 -124.63746 -120.41820 4.21926 2.16058 -120.73674 635.79621
3360.0000 -125.18225 -120.00220 5.18005 2.16195 -120.71786 647.14386
3365.0000 -124.74007 -119.91947 4.82060 2.17853 -120.48989 625.11738
3370.0000 -125.84365 -121.20843 4.63522 2.18719 -120.37077 635.37252
3375.0000 -125.17546 -120.82710 4.34836 2.12904 -121.17049 608.93034
3380.0000 -125.60383 -122.22015 3.38368 2.14577 -120.94034 620.93419
3385.0000 -125.52754 -121.26054 4.26700 2.11682 -121.33856 622.38858
3390.0000 -126.13787 -122.77899 3.35887 2.07261 -121.94658 588.94879
3395.0000 -126.17043 -122.64578 3.52465 1.99427 -123.02387 498.76274
3400.0000 -125.50967 -121.83455 3.67513 2.06135 -122.10140 557.87204
3405.0000 -124.97323 -120.86733 4.10590 2.13232 -121.12535 617.84077
3410.0000 -125.64149 -121.54115 4.10034 2.14526 -120.94735 610.85889
3415.0000 -124.73102 -120.36728 4.36374 2.14070 -121.01013 617.49730
3420.0000 -124.94078 -120.50477 4.43602 2.20222 -120.16405 682.42714
3425.0000 -125.22838 -120.63650 4.59188 2.14885 -120.89805 622.06538
3430.0000 -124.89740 -121.49094 3.40646 2.12035 -121.28999 597.21670
3435.0000 -124.98840 -121.37738 3.61102 2.12722 -121.19553 588.49199
3440.0000 -125.17306 -120.82197 4.35109 2.14387 -120.96648 611.23304
3445.0000 -123.68092 -119.18039 4.50053 2.23019 -119.77937 626.09907
3450.0000 -123.00482 -118.90662 4.09820 2.28254 -119.05943 723.15197
3455.0000 -123.41848 -118.26238 5.15610 2.28188 -119.06861 735.00214
3460.0000 -124.89059 -120.67789 4.21269 2.22980 -119.78477 677.30482
3465.0000 -125.25979 -121.27530 3.98450 2.13373 -121.10595 595.64609
3470.0000 -124.82939 -120.71876 4.11063 2.15402 -120.82698 630.13309
3475.0000 -126.00649 -121.64147 4.36502 2.10206 -121.54147 599.62184
3480.0000 -125.73084 -120.90741 4.82343 2.12823 -121.18159 597.36209
3485.0000 -124.18372 -119.70211 4.48161 2.22405 -119.86387 682.92831
3490.0000 -124.81095 -120.39182 4.41913 2.19412 -120.27541 642.09006
3495.0000 -123.90586 -119.35285 4.55300 2.20795 -120.08533 630.04336
3500.0000 -125.07598 -119.94533 5.13065 2.22924 -119.79246 685.33381
MELTING PROCESS: loop number 15 T-loop= 647.00000000000000
main_MD> interactions number 15 at Temperature= 647.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 3.20311 1.78994 -4.59181
force_rgl> df(natom) -0.99602 1.76107 2.50158
3505.0000 -124.56043 -120.39543 4.16500 2.21724 -119.95755 669.68194
3510.0000 -124.52610 -120.38181 4.14429 2.19905 -120.20773 634.77328
3515.0000 -124.31081 -119.97382 4.33699 2.14983 -120.88454 633.70508
3520.0000 -124.58080 -120.66488 3.91593 2.13733 -121.05648 603.45178
3525.0000 -124.64156 -120.80431 3.83725 2.16841 -120.62910 640.27630
3530.0000 -125.16045 -120.93944 4.22101 2.14588 -120.93887 629.71797
3535.0000 -125.99619 -121.98239 4.01380 2.12298 -121.25377 598.75125
3540.0000 -125.48018 -121.35150 4.12868 2.09839 -121.59196 592.41094
3545.0000 -124.72197 -120.63822 4.08375 2.14973 -120.88591 627.33057
3550.0000 -124.99513 -120.85130 4.14384 2.12991 -121.15851 611.92652
3555.0000 -125.41274 -121.05712 4.35562 2.16572 -120.66601 648.99482
3560.0000 -125.62132 -121.45606 4.16525 2.08689 -121.75012 567.49892
3565.0000 -124.80931 -120.68972 4.11959 2.09407 -121.65146 595.77171
3570.0000 -123.50108 -119.47764 4.02344 2.21030 -120.05290 684.13772
3575.0000 -124.64355 -119.51258 5.13097 2.22911 -119.79422 718.63758
3580.0000 -123.13034 -118.35885 4.77149 2.27939 -119.10277 683.05739
3585.0000 -124.12653 -119.76552 4.36101 2.26739 -119.26790 690.85598
3590.0000 -123.87788 -119.14751 4.73036 2.22865 -119.80059 655.19731
3595.0000 -123.96264 -119.98595 3.97669 2.25062 -119.49843 687.03789
3600.0000 -125.21346 -120.17783 5.03562 2.21551 -119.98127 665.04607
3605.0000 -123.81345 -119.56772 4.24573 2.23874 -119.66187 690.35317
3610.0000 -125.07696 -120.57391 4.50305 2.18556 -120.39314 652.64222
3615.0000 -125.76631 -121.20770 4.55861 2.17704 -120.51030 631.24447
3620.0000 -125.78331 -121.22046 4.56285 2.12748 -121.19199 608.03351
3625.0000 -124.71303 -120.97728 3.73575 2.10099 -121.55627 581.25088
3630.0000 -124.83502 -120.22411 4.61091 2.17539 -120.53304 631.74411
3635.0000 -123.76625 -120.04678 3.71947 2.20797 -120.08506 652.63690
3640.0000 -124.92145 -120.92544 3.99601 2.16810 -120.63328 622.50056
3645.0000 -125.28981 -121.29637 3.99344 2.11502 -121.36323 572.86514
3650.0000 -125.72692 -121.87625 3.85066 2.15908 -120.75742 639.67902
3655.0000 -124.96655 -119.88365 5.08291 2.14186 -120.99411 618.60368
3660.0000 -124.89578 -120.54307 4.35271 2.17922 -120.48038 615.63044
3665.0000 -124.66716 -120.82159 3.84557 2.17466 -120.54305 625.50932
3670.0000 -125.24949 -120.86251 4.38698 2.14854 -120.90237 627.29538
3675.0000 -124.89024 -121.03488 3.85536 2.13187 -121.13154 604.01809
3680.0000 -124.96218 -120.80363 4.15855 2.16429 -120.68575 615.72778
3685.0000 -124.16761 -120.34614 3.82147 2.19124 -120.31514 670.59792
3690.0000 -125.64778 -120.36617 5.28161 2.15864 -120.76336 660.16433
3695.0000 -124.23541 -120.47727 3.75814 2.16047 -120.73829 646.57361
3700.0000 -126.25838 -122.31716 3.94122 2.10201 -121.54214 563.08915
3705.0000 -124.87131 -121.10412 3.76718 2.10774 -121.46335 599.22499
3710.0000 -124.20185 -119.90350 4.29835 2.17288 -120.56754 626.77964
3715.0000 -124.23045 -119.29910 4.93135 2.24036 -119.63960 693.42027
3720.0000 -125.29724 -120.47836 4.81887 2.23016 -119.77977 701.47714
3725.0000 -125.65104 -121.48400 4.16704 2.14181 -120.99487 612.17207
3730.0000 -123.95107 -119.39742 4.55365 2.16720 -120.64568 632.82523
3735.0000 -124.71112 -120.34121 4.36991 2.23597 -119.69991 676.34997
3740.0000 -125.33018 -120.88223 4.44795 2.15520 -120.81076 639.02666
3745.0000 -125.00208 -120.65879 4.34329 2.20456 -120.13185 678.21460
3750.0000 -124.03099 -119.61886 4.41213 2.19863 -120.21340 658.11418
MELTING PROCESS: loop number 16 T-loop= 672.00000000000000
main_MD> interactions number 16 at Temperature= 672.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.28143 -1.50559 4.17742
force_rgl> df(natom) 2.30451 1.67073 0.08456
3755.0000 -123.58508 -118.68187 4.90320 2.28397 -119.03986 717.68827
3760.0000 -124.29992 -118.85947 5.44045 2.29866 -118.83777 722.69455
3765.0000 -124.13278 -120.46305 3.66973 2.23086 -119.77016 650.31021
3770.0000 -124.21924 -120.29413 3.92512 2.18347 -120.42191 625.66595
3775.0000 -124.33544 -120.30980 4.02564 2.19344 -120.28484 655.57201
3780.0000 -124.69496 -119.91839 4.77657 2.22404 -119.86396 670.86677
3785.0000 -125.22456 -120.76547 4.45909 2.18172 -120.44607 645.76736
3790.0000 -123.74861 -119.06048 4.68813 2.19670 -120.23996 646.78392
3795.0000 -123.48499 -118.19205 5.29294 2.36389 -117.94070 793.30819
3800.0000 -124.30214 -119.76923 4.53291 2.33448 -118.34518 752.48084
3805.0000 -124.99443 -120.61569 4.37875 2.24826 -119.53094 684.79545
3810.0000 -125.15514 -120.75750 4.39764 2.16045 -120.73848 639.57743
3815.0000 -125.15181 -120.79327 4.35854 2.19085 -120.32049 648.86673
3820.0000 -124.68779 -120.39251 4.29528 2.21215 -120.02750 689.40801
3825.0000 -124.14102 -119.69379 4.44723 2.24818 -119.53198 709.25189
3830.0000 -124.40937 -120.53643 3.87293 2.20412 -120.13794 666.27546
3835.0000 -124.89052 -120.62608 4.26444 2.21090 -120.04472 689.59473
3840.0000 -123.59703 -119.83802 3.75902 2.20390 -120.14104 648.80271
3845.0000 -125.22455 -120.96186 4.26269 2.17054 -120.59980 638.33101
3850.0000 -124.30562 -120.51357 3.79205 2.12471 -121.23002 573.46775
3855.0000 -124.73130 -119.47060 5.26071 2.19306 -120.29011 671.05619
3860.0000 -125.04270 -120.63167 4.41103 2.20381 -120.14221 688.39541
3865.0000 -125.12315 -121.49358 3.62957 2.15295 -120.84168 646.05399
3870.0000 -124.50282 -120.58996 3.91287 2.15214 -120.85279 667.61453
3875.0000 -125.23538 -121.12324 4.11213 2.16119 -120.72835 642.56805
3880.0000 -125.35511 -120.50861 4.84650 2.13161 -121.13513 617.43689
3885.0000 -125.03333 -120.38852 4.64481 2.16712 -120.64675 634.17026
3890.0000 -124.65926 -119.51426 5.14500 2.20256 -120.15935 650.15863
3895.0000 -123.50076 -118.89139 4.60937 2.23750 -119.67893 651.72156
3900.0000 -123.08706 -118.36170 4.72536 2.32236 -118.51188 760.31201
3905.0000 -123.28163 -117.71128 5.57035 2.37372 -117.80559 775.41373
3910.0000 -123.99128 -119.17381 4.81747 2.34271 -118.23193 770.72157
3915.0000 -124.49395 -119.99360 4.50035 2.25284 -119.46794 712.06790
3920.0000 -123.68045 -120.02524 3.65522 2.15570 -120.80386 599.90415
3925.0000 -123.95280 -119.60500 4.34779 2.22035 -119.91472 683.87794
3930.0000 -125.99600 -121.89805 4.09795 2.22674 -119.82685 673.74557
3935.0000 -124.98061 -121.80284 3.17777 2.11073 -121.42226 599.44790
3940.0000 -124.96677 -120.68175 4.28503 2.15148 -120.86194 628.60044
3945.0000 -125.56873 -121.65978 3.90895 2.17829 -120.49313 655.15764
3950.0000 -124.65107 -121.57031 3.08075 2.09297 -121.66655 570.43044
3955.0000 -125.36734 -121.27712 4.09022 2.11188 -121.40653 596.72016
3960.0000 -124.76375 -121.34988 3.41387 2.13935 -121.02873 603.67633
3965.0000 -124.22218 -120.05322 4.16897 2.17104 -120.59293 640.71289
3970.0000 -124.04322 -119.44726 4.59597 2.25087 -119.49498 700.57638
3975.0000 -125.19334 -120.43178 4.76156 2.22703 -119.82291 670.56608
3980.0000 -123.55225 -117.58501 5.96725 2.30166 -118.79649 728.49880
3985.0000 -123.81689 -119.40179 4.41510 2.34815 -118.15722 781.28960
3990.0000 -124.29624 -119.87355 4.42270 2.21933 -119.92879 661.43070
3995.0000 -124.97212 -120.31666 4.65546 2.20507 -120.12493 663.91156
4000.0000 -124.93392 -120.34170 4.59223 2.16994 -120.60806 651.72295
MELTING PROCESS: loop number 17 T-loop= 697.00000000000000
main_MD> interactions number 17 at Temperature= 697.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.11847 -1.23717 1.57035
force_rgl> df(natom) 1.63339 -3.84363 -0.92273
4005.0000 -123.77355 -119.07783 4.69572 2.23190 -119.75596 660.56269
4010.0000 -124.35836 -120.31221 4.04615 2.20478 -120.12887 657.84938
4015.0000 -124.59571 -120.25445 4.34126 2.19856 -120.21445 636.89173
4020.0000 -124.73283 -120.02972 4.70311 2.21095 -120.04403 633.95576
4025.0000 -123.09486 -118.19066 4.90420 2.30433 -118.75986 720.49568
4030.0000 -123.51007 -118.25033 5.25974 2.35350 -118.08360 739.62926
4035.0000 -124.99327 -120.24590 4.74737 2.31276 -118.64393 726.96157
4040.0000 -124.33146 -119.67372 4.65775 2.22688 -119.82498 689.83150
4045.0000 -123.42369 -118.51084 4.91285 2.25335 -119.46085 666.35449
4050.0000 -123.31880 -118.84638 4.47242 2.26968 -119.23638 695.50177
4055.0000 -124.17419 -119.36771 4.80649 2.26405 -119.31370 686.98731
4060.0000 -123.87338 -119.54377 4.32961 2.23702 -119.68550 671.42260
4065.0000 -124.78300 -120.57568 4.20732 2.24000 -119.64448 677.42183
4070.0000 -124.33149 -119.83357 4.49793 2.19822 -120.21913 638.05554
4075.0000 -124.74882 -119.34419 5.40463 2.23438 -119.72178 684.20906
4080.0000 -123.64482 -120.09764 3.54718 2.25167 -119.48403 704.71766
4085.0000 -123.27789 -118.76632 4.51157 2.23811 -119.67045 643.91052
4090.0000 -123.45360 -118.30394 5.14966 2.29406 -118.90098 715.83396
4095.0000 -124.14744 -119.03783 5.10962 2.29804 -118.84628 737.22029
4100.0000 -123.84870 -119.75514 4.09357 2.22446 -119.85821 670.49509
4105.0000 -123.93129 -119.30050 4.63079 2.28521 -119.02282 714.98960
4110.0000 -124.50201 -118.97120 5.53081 2.27418 -119.17452 698.70755
4115.0000 -124.50149 -120.51908 3.98241 2.28972 -118.96075 735.31134
4120.0000 -124.07060 -119.67018 4.40042 2.18853 -120.35241 648.87574
4125.0000 -124.78527 -120.64095 4.14432 2.26730 -119.26908 686.28709
4130.0000 -124.54672 -119.50001 5.04672 2.23114 -119.76640 675.78943
4135.0000 -123.39972 -118.96466 4.43505 2.23329 -119.73685 660.16012
4140.0000 -122.08992 -117.48029 4.60964 2.31006 -118.68104 715.63342
4145.0000 -123.23769 -118.75542 4.48227 2.33044 -118.40078 734.20403
4150.0000 -124.22621 -118.90616 5.32005 2.30711 -118.72152 711.22506
4155.0000 -122.98049 -118.05334 4.92716 2.32181 -118.51948 752.95900
4160.0000 -122.45252 -117.45923 4.99329 2.35078 -118.12101 762.97926
4165.0000 -122.87635 -117.91725 4.95910 2.33445 -118.34557 733.98673
4170.0000 -122.49104 -117.40322 5.08782 2.39492 -117.51393 808.84652
4175.0000 -122.50399 -118.23207 4.27192 2.40174 -117.42013 800.35966
4180.0000 -123.90807 -119.81909 4.08898 2.25131 -119.48894 684.86205
4185.0000 -124.54353 -119.87760 4.66592 2.23735 -119.68091 674.78124
4190.0000 -124.01644 -119.68943 4.32701 2.27062 -119.22336 714.14903
4195.0000 -124.49079 -119.99915 4.49164 2.19997 -120.19504 641.85188
4200.0000 -123.89128 -118.84847 5.04281 2.25795 -119.39761 676.14882
4205.0000 -123.17982 -119.23002 3.94980 2.22184 -119.89421 650.49655
4210.0000 -123.83840 -117.99326 5.84514 2.28841 -118.97877 681.30045
4215.0000 -123.50037 -119.40743 4.09294 2.29649 -118.86760 727.50166
4220.0000 -123.15760 -118.49969 4.65791 2.27957 -119.10028 739.10602
4225.0000 -122.90477 -117.98442 4.92035 2.31304 -118.64005 743.26827
4230.0000 -123.86722 -117.75811 6.10911 2.33504 -118.33743 756.49244
4235.0000 -123.22365 -117.83519 5.38846 2.32898 -118.42077 734.83086
4240.0000 -123.07241 -117.95187 5.12053 2.35201 -118.10414 770.77543
4245.0000 -122.53750 -117.03325 5.50424 2.38996 -117.58217 806.55080
4250.0000 -123.58458 -118.64999 4.93459 2.38043 -117.71320 756.96514
MELTING PROCESS: loop number 18 T-loop= 722.00000000000000
main_MD> interactions number 18 at Temperature= 722.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 3.19391 2.10759 -0.72411
force_rgl> df(natom) -0.00619 -0.46131 -1.90882
4255.0000 -123.79732 -119.63718 4.16014 2.30597 -118.73724 741.39958
4260.0000 -123.82496 -119.50318 4.32178 2.26974 -119.23548 715.26167
4265.0000 -123.06501 -119.03922 4.02579 2.29608 -118.87330 738.04172
4270.0000 -123.75804 -118.93649 4.82155 2.31632 -118.59485 768.77207
4275.0000 -123.40036 -118.46535 4.93500 2.25919 -119.38060 691.62900
4280.0000 -123.22314 -118.51342 4.70972 2.26115 -119.35366 665.35939
4285.0000 -124.65228 -120.26696 4.38532 2.25085 -119.49528 678.31425
4290.0000 -124.35392 -119.16918 5.18474 2.21098 -120.04357 646.52829
4295.0000 -123.25922 -118.69295 4.56627 2.27165 -119.20924 701.47731
4300.0000 -122.92792 -118.00468 4.92323 2.31108 -118.66703 740.43571
4305.0000 -123.36971 -118.01033 5.35939 2.34747 -118.16659 788.51496
4310.0000 -123.73252 -117.83433 5.89819 2.31616 -118.59719 753.75803
4315.0000 -124.31968 -119.19185 5.12783 2.29823 -118.84364 714.72176
4320.0000 -123.06404 -118.22548 4.83855 2.29697 -118.86107 719.48804
4325.0000 -123.56350 -118.21121 5.35230 2.36150 -117.97353 778.83113
4330.0000 -124.36308 -120.13691 4.22617 2.29561 -118.87976 752.32930
4335.0000 -123.37071 -118.56669 4.80402 2.25697 -119.41118 706.88895
4340.0000 -123.55433 -119.11723 4.43709 2.33030 -118.40265 744.05194
4345.0000 -123.79423 -118.64797 5.14626 2.30099 -118.80578 742.59810
4350.0000 -124.14533 -118.28120 5.86413 2.37045 -117.85047 788.25186
4355.0000 -122.84965 -118.20372 4.64593 2.33040 -118.40129 745.46552
4360.0000 -124.17786 -119.69904 4.47882 2.32825 -118.43082 728.55743
4365.0000 -123.31488 -119.04738 4.26750 2.24391 -119.59075 660.20259
4370.0000 -123.54605 -117.87183 5.67422 2.31674 -118.58910 751.50970
4375.0000 -124.22377 -119.53980 4.68396 2.29469 -118.89234 747.16950
4380.0000 -123.33342 -118.12620 5.20721 2.28055 -119.08684 725.98234
4385.0000 -123.13850 -117.94530 5.19320 2.37107 -117.84195 801.68231
4390.0000 -123.78058 -119.32844 4.45214 2.34601 -118.18654 784.15369
4395.0000 -124.58901 -120.01772 4.57129 2.25338 -119.46055 694.54551
4400.0000 -124.30984 -119.94918 4.36066 2.26857 -119.25159 671.31847
4405.0000 -123.89925 -118.84768 5.05157 2.25217 -119.47710 686.64243
4410.0000 -123.45458 -118.50444 4.95014 2.26648 -119.28030 746.19547
4415.0000 -123.39469 -118.67007 4.72462 2.31776 -118.57512 769.59773
4420.0000 -123.07551 -118.75051 4.32500 2.32548 -118.46891 737.23271
4425.0000 -122.91107 -117.07264 5.83843 2.35781 -118.02437 775.33641
4430.0000 -122.50103 -117.06131 5.43972 2.41546 -117.23149 823.70752
4435.0000 -124.37722 -118.86259 5.51463 2.35734 -118.03084 772.38351
4440.0000 -123.03265 -118.29794 4.73471 2.31642 -118.59350 732.77786
4445.0000 -124.37666 -119.39652 4.98014 2.28880 -118.97344 731.58199
4450.0000 -123.46269 -118.43618 5.02651 2.30342 -118.77226 720.79982
4455.0000 -123.82331 -119.05179 4.77152 2.32636 -118.45689 764.90007
4460.0000 -123.84464 -118.25603 5.58861 2.28102 -119.08045 688.66754
4465.0000 -124.18426 -119.49203 4.69223 2.30421 -118.76151 769.82585
4470.0000 -123.78492 -119.61340 4.17152 2.24246 -119.61072 647.48283
4475.0000 -125.29583 -120.88545 4.41038 2.20644 -120.10599 648.05759
4480.0000 -124.84197 -120.28688 4.55509 2.12456 -121.23203 604.90076
4485.0000 -124.73559 -120.59218 4.14342 2.21449 -119.99538 655.43434
4490.0000 -123.63566 -120.02249 3.61318 2.21825 -119.94359 672.27518
4495.0000 -124.90754 -121.57388 3.33365 2.17334 -120.56119 636.09640
4500.0000 -124.78048 -120.03142 4.74907 2.15551 -120.80651 618.01656
MELTING PROCESS: loop number 19 T-loop= 747.00000000000000
main_MD> interactions number 19 at Temperature= 747.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.32967 0.58169 1.10754
force_rgl> df(natom) 0.79953 -0.04426 2.92547
4505.0000 -124.24888 -119.94727 4.30161 2.25283 -119.46801 682.74876
4510.0000 -123.52677 -118.66780 4.85897 2.28809 -118.98310 722.21205
4515.0000 -123.26465 -117.88638 5.37827 2.36256 -117.95896 801.27982
4520.0000 -123.72777 -118.57685 5.15092 2.32653 -118.45456 778.15421
4525.0000 -122.89482 -118.18518 4.70964 2.33769 -118.30099 788.36598
4530.0000 -123.05072 -118.27270 4.77802 2.34806 -118.15842 739.11076
4535.0000 -124.00010 -118.49706 5.50304 2.37141 -117.83730 777.37533
4540.0000 -124.42730 -118.45570 5.97160 2.31407 -118.62581 752.25786
4545.0000 -123.68154 -119.08800 4.59355 2.29628 -118.87049 750.16897
4550.0000 -124.42242 -119.92331 4.49911 2.27890 -119.10951 745.76469
4555.0000 -123.15305 -118.38347 4.76958 2.31634 -118.59465 734.71108
4560.0000 -122.38228 -118.24260 4.13968 2.39447 -117.52023 785.93203
4565.0000 -124.03553 -118.94636 5.08917 2.31242 -118.64854 725.08460
4570.0000 -122.80984 -117.39262 5.41723 2.34758 -118.16508 777.63386
4575.0000 -124.23972 -119.73611 4.50361 2.31340 -118.63510 757.14788
4580.0000 -122.59123 -117.91613 4.67510 2.26928 -119.24184 699.63706
4585.0000 -123.41640 -118.77163 4.64477 2.32098 -118.53078 743.08601
4590.0000 -124.52785 -119.98066 4.54719 2.28136 -119.07574 721.06568
4595.0000 -123.70991 -118.70097 5.00894 2.22006 -119.91877 642.43014
4600.0000 -123.00247 -118.69180 4.31067 2.30614 -118.73495 699.94103
4605.0000 -122.64816 -117.70746 4.94070 2.33147 -118.38664 722.47489
4610.0000 -122.75027 -117.96320 4.78707 2.40169 -117.42092 771.49887
4615.0000 -124.10455 -118.58022 5.52432 2.30363 -118.76939 752.79937
4620.0000 -123.51901 -119.65181 3.86720 2.28450 -119.03248 740.35072
4625.0000 -123.71963 -119.15477 4.56486 2.23788 -119.67362 701.44924
4630.0000 -124.02641 -120.27637 3.75004 2.19670 -120.24004 674.81686
4635.0000 -124.28230 -118.89026 5.39204 2.23045 -119.77585 674.94859
4640.0000 -124.51408 -119.37211 5.14197 2.23412 -119.72541 687.71765
4645.0000 -123.95334 -119.33210 4.62124 2.26938 -119.24045 716.28843
4650.0000 -123.43566 -119.53797 3.89769 2.22346 -119.87195 641.72761
4655.0000 -122.60008 -117.27645 5.32363 2.33575 -118.32766 743.63061
4660.0000 -121.92688 -117.01144 4.91544 2.34004 -118.26868 752.59065
4665.0000 -122.67783 -118.28991 4.38792 2.38663 -117.62803 774.41166
4670.0000 -122.02933 -117.25605 4.77328 2.38420 -117.66147 762.97568
4675.0000 -123.18575 -117.80583 5.37992 2.39720 -117.48267 773.80681
4680.0000 -122.78152 -118.27317 4.50835 2.35459 -118.06857 735.86640
4685.0000 -122.58034 -117.57555 5.00479 2.33987 -118.27109 744.03449
4690.0000 -124.11301 -119.30584 4.80717 2.32712 -118.44633 747.17773
4695.0000 -123.13900 -118.57917 4.55983 2.29921 -118.83029 708.96763
4700.0000 -123.02218 -117.71070 5.31148 2.33697 -118.31098 768.22611
4705.0000 -123.74843 -119.69266 4.05578 2.29701 -118.86055 701.65326
4710.0000 -123.35309 -118.83958 4.51351 2.29568 -118.87880 735.09533
4715.0000 -123.54422 -118.52659 5.01763 2.34241 -118.23616 762.04706
4720.0000 -124.01084 -119.76219 4.24865 2.28070 -119.08475 720.12653
4725.0000 -124.56952 -119.48543 5.08408 2.26214 -119.34008 710.43456
4730.0000 -123.85260 -119.14679 4.70581 2.29307 -118.91469 716.06314
4735.0000 -123.90960 -119.98963 3.91997 2.23909 -119.65701 676.07406
4740.0000 -124.91779 -120.42674 4.49105 2.17304 -120.56542 608.23565
4745.0000 -123.28056 -118.93919 4.34137 2.21173 -120.03334 635.67722
4750.0000 -124.37222 -119.53875 4.83346 2.25225 -119.47600 665.07173
MELTING PROCESS: loop number 20 T-loop= 772.00000000000000
main_MD> interactions number 20 at Temperature= 772.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -2.53382 -1.84726 2.24898
force_rgl> df(natom) 0.52020 -9.64203 -3.78690
4755.0000 -124.06102 -118.97586 5.08516 2.22706 -119.82253 741.28906
4760.0000 -123.01550 -118.13122 4.88428 2.27767 -119.12648 696.10736
4765.0000 -123.03039 -118.13304 4.89735 2.30929 -118.69162 729.43824
4770.0000 -122.80545 -118.14025 4.66520 2.33905 -118.28231 792.95736
4775.0000 -123.23533 -119.68282 3.55251 2.31794 -118.57265 766.84875
4780.0000 -124.62042 -119.68572 4.93469 2.24161 -119.62240 700.74869
4785.0000 -121.35764 -114.95186 6.40578 2.39756 -117.47763 841.06883
4790.0000 -122.89403 -117.65608 5.23795 2.45001 -116.75635 822.49356
4795.0000 -122.15330 -117.75341 4.39988 2.44123 -116.87714 809.21253
4800.0000 -123.67261 -118.31203 5.36058 2.36224 -117.96345 772.10419
4805.0000 -123.60659 -118.76696 4.83963 2.36728 -117.89414 781.37094
4810.0000 -123.79576 -118.73022 5.06554 2.28642 -119.00605 684.26284
4815.0000 -123.75361 -118.53230 5.22131 2.33250 -118.37246 726.72217
4820.0000 -122.59342 -117.54050 5.05292 2.40733 -117.34336 800.41311
4825.0000 -123.05463 -117.63691 5.41771 2.39039 -117.57629 785.39320
4830.0000 -122.22327 -118.45234 3.77094 2.33309 -118.36427 747.48729
4835.0000 -122.53694 -118.70956 3.82738 2.34204 -118.24121 744.14156
4840.0000 -123.24457 -118.87786 4.36671 2.29292 -118.91675 724.85266
4845.0000 -123.39705 -118.07086 5.32619 2.30348 -118.77151 743.52213
4850.0000 -121.76655 -116.48836 5.27819 2.35722 -118.03246 775.33415
4855.0000 -123.03601 -117.72983 5.30617 2.42261 -117.13320 827.16433
4860.0000 -121.52681 -115.07447 6.45233 2.48488 -116.27680 869.68459
4865.0000 -121.85449 -117.58309 4.27139 2.45763 -116.65153 812.00847
4870.0000 -123.29176 -118.25863 5.03313 2.33438 -118.34660 733.95474
4875.0000 -122.36154 -117.38138 4.98016 2.37460 -117.79350 774.46690
4880.0000 -122.90896 -117.60348 5.30548 2.37311 -117.81392 770.13483
4885.0000 -123.18516 -118.34951 4.83565 2.36412 -117.93754 807.28383
4890.0000 -123.41452 -118.76283 4.65169 2.35354 -118.08302 772.22975
4895.0000 -123.41047 -118.82163 4.58884 2.33310 -118.36414 721.06599
4900.0000 -124.02796 -119.30167 4.72629 2.31561 -118.60474 750.75920
4905.0000 -122.40400 -117.86128 4.54272 2.33364 -118.35668 741.25588
4910.0000 -121.09277 -115.82258 5.27019 2.45401 -116.70135 841.03684
4915.0000 -122.09077 -116.78547 5.30530 2.48517 -116.27276 836.29967
4920.0000 -124.22400 -118.88347 5.34053 2.37395 -117.80239 789.92175
4925.0000 -122.42078 -117.58557 4.83520 2.33499 -118.33818 749.15710
4930.0000 -123.24873 -117.22897 6.01977 2.39760 -117.47710 795.61341
4935.0000 -123.09580 -118.21633 4.87948 2.39047 -117.57512 791.55853
4940.0000 -122.74017 -116.72523 6.01494 2.40448 -117.38256 782.13333
4945.0000 -123.70291 -116.70949 6.99342 2.39299 -117.54052 783.09327
4950.0000 -122.52290 -117.62172 4.90118 2.37222 -117.82613 750.22979
4955.0000 -123.42344 -117.72425 5.69919 2.40418 -117.38656 818.28799
4960.0000 -122.85694 -116.84126 6.01568 2.40809 -117.33282 856.11262
4965.0000 -122.91705 -118.27842 4.63864 2.37948 -117.72626 797.27268
4970.0000 -124.54470 -118.86533 5.67938 2.30141 -118.79998 724.03579
4975.0000 -123.38632 -118.92826 4.45807 2.28606 -119.01110 716.54447
4980.0000 -120.83487 -116.22276 4.61211 2.39214 -117.55225 798.17150
4985.0000 -121.50009 -116.09194 5.40814 2.50071 -116.05911 862.11968
4990.0000 -122.04725 -116.73952 5.30774 2.43886 -116.90972 856.69893
4995.0000 -122.23917 -116.47188 5.76730 2.48231 -116.31217 868.23595
5000.0000 -122.57942 -116.68094 5.89848 2.45411 -116.69996 827.31263
MELTING PROCESS: loop number 21 T-loop= 797.00000000000000
main_MD> interactions number 21 at Temperature= 797.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.88736 0.45316 -6.39543
force_rgl> df(natom) -1.73676 0.00437 -0.28596
5005.0000 -123.16122 -117.36918 5.79203 2.44880 -116.77303 848.98929
5010.0000 -123.49623 -118.36946 5.12677 2.36913 -117.86867 790.98098
5015.0000 -123.05296 -118.35200 4.70096 2.30930 -118.69147 739.19849
5020.0000 -123.83332 -120.21237 3.62095 2.32147 -118.52414 748.93553
5025.0000 -123.35522 -118.93099 4.42423 2.27128 -119.21439 758.12963
5030.0000 -123.28674 -118.56648 4.72026 2.30723 -118.71991 743.48407
5035.0000 -123.05835 -117.84397 5.21439 2.36010 -117.99278 762.56618
5040.0000 -123.55874 -118.51077 5.04798 2.33070 -118.39717 732.30048
5045.0000 -123.40847 -118.75986 4.64861 2.28623 -119.00873 721.06855
5050.0000 -123.42266 -119.01500 4.40766 2.27764 -119.12689 731.26080
5055.0000 -122.68525 -117.17018 5.51507 2.35775 -118.02519 750.47563
5060.0000 -123.60514 -117.68167 5.92347 2.39231 -117.54983 786.91266
5065.0000 -123.52960 -118.75349 4.77611 2.35369 -118.08101 769.27925
5070.0000 -123.04411 -117.92902 5.11509 2.33900 -118.28296 754.92340
5075.0000 -123.51080 -118.55434 4.95646 2.34768 -118.16363 757.79043
5080.0000 -122.88164 -118.96147 3.92016 2.24937 -119.51567 652.73491
5085.0000 -123.00556 -117.45521 5.55036 2.38409 -117.66295 789.65630
5090.0000 -123.19769 -117.48887 5.70882 2.38353 -117.67060 821.79138
5095.0000 -122.49905 -116.98667 5.51238 2.40973 -117.31026 826.38909
5100.0000 -123.00533 -117.69540 5.30993 2.41518 -117.23536 848.23687
5105.0000 -122.67294 -116.76418 5.90876 2.37386 -117.80358 781.91140
5110.0000 -123.09049 -117.49120 5.59929 2.42832 -117.05464 847.26055
5115.0000 -122.72921 -117.73612 4.99310 2.40891 -117.32154 814.18528
5120.0000 -123.04138 -117.24979 5.79159 2.36973 -117.86035 741.13522
5125.0000 -123.03838 -116.58766 6.45072 2.44407 -116.83806 829.89766
5130.0000 -121.17971 -116.20790 4.97181 2.48811 -116.23241 847.18903
5135.0000 -122.53100 -116.24357 6.28743 2.49890 -116.08397 876.47761
5140.0000 -121.71560 -116.67304 5.04256 2.43791 -116.92274 805.60107
5145.0000 -122.80942 -117.84159 4.96783 2.41829 -117.19259 810.41964
5150.0000 -122.58084 -116.78931 5.79153 2.38347 -117.67139 785.57027
5155.0000 -123.41655 -117.88020 5.53635 2.43275 -116.99368 802.19587
5160.0000 -122.39648 -117.96430 4.43219 2.36399 -117.93938 792.58240
5165.0000 -122.73379 -117.03412 5.69967 2.34502 -118.20016 769.07730
5170.0000 -122.91266 -117.76058 5.15207 2.38558 -117.64247 809.24762
5175.0000 -123.12492 -118.13816 4.98676 2.38396 -117.66468 776.90519
5180.0000 -123.12026 -118.54500 4.57526 2.35439 -118.07143 775.27326
5185.0000 -122.93525 -117.38192 5.55333 2.35467 -118.06746 765.23568
5190.0000 -123.30856 -119.19400 4.11456 2.31983 -118.54670 727.36689
5195.0000 -122.83868 -117.92305 4.91563 2.33573 -118.32803 762.42385
5200.0000 -122.68665 -117.11531 5.57134 2.40547 -117.36892 785.83917
5205.0000 -122.65080 -118.00884 4.64196 2.39975 -117.44755 787.82262
5210.0000 -123.13497 -118.13363 5.00134 2.35187 -118.10605 758.70005
5215.0000 -123.29450 -118.32307 4.97142 2.33467 -118.34252 768.67279
5220.0000 -122.64512 -118.08328 4.56184 2.35318 -118.08801 749.39318
5225.0000 -123.38101 -118.66388 4.71713 2.35697 -118.03587 754.24195
5230.0000 -122.35591 -118.23005 4.12587 2.35373 -118.08040 768.13855
5235.0000 -124.09602 -118.47550 5.62052 2.34443 -118.20830 758.98577
5240.0000 -123.54156 -118.31936 5.22220 2.27059 -119.22375 699.02903
5245.0000 -123.22416 -117.96727 5.25689 2.39290 -117.54176 760.19725
5250.0000 -123.84754 -118.27859 5.56895 2.37182 -117.83171 768.23495
MELTING PROCESS: loop number 22 T-loop= 822.00000000000000
main_MD> interactions number 22 at Temperature= 822.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.24078 -0.75422 -1.21012
force_rgl> df(natom) -2.97760 -2.25618 2.33065
5255.0000 -123.34067 -118.70341 4.63726 2.38197 -117.69213 787.77728
5260.0000 -124.49548 -119.67260 4.82287 2.30530 -118.74649 741.29561
5265.0000 -123.54930 -117.46053 6.08876 2.29147 -118.93668 738.03276
5270.0000 -122.69134 -117.65504 5.03631 2.37200 -117.82920 791.26820
5275.0000 -122.56228 -117.65357 4.90871 2.45239 -116.72369 850.95449
5280.0000 -123.68299 -117.76278 5.92022 2.39683 -117.48770 827.64156
5285.0000 -122.18417 -115.78093 6.40324 2.44530 -116.82109 850.76427
5290.0000 -121.85748 -116.34496 5.51252 2.48178 -116.31948 858.02400
5295.0000 -122.77881 -115.89772 6.88109 2.52609 -115.71000 908.99995
5300.0000 -122.32655 -115.80527 6.52127 2.46352 -116.57049 861.47779
5305.0000 -122.49532 -117.25898 5.23634 2.45241 -116.72340 849.41387
5310.0000 -122.24623 -116.57522 5.67101 2.43721 -116.93246 813.40258
5315.0000 -121.30784 -115.77784 5.53000 2.52303 -115.75222 890.06775
5320.0000 -120.98495 -114.82169 6.16326 2.56765 -115.13847 900.59410
5325.0000 -122.19616 -115.21579 6.98037 2.55025 -115.37786 889.41409
5330.0000 -122.00396 -116.82701 5.17695 2.47747 -116.37865 838.87346
5335.0000 -122.35672 -117.21238 5.14435 2.44170 -116.87059 807.59508
5340.0000 -122.56536 -116.90769 5.65766 2.43797 -116.92193 823.64113
5345.0000 -123.38350 -118.37599 5.00752 2.40722 -117.34486 836.10262
5350.0000 -123.64421 -118.10212 5.54209 2.33564 -118.32917 759.79781
5355.0000 -122.62060 -116.93625 5.68434 2.37510 -117.78652 786.56646
5360.0000 -122.32189 -117.32115 5.00074 2.43385 -116.97857 846.83484
5365.0000 -121.64292 -116.02704 5.61588 2.50785 -115.96088 895.54595
5370.0000 -121.26770 -114.89461 6.37309 2.53141 -115.63689 911.32277
5375.0000 -123.43082 -118.06512 5.36569 2.48565 -116.26628 853.16405
5380.0000 -122.49737 -117.07484 5.42253 2.38852 -117.60200 763.06760
5385.0000 -122.72637 -117.47196 5.25441 2.46729 -116.51865 863.57298
5390.0000 -121.83394 -116.85053 4.98341 2.44789 -116.78552 837.48297
5395.0000 -123.09383 -117.39934 5.69450 2.44792 -116.78516 854.33741
5400.0000 -122.33130 -117.53243 4.79887 2.39932 -117.45352 791.10973
5405.0000 -122.62276 -117.49330 5.12946 2.36303 -117.95255 773.49389
5410.0000 -122.96745 -117.27591 5.69154 2.42663 -117.07789 833.79238
5415.0000 -123.18486 -118.48939 4.69547 2.39996 -117.44466 793.38341
5420.0000 -122.31399 -117.54931 4.76467 2.37284 -117.81760 793.75170
5425.0000 -121.72533 -116.38789 5.33745 2.45328 -116.71140 858.93182
5430.0000 -120.69879 -113.89981 6.79898 2.59049 -114.82446 946.95924
5435.0000 -122.67217 -115.72050 6.95167 2.58908 -114.84386 978.25502
5440.0000 -120.47865 -115.18926 5.28938 2.57064 -115.09743 925.63434
5445.0000 -122.17531 -117.77541 4.39989 2.46038 -116.61379 820.39201
5450.0000 -122.80679 -117.36839 5.43840 2.41767 -117.20106 809.29544
5455.0000 -120.37624 -114.86281 5.51344 2.48785 -116.23590 841.70509
5460.0000 -121.67637 -116.25317 5.42320 2.54064 -115.50991 898.06094
5465.0000 -124.33028 -118.16454 6.16574 2.42179 -117.14439 816.47374
5470.0000 -122.33300 -117.34982 4.98318 2.39580 -117.50191 801.14997
5475.0000 -122.23843 -117.08815 5.15027 2.36693 -117.89893 782.30488
5480.0000 -121.48478 -115.52478 5.96000 2.50413 -116.01213 889.51443
5485.0000 -122.76362 -117.19441 5.56921 2.42021 -117.16617 795.26506
5490.0000 -122.52729 -117.79685 4.73043 2.39321 -117.53750 783.69687
5495.0000 -122.78398 -118.22450 4.55948 2.37498 -117.78815 766.10678
5500.0000 -123.51193 -118.41783 5.09409 2.35679 -118.03831 785.19159
MELTING PROCESS: loop number 23 T-loop= 847.00000000000000
main_MD> interactions number 23 at Temperature= 847.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.54819 -3.59603 -2.55890
force_rgl> df(natom) -2.74315 4.26290 1.03517
5505.0000 -123.08494 -117.52356 5.56138 2.35276 -118.09372 792.58523
5510.0000 -122.20941 -116.94274 5.26667 2.43700 -116.93522 865.98398
5515.0000 -122.40285 -116.50913 5.89372 2.44914 -116.76837 834.04019
5520.0000 -122.67518 -118.27894 4.39624 2.39314 -117.53851 762.26324
5525.0000 -123.72460 -118.10940 5.61520 2.36762 -117.88941 765.50145
5530.0000 -122.25766 -116.92985 5.32781 2.44468 -116.82966 849.00558
5535.0000 -121.39133 -115.80250 5.58883 2.47057 -116.47365 876.24246
5540.0000 -121.65991 -115.31589 6.34402 2.52738 -115.69227 905.63194
5545.0000 -120.66645 -115.00379 5.66266 2.55065 -115.37226 916.00956
5550.0000 -121.97468 -115.06672 6.90796 2.63579 -114.20147 1021.20126
5555.0000 -121.54745 -115.70113 5.84632 2.58258 -114.93318 914.23728
5560.0000 -121.69060 -116.55893 5.13167 2.47639 -116.39352 851.59830
5565.0000 -122.68737 -116.69118 5.99619 2.44084 -116.88251 836.03034
5570.0000 -122.00611 -117.11291 4.89321 2.43607 -116.94809 827.18381
5575.0000 -122.62278 -116.88994 5.73285 2.38113 -117.70357 780.59046
5580.0000 -122.80535 -116.42891 6.37645 2.42890 -117.04662 813.96721
5585.0000 -122.44073 -115.81361 6.62712 2.47395 -116.42711 861.07339
5590.0000 -122.24575 -115.85345 6.39230 2.51532 -115.85819 920.10627
5595.0000 -122.77416 -117.15415 5.62001 2.45318 -116.71283 848.89207
5600.0000 -121.55033 -116.01028 5.54005 2.47141 -116.46212 826.82720
5605.0000 -122.23321 -116.09738 6.13583 2.48740 -116.24215 843.60520
5610.0000 -123.36098 -118.42274 4.93824 2.48785 -116.23593 856.20602
5615.0000 -121.97810 -116.39758 5.58052 2.43732 -116.93091 817.10990
5620.0000 -121.56244 -116.63472 4.92773 2.53231 -115.62453 878.86926
5625.0000 -122.50323 -116.55503 5.94819 2.45533 -116.68320 817.90936
5630.0000 -121.72649 -115.98488 5.74162 2.49435 -116.14657 863.58517
5635.0000 -122.40346 -116.41106 5.99240 2.49622 -116.12080 879.72252
5640.0000 -120.77196 -114.86890 5.90306 2.55605 -115.29808 909.22540
5645.0000 -120.99012 -114.91330 6.07683 2.64157 -114.12199 982.99120
5650.0000 -122.28811 -115.74863 6.53949 2.51799 -115.82151 875.70310
5655.0000 -122.59223 -117.37713 5.21511 2.40918 -117.31791 794.73706
5660.0000 -122.35436 -117.55034 4.80402 2.42938 -117.04011 812.99849
5665.0000 -122.46967 -116.64191 5.82775 2.38419 -117.66160 793.90650
5670.0000 -122.54469 -117.41795 5.12674 2.45775 -116.64993 837.52050
5675.0000 -122.60792 -118.52725 4.08067 2.41754 -117.20296 801.49416
5680.0000 -121.93884 -116.18702 5.75183 2.45617 -116.67162 891.07017
5685.0000 -122.70642 -116.64544 6.06098 2.46780 -116.51167 843.83260
5690.0000 -123.27443 -118.17725 5.09717 2.39407 -117.52573 791.00475
5695.0000 -122.37278 -117.20967 5.16311 2.43140 -117.01226 843.12001
5700.0000 -121.56639 -116.09831 5.46807 2.47040 -116.47601 877.65719
5705.0000 -122.84456 -117.79354 5.05103 2.46504 -116.54970 866.89852
5710.0000 -122.30348 -116.61944 5.68404 2.44783 -116.78640 842.10556
5715.0000 -122.37664 -117.13503 5.24161 2.46167 -116.59606 824.90878
5720.0000 -121.67576 -116.37525 5.30050 2.42667 -117.07732 820.40204
5725.0000 -120.81862 -116.56578 4.25285 2.47990 -116.34525 865.53353
5730.0000 -123.36111 -117.21541 6.14570 2.43817 -116.91918 843.58518
5735.0000 -122.72811 -117.20269 5.52542 2.41544 -117.23183 801.11786
5740.0000 -121.95512 -116.39329 5.56183 2.43171 -117.00797 819.82448
5745.0000 -120.18201 -113.97526 6.20675 2.49275 -116.16863 869.28962
5750.0000 -121.15194 -114.90882 6.24311 2.61291 -114.51604 979.03319
MELTING PROCESS: loop number 24 T-loop= 872.00000000000000
main_MD> interactions number 24 at Temperature= 872.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -2.33545 0.72015 -1.92460
force_rgl> df(natom) 0.98292 -3.28061 -2.16612
5755.0000 -120.90654 -115.62301 5.28352 2.55612 -115.29709 919.29958
5760.0000 -119.53123 -114.69882 4.83241 2.62715 -114.32031 993.56769
5765.0000 -122.06888 -117.12324 4.94564 2.52139 -115.77469 867.07632
5770.0000 -123.02993 -117.69637 5.33356 2.42007 -117.16811 841.65518
5775.0000 -123.02901 -118.04205 4.98696 2.34376 -118.21753 781.07535
5780.0000 -121.77940 -116.37866 5.40074 2.44750 -116.79083 836.04856
5785.0000 -121.59834 -116.59591 5.00243 2.44253 -116.85924 793.69021
5790.0000 -122.23526 -115.99944 6.23582 2.45697 -116.66060 822.81861
5795.0000 -122.50851 -116.40849 6.10002 2.47024 -116.47815 822.90825
5800.0000 -121.78363 -115.70049 6.08313 2.51053 -115.92412 919.63611
5805.0000 -122.57971 -115.67863 6.90108 2.54111 -115.50354 923.79948
5810.0000 -120.80536 -115.23863 5.56674 2.54928 -115.39118 913.99562
5815.0000 -121.13995 -115.44688 5.69307 2.55842 -115.26541 902.03821
5820.0000 -121.68712 -115.43922 6.24790 2.52726 -115.69401 922.27426
5825.0000 -121.83204 -116.74307 5.08898 2.50270 -116.03180 898.62471
5830.0000 -122.81962 -116.83982 5.97980 2.40296 -117.40345 798.74848
5835.0000 -119.46577 -114.70062 4.76514 2.50898 -115.94532 848.39501
5840.0000 -122.38548 -117.05427 5.33121 2.51396 -115.87686 895.96092
5845.0000 -122.18052 -117.49471 4.68582 2.42990 -117.03289 810.70573
5850.0000 -120.94035 -115.25548 5.68487 2.45537 -116.68266 859.01383
5855.0000 -121.80027 -116.66280 5.13747 2.45772 -116.65028 871.60584
5860.0000 -122.53558 -116.68090 5.85468 2.44700 -116.79781 829.99852
5865.0000 -121.69206 -116.65408 5.03798 2.44022 -116.89094 817.17989
5870.0000 -122.42272 -117.00317 5.41955 2.45357 -116.70734 853.97194
5875.0000 -122.67578 -115.52953 7.14625 2.44711 -116.79629 833.58728
5880.0000 -121.14925 -115.04436 6.10489 2.60891 -114.57108 945.64101
5885.0000 -120.87024 -116.08362 4.78663 2.54481 -115.45263 897.33613
5890.0000 -122.35911 -117.18779 5.17132 2.49391 -116.15259 879.22709
5895.0000 -122.27682 -117.20341 5.07341 2.41964 -117.17403 817.45814
5900.0000 -122.64872 -117.50920 5.13952 2.42382 -117.11659 801.65084
5905.0000 -122.62191 -117.13984 5.48206 2.44474 -116.82884 837.59325
5910.0000 -122.39268 -116.63462 5.75806 2.50236 -116.03635 854.39914
5915.0000 -123.05980 -117.31991 5.73989 2.47013 -116.47965 861.31709
5920.0000 -122.32985 -116.50303 5.82683 2.46219 -116.58882 886.53592
5925.0000 -121.84863 -115.47352 6.37511 2.51234 -115.89918 883.38589
5930.0000 -122.05168 -116.43540 5.61628 2.46214 -116.58959 841.14268
5935.0000 -121.87129 -115.73692 6.13437 2.47752 -116.37806 875.98449
5940.0000 -122.11216 -116.54700 5.56515 2.48179 -116.31934 876.06238
5945.0000 -122.72885 -117.01684 5.71202 2.42670 -117.07693 809.24372
5950.0000 -121.76765 -115.40583 6.36182 2.48928 -116.21627 846.25362
5955.0000 -122.10333 -113.99721 8.10612 2.58299 -114.92762 922.55722
5960.0000 -121.49846 -115.29967 6.19878 2.63476 -114.21563 982.90112
5965.0000 -121.02864 -115.18897 5.83967 2.56878 -115.12294 909.74939
5970.0000 -122.04740 -115.93108 6.11632 2.52285 -115.75468 905.16242
5975.0000 -121.98373 -117.10709 4.87664 2.46189 -116.59303 844.74063
5980.0000 -122.38620 -117.09481 5.29139 2.45978 -116.62199 824.77252
5985.0000 -120.25085 -114.30689 5.94396 2.50695 -115.97324 882.25993
5990.0000 -120.34267 -114.73832 5.60435 2.58571 -114.89020 878.40242
5995.0000 -120.86495 -113.72059 7.14436 2.63604 -114.19802 988.22290
6000.0000 -120.54631 -115.22405 5.32227 2.58773 -114.86240 932.00402
MELTING PROCESS: loop number 25 T-loop= 897.00000000000000
main_MD> interactions number 25 at Temperature= 897.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.66055 -0.63577 2.45021
force_rgl> df(natom) 2.96325 -1.96925 0.74254
6005.0000 -121.62722 -114.04183 7.58538 2.60836 -114.57871 989.95906
6010.0000 -121.75672 -115.00629 6.75043 2.58563 -114.89120 960.95412
6015.0000 -122.40426 -116.26864 6.13562 2.54013 -115.51698 937.53098
6020.0000 -121.13372 -115.76946 5.36426 2.50143 -116.04918 894.18892
6025.0000 -121.94179 -116.13316 5.80863 2.49965 -116.07362 870.83538
6030.0000 -122.35409 -116.47820 5.87589 2.48391 -116.29011 881.71125
6035.0000 -122.27004 -116.59447 5.67556 2.40703 -117.34748 786.47443
6040.0000 -121.97497 -116.76535 5.20962 2.42225 -117.13817 814.49232
6045.0000 -121.39528 -116.41988 4.97541 2.45329 -116.71119 832.55127
6050.0000 -122.70650 -116.44641 6.26009 2.46928 -116.49132 846.36128
6055.0000 -121.96815 -116.53512 5.43303 2.47569 -116.40319 847.98517
6060.0000 -120.13531 -114.25220 5.88311 2.56411 -115.18720 911.58312
6065.0000 -121.42959 -115.23077 6.19882 2.60294 -114.65319 937.47357
6070.0000 -120.56472 -115.53735 5.02737 2.57275 -115.06842 945.38170
6075.0000 -120.73305 -114.19839 6.53465 2.60169 -114.67044 929.86400
6080.0000 -121.44616 -115.91057 5.53559 2.54896 -115.39553 883.34498
6085.0000 -121.88282 -116.21607 5.66676 2.54872 -115.39888 868.20456
6090.0000 -121.56329 -115.66795 5.89535 2.47780 -116.37419 874.93001
6095.0000 -122.37759 -116.96445 5.41314 2.41590 -117.22541 825.92974
6100.0000 -122.99207 -117.67044 5.32163 2.44084 -116.88246 851.02525
6105.0000 -122.91491 -117.59439 5.32052 2.42075 -117.15882 861.64060
6110.0000 -122.97692 -117.42146 5.55546 2.37374 -117.80530 785.35213
6115.0000 -121.10527 -115.40373 5.70154 2.43016 -117.02931 843.89620
6120.0000 -122.46050 -116.43253 6.02797 2.47899 -116.35784 859.99883
6125.0000 -121.78488 -114.84493 6.93995 2.51192 -115.90489 871.94528
6130.0000 -120.54052 -112.98990 7.55062 2.64690 -114.04867 979.86655
6135.0000 -122.35834 -114.65333 7.70500 2.58092 -114.95602 901.94581
6140.0000 -120.71204 -114.69917 6.01287 2.58860 -114.85041 914.21968
6145.0000 -122.00849 -116.04604 5.96244 2.54350 -115.47066 886.36014
6150.0000 -122.78138 -116.08415 6.69724 2.49221 -116.17603 882.41634
6155.0000 -120.53014 -115.29168 5.23847 2.51117 -115.91527 895.17081
6160.0000 -120.34562 -114.86459 5.48103 2.53063 -115.64758 884.21920
6165.0000 -120.36647 -114.94650 5.41998 2.52770 -115.68788 886.85028
6170.0000 -121.34143 -116.04927 5.29216 2.53725 -115.55657 908.12870
6175.0000 -120.87440 -116.09434 4.78005 2.53170 -115.63289 882.40178
6180.0000 -121.52774 -115.01766 6.51008 2.51147 -115.91115 907.52483
6185.0000 -122.09934 -116.50145 5.59789 2.50793 -115.95980 871.77730
6190.0000 -120.83203 -114.17734 6.65469 2.53330 -115.61097 929.73881
6195.0000 -121.96147 -115.79159 6.16987 2.59490 -114.76378 938.30637
6200.0000 -122.53240 -116.40630 6.12610 2.50849 -115.95211 900.37249
6205.0000 -121.16897 -115.54967 5.61930 2.49589 -116.12540 851.08070
6210.0000 -122.69258 -117.21603 5.47654 2.47898 -116.35794 869.29421
6215.0000 -122.25098 -116.71168 5.53931 2.45113 -116.74097 819.89123
6220.0000 -121.68650 -116.72948 4.95702 2.47113 -116.46594 853.13574
6225.0000 -120.68297 -115.22462 5.45835 2.46464 -116.55513 836.30931
6230.0000 -121.15597 -115.40252 5.75345 2.56503 -115.17455 951.34404
6235.0000 -120.27228 -114.22095 6.05133 2.58625 -114.88278 914.35732
6240.0000 -121.98572 -116.61592 5.36981 2.51704 -115.83460 880.77222
6245.0000 -121.62618 -115.96818 5.65800 2.46817 -116.50656 872.99039
6250.0000 -121.16403 -114.92042 6.24361 2.55593 -115.29963 920.52040
MELTING PROCESS: loop number 26 T-loop= 922.00000000000000
main_MD> interactions number 26 at Temperature= 922.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.76091 -5.27899 4.94665
force_rgl> df(natom) -3.21754 6.21347 0.27819
6255.0000 -121.51720 -115.55055 5.96665 2.54080 -115.50770 889.23444
6260.0000 -121.76452 -115.65219 6.11233 2.51995 -115.79455 875.91486
6265.0000 -122.22645 -116.28236 5.94409 2.46520 -116.54745 842.46116
6270.0000 -122.08979 -114.89835 7.19145 2.57094 -115.09331 925.19979
6275.0000 -120.80625 -113.45603 7.35021 2.63268 -114.24422 949.76205
6280.0000 -121.91595 -115.88093 6.03502 2.58141 -114.94934 917.31955
6285.0000 -121.73631 -115.92316 5.81315 2.51023 -115.92819 885.57435
6290.0000 -120.44185 -114.75460 5.68725 2.56958 -115.11201 905.49926
6295.0000 -120.37449 -114.27333 6.10116 2.56604 -115.16066 919.14157
6300.0000 -122.32344 -115.27782 7.04562 2.62870 -114.29900 987.63727
6305.0000 -121.53528 -116.19032 5.34496 2.47545 -116.40656 853.55143
6310.0000 -120.98726 -113.04401 7.94325 2.60426 -114.63511 962.82777
6315.0000 -121.81943 -116.21541 5.60401 2.58139 -114.94959 934.43602
6320.0000 -121.92037 -116.53532 5.38505 2.57160 -115.08414 958.42227
6325.0000 -121.36319 -115.72778 5.63541 2.49247 -116.17239 896.39113
6330.0000 -121.09023 -114.25500 6.83524 2.61797 -114.44650 988.73690
6335.0000 -120.79511 -115.60757 5.18753 2.60711 -114.59587 952.46002
6340.0000 -121.77358 -115.42404 6.34954 2.50863 -115.95017 870.31126
6345.0000 -121.50196 -114.64713 6.85484 2.53050 -115.64941 921.54354
6350.0000 -121.00498 -115.61031 5.39467 2.53713 -115.55822 891.06956
6355.0000 -122.01293 -115.45972 6.55320 2.59966 -114.69825 938.64933
6360.0000 -122.24731 -115.53728 6.71003 2.51467 -115.86715 881.73437
6365.0000 -121.80681 -114.50003 7.30677 2.58085 -114.95705 948.34560
6370.0000 -119.82325 -113.79438 6.02887 2.67249 -113.69674 992.73696
6375.0000 -122.34033 -116.03650 6.30383 2.61992 -114.41967 980.38720
6380.0000 -121.71797 -115.28815 6.42982 2.53536 -115.58261 895.73848
6385.0000 -120.72895 -113.30047 7.42848 2.59159 -114.80935 972.20315
6390.0000 -120.68450 -113.93482 6.74968 2.62351 -114.37025 970.74097
6395.0000 -122.19277 -116.32333 5.86944 2.59168 -114.80804 962.70586
6400.0000 -122.44155 -116.42599 6.01557 2.47882 -116.36018 875.12632
6405.0000 -121.31366 -116.06349 5.25017 2.48645 -116.25527 867.79750
6410.0000 -121.44002 -116.12735 5.31267 2.53319 -115.61248 901.82243
6415.0000 -120.76846 -115.39557 5.37289 2.60062 -114.68505 957.69878
6420.0000 -121.88011 -115.77088 6.10923 2.52173 -115.77000 884.60251
6425.0000 -121.28593 -115.84802 5.43791 2.56907 -115.11897 913.03477
6430.0000 -122.04983 -115.85706 6.19277 2.55223 -115.35057 907.55483
6435.0000 -120.82992 -114.85961 5.97031 2.53546 -115.58123 918.80989
6440.0000 -121.36259 -115.08321 6.27938 2.56838 -115.12846 943.25160
6445.0000 -122.62635 -116.73221 5.89414 2.48283 -116.30506 877.37153
6450.0000 -120.23453 -114.22876 6.00577 2.51074 -115.92116 889.98826
6455.0000 -121.00157 -113.91138 7.09018 2.57307 -115.06403 901.48135
6460.0000 -121.61352 -115.29421 6.31931 2.58040 -114.96316 963.00009
6465.0000 -120.15127 -114.25713 5.89413 2.64557 -114.06695 998.49329
6470.0000 -120.96146 -113.58458 7.37688 2.62390 -114.36492 992.18113
6475.0000 -121.51375 -114.93644 6.57731 2.59633 -114.74414 952.15602
6480.0000 -121.78923 -114.98423 6.80500 2.60314 -114.65038 947.99221
6485.0000 -121.44721 -115.03340 6.41381 2.60985 -114.55815 976.48398
6490.0000 -120.81968 -113.35712 7.46256 2.61045 -114.54987 951.69374
6495.0000 -122.28735 -115.81050 6.47684 2.58161 -114.94658 927.08932
6500.0000 -121.60160 -115.06409 6.53751 2.58509 -114.89867 936.94227
MELTING PROCESS: loop number 27 T-loop= 947.00000000000000
main_MD> interactions number 27 at Temperature= 947.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.85225 0.74814 -2.42231
force_rgl> df(natom) 0.60766 1.98674 0.06785
6505.0000 -120.66799 -115.13274 5.53525 2.54305 -115.47686 900.53657
6510.0000 -121.13677 -115.53745 5.59932 2.51913 -115.80577 877.35192
6515.0000 -120.34386 -114.19541 6.14845 2.55928 -115.25366 924.26129
6520.0000 -121.18702 -114.74279 6.44423 2.62610 -114.33466 966.20236
6525.0000 -120.71481 -115.21894 5.49587 2.53480 -115.59027 906.00162
6530.0000 -123.34263 -116.75941 6.58322 2.47769 -116.37573 856.11306
6535.0000 -122.24696 -115.29531 6.95165 2.50079 -116.05805 859.94470
6540.0000 -121.31663 -114.73221 6.58443 2.54105 -115.50438 901.22166
6545.0000 -122.52108 -117.10087 5.42020 2.47301 -116.44000 869.59580
6550.0000 -121.00010 -114.96929 6.03081 2.50909 -115.94381 882.35892
6555.0000 -122.17160 -115.20483 6.96678 2.53256 -115.62104 912.04977
6560.0000 -120.69602 -113.97384 6.72218 2.58409 -114.91240 945.53204
6565.0000 -122.14948 -115.63732 6.51216 2.56046 -115.23741 932.89655
6570.0000 -121.42309 -116.17755 5.24554 2.53284 -115.61720 905.67245
6575.0000 -122.04836 -116.57247 5.47589 2.47115 -116.46560 864.13553
6580.0000 -122.66850 -117.03787 5.63063 2.46567 -116.54094 872.67939
6585.0000 -123.29323 -116.41812 6.87512 2.46746 -116.51636 874.88068
6590.0000 -121.16997 -116.07926 5.09071 2.46454 -116.55659 846.02679
6595.0000 -121.63691 -117.41020 4.22670 2.45112 -116.74107 822.81428
6600.0000 -120.73033 -114.84641 5.88393 2.50093 -116.05606 882.95005
6605.0000 -121.65002 -116.69426 4.95576 2.53888 -115.53422 904.51465
6610.0000 -120.05294 -113.36566 6.68728 2.59849 -114.71445 941.00081
6615.0000 -119.92353 -113.61548 6.30804 2.68400 -113.53843 991.34492
6620.0000 -120.81342 -113.69887 7.11455 2.67684 -113.63684 1007.64894
6625.0000 -121.26357 -113.92362 7.33994 2.61266 -114.51953 943.88521
6630.0000 -120.32229 -114.45401 5.86828 2.64682 -114.04975 1014.02344
6635.0000 -119.64798 -113.03708 6.61089 2.62486 -114.35180 996.40286
6640.0000 -120.43624 -113.66961 6.76663 2.70951 -113.18753 1036.40284
6645.0000 -120.58386 -113.80398 6.77988 2.65527 -113.93353 985.41235
6650.0000 -121.46777 -115.22566 6.24210 2.65174 -113.98212 1001.74144
6655.0000 -120.90014 -115.02050 5.87964 2.58438 -114.90842 929.66556
6660.0000 -121.51648 -116.31336 5.20312 2.56215 -115.21418 904.77884
6665.0000 -120.83300 -115.07803 5.75497 2.54989 -115.38274 903.20902
6670.0000 -121.29092 -115.11051 6.18041 2.54828 -115.40496 929.86809
6675.0000 -121.33779 -114.98118 6.35661 2.62058 -114.41059 964.83590
6680.0000 -121.18761 -114.64029 6.54732 2.61235 -114.52374 971.37860
6685.0000 -120.99384 -114.87237 6.12147 2.53849 -115.53956 907.05955
6690.0000 -119.61070 -114.33799 5.27271 2.60800 -114.58366 948.90431
6695.0000 -120.07068 -113.00712 7.06355 2.67540 -113.65674 993.56082
6700.0000 -119.56113 -112.25321 7.30792 2.76748 -112.39036 1087.72511
6705.0000 -121.73511 -115.12649 6.60863 2.70209 -113.28959 1009.77305
6710.0000 -121.17836 -114.10003 7.07833 2.54395 -115.46449 940.88292
6715.0000 -119.86686 -114.67703 5.18983 2.63808 -114.16992 962.42117
6720.0000 -119.86023 -113.83710 6.02313 2.70134 -113.29989 997.40789
6725.0000 -121.42104 -115.31224 6.10880 2.65187 -113.98025 972.51781
6730.0000 -121.94683 -115.85524 6.09159 2.51613 -115.84704 891.68574
6735.0000 -121.57947 -115.94770 5.63177 2.50998 -115.93161 888.69812
6740.0000 -120.25003 -113.58643 6.66360 2.60519 -114.62230 936.92815
6745.0000 -122.29104 -117.05957 5.23147 2.56979 -115.10905 909.25808
6750.0000 -121.20765 -115.83909 5.36856 2.51777 -115.82443 889.84535
MELTING PROCESS: loop number 28 T-loop= 972.00000000000000
main_MD> interactions number 28 at Temperature= 972.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.37983 -6.78609 -1.57103
force_rgl> df(natom) -0.88576 -2.15897 0.35432
6755.0000 -119.32600 -113.50393 5.82207 2.59658 -114.74060 953.04260
6760.0000 -118.96925 -112.07736 6.89190 2.75699 -112.53469 1052.55820
6765.0000 -119.01228 -111.35014 7.66214 2.77547 -112.28053 1017.35168
6770.0000 -119.81615 -112.91757 6.89858 2.80973 -111.80937 1111.18645
6775.0000 -121.16926 -115.13697 6.03229 2.65619 -113.92085 996.10358
6780.0000 -122.13008 -115.02761 7.10247 2.57752 -115.00281 942.96799
6785.0000 -121.36359 -115.66446 5.69913 2.58707 -114.87151 984.84966
6790.0000 -122.46639 -114.89461 7.57178 2.55789 -115.27273 968.70409
6795.0000 -121.72247 -115.26966 6.45281 2.59773 -114.72489 979.01602
6800.0000 -121.04200 -113.97812 7.06388 2.57541 -115.03175 951.80655
6805.0000 -119.94829 -114.00624 5.94205 2.68777 -113.48662 1012.52947
6810.0000 -119.78672 -114.25553 5.53119 2.65419 -113.94842 998.47470
6815.0000 -118.42643 -111.54542 6.88101 2.73682 -112.81199 1022.09658
6820.0000 -119.49561 -111.97208 7.52353 2.82459 -111.60490 1112.61423
6825.0000 -119.69277 -113.45632 6.23645 2.76063 -112.48459 1032.22248
6830.0000 -119.83866 -113.52072 6.31794 2.64237 -114.11099 1009.30312
6835.0000 -121.90685 -114.76203 7.14482 2.63951 -114.15031 972.44689
6840.0000 -120.47494 -114.31546 6.15948 2.67861 -113.61261 1028.72930
6845.0000 -122.61549 -116.59364 6.02185 2.57356 -115.05721 939.06637
6850.0000 -120.45082 -113.78014 6.67068 2.53801 -115.54621 928.65195
6855.0000 -120.30282 -113.95905 6.34377 2.67991 -113.59462 1001.40982
6860.0000 -118.41852 -113.00291 5.41561 2.68248 -113.55926 1037.06397
6865.0000 -120.59253 -113.61021 6.98232 2.68086 -113.58162 1028.19153
6870.0000 -121.45123 -114.13208 7.31915 2.68171 -113.56988 1022.32640
6875.0000 -120.95483 -114.69906 6.25577 2.66620 -113.78327 1036.08169
6880.0000 -119.94972 -113.64285 6.30687 2.62596 -114.33662 944.35140
6885.0000 -121.59129 -114.61871 6.97258 2.66388 -113.81508 982.75494
6890.0000 -119.04759 -112.55091 6.49667 2.68466 -113.52938 1026.78463
6895.0000 -120.28746 -113.96058 6.32688 2.70120 -113.30194 1043.31778
6900.0000 -122.05102 -115.65670 6.39432 2.56375 -115.19218 903.33767
6905.0000 -120.15753 -114.53594 5.62158 2.54654 -115.42888 927.14959
6910.0000 -120.10312 -114.37981 5.72331 2.62397 -114.36398 951.77683
6915.0000 -121.63970 -115.69381 5.94590 2.56156 -115.22221 922.48943
6920.0000 -121.90758 -117.31483 4.59275 2.48042 -116.33817 849.37350
6925.0000 -120.81234 -114.64510 6.16724 2.50472 -116.00403 864.96228
6930.0000 -119.98768 -114.93907 5.04861 2.61222 -114.52555 968.54765
6935.0000 -120.34821 -115.30741 5.04079 2.56665 -115.15222 922.27316
6940.0000 -120.93914 -115.30136 5.63778 2.56422 -115.18575 913.35684
6945.0000 -119.89929 -113.96053 5.93877 2.59867 -114.71189 951.39402
6950.0000 -120.54526 -114.90557 5.63969 2.64434 -114.08384 1013.19560
6955.0000 -120.75739 -114.10071 6.65667 2.62678 -114.32538 985.43872
6960.0000 -120.01239 -112.92393 7.08846 2.67123 -113.71398 1012.11022
6965.0000 -119.43765 -113.11933 6.31833 2.75447 -112.56927 1066.00174
6970.0000 -119.95882 -111.82033 8.13849 2.77279 -112.31727 1097.95660
6975.0000 -120.55453 -114.88214 5.67238 2.63826 -114.16750 989.64890
6980.0000 -120.11138 -114.36964 5.74174 2.59316 -114.78769 935.03487
6985.0000 -120.58095 -114.27008 6.31086 2.66132 -113.85034 993.34495
6990.0000 -121.93261 -116.03912 5.89349 2.54724 -115.41927 875.89144
6995.0000 -122.33843 -116.45317 5.88526 2.49180 -116.18162 862.30846
7000.0000 -121.28120 -115.60496 5.67624 2.53576 -115.57711 903.61051
MELTING PROCESS: loop number 29 T-loop= 997.00000000000000
main_MD> interactions number 29 at Temperature= 997.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.61568 -0.80582 -0.42403
force_rgl> df(natom) 2.41792 1.52021 -1.87022
7005.0000 -120.17637 -114.60501 5.57137 2.64566 -114.06569 975.13605
7010.0000 -121.25946 -115.92070 5.33876 2.56917 -115.11767 916.63062
7015.0000 -121.44386 -113.80095 7.64291 2.63371 -114.23003 975.78480
7020.0000 -120.38476 -114.71374 5.67102 2.64817 -114.03121 977.01112
7025.0000 -120.63950 -114.68269 5.95681 2.58921 -114.84201 955.73544
7030.0000 -120.50936 -113.49534 7.01402 2.62620 -114.33335 973.26112
7035.0000 -119.64517 -112.09507 7.55010 2.78979 -112.08349 1084.60868
7040.0000 -119.64354 -113.77079 5.87275 2.76443 -112.43234 1064.15058
7045.0000 -121.50342 -115.89567 5.60775 2.57887 -114.98427 936.99592
7050.0000 -121.61645 -115.14600 6.47045 2.55432 -115.32182 935.50093
7055.0000 -120.25032 -114.32194 5.92838 2.57892 -114.98355 929.66828
7060.0000 -120.75051 -114.78485 5.96566 2.53595 -115.57452 869.60569
7065.0000 -119.97351 -112.95677 7.01674 2.64498 -114.07498 1008.21708
7070.0000 -120.26913 -112.98585 7.28327 2.73163 -112.88346 1049.47266
7075.0000 -121.95253 -114.27895 7.67358 2.65275 -113.96824 1006.47932
7080.0000 -120.88274 -115.39948 5.48326 2.55276 -115.34331 942.14653
7085.0000 -121.11630 -114.48085 6.63545 2.65446 -113.94462 986.83108
7090.0000 -121.75892 -116.08562 5.67331 2.57334 -115.06028 927.14518
7095.0000 -121.45885 -115.13270 6.32615 2.53283 -115.61732 916.48080
7100.0000 -120.44055 -114.86991 5.57065 2.51416 -115.87414 880.06649
7105.0000 -120.72791 -114.47312 6.25478 2.59063 -114.82251 964.95935
7110.0000 -121.16188 -114.88868 6.27320 2.59564 -114.75357 944.37415
7115.0000 -120.47993 -114.65056 5.82937 2.55873 -115.26125 907.74400
7120.0000 -121.47140 -113.85002 7.62138 2.62320 -114.37452 965.22478
7125.0000 -120.28148 -114.21563 6.06585 2.70853 -113.20105 1037.34604
7130.0000 -120.13603 -113.51840 6.61763 2.64434 -114.08390 992.32186
7135.0000 -121.74384 -116.18365 5.56019 2.57273 -115.06863 942.15979
7140.0000 -120.08423 -114.46253 5.62171 2.58580 -114.88893 894.66093
7145.0000 -119.28112 -113.61952 5.66160 2.64923 -114.01654 994.86888
7150.0000 -119.52427 -113.54624 5.97802 2.69822 -113.34283 1007.44089
7155.0000 -120.73907 -114.82152 5.91755 2.61540 -114.48179 952.27750
7160.0000 -119.68428 -113.43484 6.24944 2.69808 -113.34478 993.76876
7165.0000 -120.72605 -113.80644 6.91962 2.66956 -113.73698 957.10348
7170.0000 -120.44603 -113.18524 7.26080 2.71210 -113.15199 1044.37762
7175.0000 -121.20535 -115.14635 6.05901 2.64242 -114.11027 1005.48226
7180.0000 -120.77831 -114.45562 6.32268 2.58842 -114.85283 912.78280
7185.0000 -122.29086 -115.31012 6.98074 2.53691 -115.56130 911.54291
7190.0000 -120.94541 -114.25303 6.69238 2.59837 -114.71609 920.57594
7195.0000 -120.67098 -114.04811 6.62287 2.63683 -114.18712 967.68084
7200.0000 -121.94811 -115.87261 6.07550 2.54833 -115.40415 932.11760
7205.0000 -121.48507 -115.68300 5.80206 2.53453 -115.59404 906.28961
7210.0000 -121.34958 -115.13332 6.21625 2.60561 -114.61653 952.33239
7215.0000 -122.87618 -117.24083 5.63535 2.49230 -116.17476 881.73916
7220.0000 -120.80960 -113.70458 7.10502 2.57926 -114.97880 958.71871
7225.0000 -120.67148 -113.69167 6.97980 2.74071 -112.75846 1048.56133
7230.0000 -121.48871 -115.29752 6.19119 2.64768 -114.03793 996.40344
7235.0000 -119.81528 -113.96352 5.85176 2.60323 -114.64925 941.28944
7240.0000 -121.04851 -114.79312 6.25539 2.59459 -114.76797 952.68828
7245.0000 -120.31052 -112.84384 7.46668 2.62890 -114.29616 964.12139
7250.0000 -119.87910 -112.19891 7.68019 2.77100 -112.34192 1113.92935
MELTING PROCESS: loop number 30 T-loop= 1022.0000000000000
main_MD> interactions number 30 at Temperature= 1022.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.55922 -0.55389 -0.88703
force_rgl> df(natom) 0.50885 -0.24702 -0.19627
7255.0000 -120.74220 -113.33679 7.40541 2.73071 -112.89608 1068.37473
7260.0000 -119.70818 -112.32011 7.38807 2.73289 -112.86608 1033.73287
7265.0000 -121.16793 -114.74951 6.41842 2.71301 -113.13951 1070.40963
7270.0000 -121.79106 -115.38607 6.40499 2.53299 -115.61522 889.60724
7275.0000 -121.36409 -114.83418 6.52990 2.55590 -115.30008 933.93120
7280.0000 -121.14898 -114.68950 6.45948 2.60294 -114.65316 959.14668
7285.0000 -120.75950 -113.37922 7.38027 2.63578 -114.20157 990.34698
7290.0000 -118.57305 -112.62639 5.94666 2.72559 -112.96641 1036.60732
7295.0000 -121.42728 -113.84694 7.58034 2.72685 -112.94914 1072.17122
7300.0000 -119.93439 -113.65528 6.27912 2.68210 -113.56453 1021.88412
7305.0000 -119.83349 -113.95770 5.87579 2.62993 -114.28207 974.52055
7310.0000 -120.62004 -114.52590 6.09415 2.64249 -114.10931 994.60882
7315.0000 -121.14195 -113.53286 7.60909 2.76542 -112.41876 1079.53206
7320.0000 -120.23172 -112.01927 8.21245 2.78100 -112.20443 1094.37405
7325.0000 -120.64714 -113.73746 6.90968 2.70724 -113.21886 1025.68079
7330.0000 -118.47050 -112.34226 6.12824 2.68528 -113.52087 1026.48844
7335.0000 -119.23719 -112.91912 6.31808 2.70695 -113.22287 1022.09103
7340.0000 -120.73901 -113.64966 7.08935 2.76886 -112.37135 1062.82373
7345.0000 -122.17860 -115.78943 6.38916 2.64167 -114.12051 1008.99720
7350.0000 -121.27920 -115.14986 6.12934 2.55801 -115.27109 948.22871
7355.0000 -120.02730 -112.86659 7.16071 2.63390 -114.22741 999.80736
7360.0000 -121.38266 -114.74102 6.64164 2.69832 -113.34153 1007.82647
7365.0000 -119.88199 -112.85961 7.02239 2.68542 -113.51885 1021.54963
7370.0000 -120.12397 -114.19052 5.93345 2.70318 -113.27472 1036.34422
7375.0000 -120.19647 -112.53592 7.66055 2.70021 -113.31553 1028.15238
7380.0000 -120.24525 -113.25106 6.99418 2.70851 -113.20139 1069.67553
7385.0000 -121.03274 -113.99633 7.03641 2.60430 -114.63454 969.27758
7390.0000 -120.22377 -114.37112 5.85265 2.61142 -114.53652 947.35052
7395.0000 -120.04560 -113.30805 6.73755 2.71951 -113.05007 1021.15357
7400.0000 -120.92392 -114.12881 6.79512 2.66966 -113.73557 1004.90412
7405.0000 -120.63704 -113.46151 7.17553 2.59653 -114.74135 939.34653
7410.0000 -119.89515 -114.16046 5.73469 2.68574 -113.51450 1014.43861
7415.0000 -119.77497 -113.79109 5.98388 2.66725 -113.76882 998.58737
7420.0000 -120.02711 -113.21627 6.81084 2.73615 -112.82116 1049.00265
7425.0000 -120.81946 -113.25422 7.56524 2.74556 -112.69185 1078.47688
7430.0000 -121.31602 -115.19062 6.12540 2.58293 -114.92833 964.55933
7435.0000 -122.05357 -116.24547 5.80810 2.57671 -115.01390 901.13450
7440.0000 -121.61484 -115.82023 5.79460 2.51959 -115.79940 912.64209
7445.0000 -120.43251 -114.02914 6.40337 2.56434 -115.18406 902.62177
7450.0000 -121.31117 -115.00288 6.30829 2.57957 -114.97459 936.43689
7455.0000 -120.30306 -114.75420 5.54886 2.58785 -114.86073 932.60778
7460.0000 -120.60457 -114.51767 6.08689 2.56599 -115.16132 928.45906
7465.0000 -120.73482 -114.11854 6.61628 2.54284 -115.47971 928.06163
7470.0000 -121.33838 -115.32803 6.01035 2.57163 -115.08382 952.52810
7475.0000 -120.55445 -114.12746 6.42699 2.55202 -115.35344 903.42489
7480.0000 -117.95117 -111.22742 6.72374 2.76093 -112.48045 1091.04306
7485.0000 -119.09400 -113.10058 5.99342 2.77627 -112.26948 1051.66844
7490.0000 -118.23121 -111.61469 6.61652 2.80638 -111.85541 1060.00785
7495.0000 -119.37085 -112.18850 7.18235 2.79223 -112.05000 1036.27120
7500.0000 -120.28362 -113.82533 6.45830 2.70248 -113.28424 1041.74910
MELTING PROCESS: loop number 31 T-loop= 1047.0000000000000
main_MD> interactions number 31 at Temperature= 1047.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -2.07399 -2.33206 -0.55916
force_rgl> df(natom) 2.57600 -2.08383 -1.20757
7505.0000 -120.94713 -113.52224 7.42489 2.63665 -114.18955 993.70321
7510.0000 -120.20198 -113.23777 6.96421 2.68198 -113.56627 1031.17982
7515.0000 -119.38294 -112.17170 7.21124 2.71450 -113.11901 994.96676
7520.0000 -120.24028 -111.80195 8.43833 2.76974 -112.35926 1086.74850
7525.0000 -119.07558 -111.94525 7.13033 2.78035 -112.21331 1091.28467
7530.0000 -119.21436 -113.75690 5.45746 2.68133 -113.57512 980.71406
7535.0000 -117.53677 -111.83198 5.70479 2.71703 -113.08416 1003.82222
7540.0000 -120.46325 -113.67564 6.78761 2.73883 -112.78433 1063.58567
7545.0000 -120.72886 -113.61274 7.11612 2.65131 -113.98796 998.55637
7550.0000 -119.56346 -113.11981 6.44365 2.73647 -112.81685 1040.16776
7555.0000 -119.71600 -111.21700 8.49900 2.76193 -112.46675 1082.22616
7560.0000 -120.27846 -112.97848 7.29998 2.76748 -112.39040 1118.49433
7565.0000 -119.05626 -112.07035 6.98591 2.72152 -113.02248 1059.57512
7570.0000 -117.77055 -112.06627 5.70428 2.76441 -112.43260 1081.25778
7575.0000 -118.27512 -112.99507 5.28005 2.73259 -112.87014 1052.13026
7580.0000 -119.45584 -111.89672 7.55912 2.67908 -113.60607 1020.78452
7585.0000 -119.35061 -111.82051 7.53010 2.70139 -113.29924 1051.37147
7590.0000 -119.55248 -111.77579 7.77668 2.78545 -112.14328 1082.17393
7595.0000 -118.55417 -111.22782 7.32635 2.80041 -111.93754 1090.87829
7600.0000 -119.82160 -113.47552 6.34609 2.79706 -111.98360 1092.52335
7605.0000 -120.40807 -113.72070 6.68737 2.59794 -114.72197 980.50489
7610.0000 -120.05574 -114.14728 5.90847 2.67252 -113.69623 970.07249
7615.0000 -120.47133 -114.24913 6.22221 2.62902 -114.29449 967.33924
7620.0000 -120.79788 -113.91301 6.88487 2.61326 -114.51132 963.31331
7625.0000 -121.16377 -115.44179 5.72198 2.60104 -114.67932 971.73947
7630.0000 -119.42756 -113.05239 6.37517 2.64390 -114.08984 974.43801
7635.0000 -121.23210 -115.23172 6.00038 2.59108 -114.81637 956.00537
7640.0000 -120.93907 -114.07893 6.86015 2.61275 -114.51829 979.31830
7645.0000 -119.64062 -112.41231 7.22831 2.71482 -113.11464 1011.98854
7650.0000 -119.11942 -111.72380 7.39563 2.87114 -110.96482 1178.75393
7655.0000 -118.44648 -110.25738 8.18910 2.83399 -111.47575 1097.28308
7660.0000 -118.06717 -111.15422 6.91295 2.87440 -110.91994 1117.68302
7665.0000 -118.32199 -111.44945 6.87254 2.83974 -111.39668 1134.41293
7670.0000 -118.42622 -111.13106 7.29516 2.85424 -111.19723 1137.17948
7675.0000 -119.84364 -112.88853 6.95511 2.77824 -112.24236 1096.20642
7680.0000 -119.04586 -111.93810 7.10776 2.77595 -112.27385 1064.25679
7685.0000 -120.19539 -112.86708 7.32832 2.73950 -112.77512 1057.71214
7690.0000 -119.81547 -113.15777 6.65770 2.67927 -113.60343 975.31238
7695.0000 -119.75038 -112.04305 7.70733 2.68781 -113.48607 1055.23249
7700.0000 -119.80407 -113.32196 6.48211 2.75295 -112.59023 1093.46674
7705.0000 -120.96928 -115.01540 5.95389 2.63041 -114.27546 979.99722
7710.0000 -119.72402 -112.41475 7.30927 2.68644 -113.50491 1047.05196
7715.0000 -121.43415 -113.16171 8.27244 2.74102 -112.75429 1035.67481
7720.0000 -119.76443 -111.69676 8.06766 2.66561 -113.79137 982.27337
7725.0000 -120.57255 -114.21667 6.35587 2.75329 -112.58554 1049.34382
7730.0000 -119.21449 -110.90028 8.31421 2.72777 -112.93649 1010.29689
7735.0000 -119.10028 -112.24430 6.85597 2.80230 -111.91150 1127.94422
7740.0000 -119.45893 -112.94654 6.51239 2.80096 -111.92998 1066.95183
7745.0000 -120.65557 -112.94279 7.71278 2.68375 -113.54192 1018.97636
7750.0000 -119.12962 -112.21324 6.91638 2.78564 -112.14062 1086.77998
MELTING PROCESS: loop number 32 T-loop= 1072.0000000000000
main_MD> interactions number 32 at Temperature= 1072.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.28264 -0.63296 0.78708
force_rgl> df(natom) 0.18172 1.54921 2.38081
7755.0000 -119.59013 -111.73549 7.85464 2.78254 -112.18322 1108.94947
7760.0000 -119.26293 -112.39241 6.87052 2.77689 -112.26099 1065.54187
7765.0000 -120.56530 -112.28845 8.27685 2.78506 -112.14854 1093.05860
7770.0000 -119.35757 -111.79932 7.55825 2.87557 -110.90391 1165.97546
7775.0000 -119.86052 -111.52822 8.33231 2.81339 -111.75903 1097.10265
7780.0000 -119.16623 -113.17153 5.99470 2.74501 -112.69940 1048.88978
7785.0000 -119.12556 -111.94492 7.18065 2.79129 -112.06292 1111.62359
7790.0000 -120.02198 -113.44004 6.58194 2.69452 -113.39380 1023.76404
7795.0000 -119.84786 -110.40388 9.44398 2.81076 -111.79511 1097.74584
7800.0000 -120.03599 -112.08008 7.95591 2.85243 -111.22204 1137.24620
7805.0000 -119.68643 -113.67515 6.01128 2.67352 -113.68260 1024.13042
7810.0000 -118.78040 -112.25595 6.52444 2.71776 -113.07409 1058.34428
7815.0000 -118.27793 -110.42716 7.85078 2.88688 -110.74828 1174.31221
7820.0000 -119.97184 -113.05874 6.91310 2.76953 -112.36219 1108.47328
7825.0000 -119.02267 -112.59598 6.42669 2.72105 -113.02894 1050.67277
7830.0000 -119.94027 -113.17971 6.76056 2.78592 -112.13677 1083.35114
7835.0000 -118.72840 -112.53415 6.19424 2.70820 -113.20558 1036.34052
7840.0000 -120.63566 -113.41853 7.21713 2.77114 -112.34004 1055.27006
7845.0000 -118.94101 -111.72286 7.21814 2.82077 -111.65748 1106.04248
7850.0000 -118.30727 -109.64194 8.66533 2.90577 -110.48858 1173.24734
7855.0000 -119.68852 -111.05123 8.63730 2.85619 -111.17033 1153.94969
7860.0000 -117.69366 -109.35167 8.34200 2.96078 -109.73206 1216.70631
7865.0000 -117.98625 -110.93307 7.05318 2.92151 -110.27212 1239.41768
7870.0000 -119.57399 -113.66724 5.90675 2.76908 -112.36834 1085.24780
7875.0000 -118.60748 -112.05506 6.55242 2.71203 -113.15292 1030.24870
7880.0000 -120.14781 -111.54093 8.60688 2.77698 -112.25971 1090.78738
7885.0000 -119.16752 -112.24705 6.92047 2.73620 -112.82047 1056.23555
7890.0000 -121.19863 -112.94580 8.25283 2.75856 -112.51303 1107.34541
7895.0000 -119.35817 -112.39915 6.95902 2.79088 -112.06854 1063.91006
7900.0000 -122.26330 -115.70200 6.56130 2.64083 -114.13212 1015.46962
7905.0000 -120.65068 -114.59746 6.05322 2.57837 -114.99106 927.61996
7910.0000 -119.69456 -112.51795 7.17661 2.65987 -113.87024 987.00278
7915.0000 -119.94877 -112.42378 7.52499 2.71869 -113.06134 1059.61594
7920.0000 -117.07686 -111.63911 5.43776 2.78773 -112.11193 1109.96369
7925.0000 -120.90987 -114.10278 6.80709 2.79185 -112.05523 1103.29219
7930.0000 -119.62311 -112.90359 6.71953 2.67031 -113.72674 998.11889
7935.0000 -120.71217 -114.89675 5.81543 2.62194 -114.39192 948.67037
7940.0000 -120.45723 -114.13277 6.32445 2.65108 -113.99113 983.62096
7945.0000 -118.77206 -109.88446 8.88759 2.76592 -112.41187 1080.30542
7950.0000 -117.11580 -109.20700 7.90881 2.94022 -110.01477 1202.44146
7955.0000 -119.09279 -111.73067 7.36212 2.87224 -110.94970 1141.44309
7960.0000 -118.63199 -111.35408 7.27791 2.89328 -110.66034 1150.07335
7965.0000 -119.70111 -111.52318 8.17794 2.79796 -111.97114 1128.25541
7970.0000 -119.94736 -114.49110 5.45627 2.74756 -112.66433 1044.93144
7975.0000 -120.26641 -113.41593 6.85047 2.71077 -113.17024 1037.74581
7980.0000 -119.29309 -112.39394 6.89915 2.71326 -113.13604 1011.78744
7985.0000 -119.72573 -114.02152 5.70421 2.70909 -113.19337 1042.34230
7990.0000 -119.11175 -112.33298 6.77877 2.73827 -112.79213 1047.20786
7995.0000 -120.86447 -113.53958 7.32489 2.76519 -112.42192 1079.78181
8000.0000 -119.44495 -112.67262 6.77233 2.75589 -112.54980 1049.05428
MELTING PROCESS: loop number 33 T-loop= 1097.0000000000000
main_MD> interactions number 33 at Temperature= 1097.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.64329 0.60835 -3.78740
force_rgl> df(natom) 0.73874 -0.04153 -0.49059
8005.0000 -117.65879 -111.39599 6.26280 2.82479 -111.60227 1107.02605
8010.0000 -119.45573 -112.71754 6.73820 2.73419 -112.84819 1031.78652
8015.0000 -119.65656 -111.90658 7.74997 2.76665 -112.40181 1091.60640
8020.0000 -117.70987 -110.41537 7.29449 2.91224 -110.39954 1194.07467
8025.0000 -119.53833 -111.84348 7.69485 2.85673 -111.16299 1145.66591
8030.0000 -119.02437 -112.47246 6.55192 2.80760 -111.83865 1074.58257
8035.0000 -118.47710 -112.18817 6.28893 2.81834 -111.69096 1117.22225
8040.0000 -119.41416 -113.56314 5.85101 2.75734 -112.52975 1025.14591
8045.0000 -119.18348 -112.12422 7.05926 2.70386 -113.26525 1020.70844
8050.0000 -117.72409 -110.94207 6.78202 2.88503 -110.77382 1178.41447
8055.0000 -119.17736 -112.28852 6.88884 2.83879 -111.40967 1122.78287
8060.0000 -119.64446 -111.79706 7.84740 2.77219 -112.32559 1098.62234
8065.0000 -121.04852 -114.20586 6.84265 2.81194 -111.77888 1129.59241
8070.0000 -118.53875 -111.21132 7.32744 2.73779 -112.79862 1039.14970
8075.0000 -117.71920 -109.67436 8.04485 2.90470 -110.50321 1205.76849
8080.0000 -119.99555 -111.77795 8.21759 2.83156 -111.50908 1125.30941
8085.0000 -121.84926 -114.65747 7.19178 2.70159 -113.29651 1073.03176
8090.0000 -120.02871 -114.24997 5.77874 2.63194 -114.25439 994.79905
8095.0000 -118.12785 -110.93148 7.19637 2.79094 -112.06769 1072.97471
8100.0000 -119.85900 -114.24765 5.61135 2.76900 -112.36949 1061.13027
8105.0000 -120.66656 -114.37227 6.29429 2.67169 -113.70766 979.53892
8110.0000 -119.60511 -112.34492 7.26019 2.75977 -112.49638 1055.96747
8115.0000 -118.12551 -111.01239 7.11312 2.77456 -112.29304 1107.53204
8120.0000 -120.21548 -110.87071 9.34478 2.85417 -111.19820 1165.69611
8125.0000 -118.43752 -110.65424 7.78328 2.82634 -111.58095 1118.22956
8130.0000 -118.37371 -110.90341 7.47029 2.89562 -110.62810 1180.81621
8135.0000 -119.44608 -112.08690 7.35918 2.87854 -110.86304 1148.11499
8140.0000 -117.60791 -110.48268 7.12523 2.89496 -110.63725 1194.53789
8145.0000 -117.92542 -111.99109 5.93433 2.83048 -111.52394 1125.27158
8150.0000 -117.49147 -110.73968 6.75179 2.79960 -111.94869 1086.25922
8155.0000 -118.57413 -111.17062 7.40351 2.90097 -110.55452 1167.27877
8160.0000 -118.38678 -111.25384 7.13294 2.82285 -111.62883 1134.85501
8165.0000 -118.48500 -110.77133 7.71367 2.84210 -111.36411 1147.80840
8170.0000 -118.89281 -112.53214 6.36067 2.80959 -111.81126 1088.07681
8175.0000 -120.16877 -111.74272 8.42605 2.79323 -112.03630 1109.39769
8180.0000 -119.17777 -110.60420 8.57357 2.91206 -110.40207 1210.87206
8185.0000 -115.69193 -108.84571 6.84622 2.95380 -109.82805 1233.04252
8190.0000 -118.96571 -110.27258 8.69313 2.95083 -109.86884 1206.16336
8195.0000 -118.94249 -111.44267 7.49982 2.86031 -111.11378 1130.22698
8200.0000 -119.36465 -112.18220 7.18244 2.89615 -110.62087 1185.81733
8205.0000 -119.21082 -112.07106 7.13977 2.83466 -111.46645 1111.77383
8210.0000 -118.58129 -112.48834 6.09295 2.75935 -112.50222 1044.31760
8215.0000 -119.10450 -111.04848 8.05602 2.79791 -111.97184 1045.53863
8220.0000 -118.92641 -111.78863 7.13778 2.82668 -111.57622 1121.64628
8225.0000 -120.10381 -112.32606 7.77776 2.77436 -112.29578 1046.95948
8230.0000 -120.47678 -112.69249 7.78428 2.70724 -113.21886 1030.73028
8235.0000 -120.13352 -112.26514 7.86838 2.82438 -111.60779 1117.03911
8240.0000 -119.06049 -112.60734 6.45314 2.75822 -112.51770 1056.22313
8245.0000 -118.69940 -111.26438 7.43502 2.75992 -112.49433 1045.70195
8250.0000 -117.86730 -111.30670 6.56059 2.78498 -112.14972 1110.61232
MELTING PROCESS: loop number 34 T-loop= 1122.0000000000000
main_MD> interactions number 34 at Temperature= 1122.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.94546 -2.65263 10.05531
force_rgl> df(natom) -2.67502 -1.55981 -3.50518
8255.0000 -119.47915 -112.49651 6.98264 2.76056 -112.48554 1100.36136
8260.0000 -118.38942 -109.23260 9.15681 2.83361 -111.48086 1158.69348
8265.0000 -120.17768 -111.41117 8.76651 2.91827 -110.31666 1171.63458
8270.0000 -118.35966 -112.73995 5.61971 2.81947 -111.67537 1134.71989
8275.0000 -119.10075 -111.70988 7.39087 2.70047 -113.31187 1048.23899
8280.0000 -119.69372 -112.14510 7.54862 2.80541 -111.86872 1146.77901
8285.0000 -116.82550 -110.13113 6.69437 2.90904 -110.44353 1157.77359
8290.0000 -116.11151 -108.96264 7.14887 2.97158 -109.58353 1230.55303
8295.0000 -116.78397 -107.32621 9.45776 3.01889 -108.93290 1251.55997
8300.0000 -116.62571 -109.88437 6.74134 2.98744 -109.36532 1270.91545
8305.0000 -116.63218 -109.15123 7.48095 2.96807 -109.63181 1216.32030
8310.0000 -120.08715 -109.75795 10.32920 2.98643 -109.37927 1253.74351
8315.0000 -117.69295 -109.77351 7.91944 2.98982 -109.33267 1263.79975
8320.0000 -120.43865 -110.66620 9.77245 2.82145 -111.64816 1113.62083
8325.0000 -120.09284 -111.96036 8.13247 2.81146 -111.78555 1100.81484
8330.0000 -117.34201 -110.13885 7.20316 2.89467 -110.64114 1182.00481
8335.0000 -117.77240 -110.08417 7.68823 3.01077 -109.04453 1241.34212
8340.0000 -118.55768 -111.75634 6.80134 2.87356 -110.93145 1179.54380
8345.0000 -118.98064 -110.37320 8.60744 2.85534 -111.18205 1128.04476
8350.0000 -120.04827 -111.53400 8.51427 2.85900 -111.13169 1151.71644
8355.0000 -118.87747 -110.65207 8.22540 2.88396 -110.78853 1195.50368
8360.0000 -117.76048 -110.40409 7.35639 2.91304 -110.38860 1215.79297
8365.0000 -118.82275 -110.27625 8.54650 2.96127 -109.72533 1172.64140
8370.0000 -117.02437 -109.79182 7.23255 2.92742 -110.19081 1195.69963
8375.0000 -116.68871 -109.96319 6.72553 2.96181 -109.71790 1206.62405
8380.0000 -119.56702 -111.60625 7.96077 2.88011 -110.84138 1148.49624
8385.0000 -117.62074 -111.59935 6.02139 2.84762 -111.28828 1145.34707
8390.0000 -117.65966 -109.18006 8.47960 2.95830 -109.76615 1200.94660
8395.0000 -116.73625 -108.81513 7.92111 2.96780 -109.63545 1137.13572
8400.0000 -119.12565 -111.42081 7.70483 2.85500 -111.18675 1153.71142
8405.0000 -117.91187 -111.26160 6.65027 2.85795 -111.14623 1163.16170
8410.0000 -117.25870 -110.01212 7.24658 2.86511 -111.04775 1131.32792
8415.0000 -119.36967 -111.28120 8.08847 2.85680 -111.16198 1157.41701
8420.0000 -118.00347 -110.04870 7.95477 2.85425 -111.19705 1105.92400
8425.0000 -118.92239 -111.65987 7.26252 2.83248 -111.49647 1065.67083
8430.0000 -119.76993 -112.00945 7.76048 2.80742 -111.84114 1050.76197
8435.0000 -116.34312 -108.12307 8.22005 2.89993 -110.56885 1168.94823
8440.0000 -117.15593 -109.56682 7.58911 3.07708 -108.13260 1323.15195
8445.0000 -116.97007 -109.25686 7.71321 2.99143 -109.31044 1238.38729
8450.0000 -118.00901 -111.05985 6.94916 2.94108 -110.00296 1187.14657
8455.0000 -118.42339 -111.76481 6.65858 2.83909 -111.40553 1140.69899
8460.0000 -120.52005 -111.67703 8.84302 2.79728 -111.98052 1100.31239
8465.0000 -116.90034 -110.64796 6.25238 2.85948 -111.12509 1159.17650
8470.0000 -119.53564 -112.83122 6.70441 2.76514 -112.42248 1049.01828
8475.0000 -118.49645 -111.78050 6.71594 2.68926 -113.46606 989.48232
8480.0000 -118.79860 -110.97295 7.82566 2.85035 -111.25069 1149.54105
8485.0000 -119.25007 -112.03471 7.21536 2.85445 -111.19438 1165.60954
8490.0000 -117.40240 -109.86478 7.53763 2.83588 -111.44970 1129.59171
8495.0000 -118.24293 -111.33585 6.90707 2.89543 -110.63075 1115.86519
8500.0000 -119.79201 -112.31915 7.47286 2.80503 -111.87395 1117.27830
MELTING PROCESS: loop number 35 T-loop= 1147.0000000000000
main_MD> interactions number 35 at Temperature= 1147.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 4.38973 1.36673 -2.18153
force_rgl> df(natom) -0.30527 4.93424 -0.54155
8505.0000 -121.70894 -115.64571 6.06323 2.72478 -112.97760 1092.88680
8510.0000 -120.49475 -113.50404 6.99071 2.65332 -113.96041 1001.56352
8515.0000 -120.15973 -111.33791 8.82182 2.75432 -112.57130 1047.39794
8520.0000 -120.76638 -111.86391 8.90247 2.81211 -111.77663 1112.11699
8525.0000 -118.54362 -111.73585 6.80777 2.74624 -112.68245 1060.14248
8530.0000 -117.76346 -110.18086 7.58260 2.82024 -111.66485 1112.98893
8535.0000 -120.52220 -114.10686 6.41534 2.85067 -111.24634 1179.77242
8540.0000 -119.48146 -112.77107 6.71038 2.73967 -112.77278 1058.98030
8545.0000 -119.50511 -112.83874 6.66637 2.70363 -113.26850 1043.81394
8550.0000 -119.21111 -111.79674 7.41438 2.83660 -111.43985 1161.45145
8555.0000 -118.94569 -112.61348 6.33221 2.75639 -112.54289 1066.24253
8560.0000 -119.17299 -111.48586 7.68713 2.76815 -112.38111 1097.63301
8565.0000 -118.47727 -110.05834 8.41894 2.94972 -109.88408 1204.75075
8570.0000 -118.53304 -108.13018 10.40285 3.09525 -107.88267 1290.97394
8575.0000 -117.59782 -110.05359 7.54424 3.04228 -108.61116 1321.10054
8580.0000 -118.69229 -109.86414 8.82814 2.89823 -110.59221 1192.90920
8585.0000 -118.90997 -111.38699 7.52298 2.90084 -110.55629 1180.27786
8590.0000 -118.96240 -111.15453 7.80787 2.83991 -111.39424 1097.38388
8595.0000 -116.85090 -111.42194 5.42896 2.78809 -112.10688 1054.66464
8600.0000 -119.51013 -111.34187 8.16826 2.82190 -111.64202 1061.51933
8605.0000 -117.46478 -109.55067 7.91411 2.91057 -110.42253 1191.05035
8610.0000 -115.93750 -109.66766 6.26984 2.94467 -109.95362 1206.37327
8615.0000 -118.96721 -110.47528 8.49193 2.90891 -110.44536 1215.41144
8620.0000 -118.83441 -110.78913 8.04528 2.94045 -110.01165 1187.52792
8625.0000 -118.85929 -111.23192 7.62738 2.91198 -110.40309 1174.35023
8630.0000 -117.60677 -110.08071 7.52606 2.89327 -110.66045 1155.96879
8635.0000 -119.48992 -110.81597 8.67395 2.83294 -111.49019 1103.47251
8640.0000 -118.94272 -111.96715 6.97557 2.84502 -111.32403 1138.89831
8645.0000 -120.33737 -113.74088 6.59650 2.71684 -113.08683 1068.74023
8650.0000 -118.69601 -111.73558 6.96043 2.76022 -112.49016 1060.66644
8655.0000 -119.07104 -111.63480 7.43623 2.84666 -111.30147 1126.90548
8660.0000 -119.61089 -110.54279 9.06810 2.87328 -110.93532 1186.44322
8665.0000 -118.23532 -109.94518 8.29014 2.94881 -109.89659 1228.62119
8670.0000 -117.57548 -109.36454 8.21095 2.97437 -109.54514 1196.83117
8675.0000 -118.22844 -110.56197 7.66647 2.92671 -110.20057 1179.19525
8680.0000 -118.86892 -111.43791 7.43101 2.87237 -110.94790 1130.68989
8685.0000 -118.55591 -110.36161 8.19430 2.85972 -111.12190 1165.62882
8690.0000 -117.61515 -109.18862 8.42653 2.98683 -109.37382 1269.48817
8695.0000 -120.23996 -111.59479 8.64517 2.92058 -110.28488 1202.31824
8700.0000 -118.75334 -111.39001 7.36333 2.81755 -111.70182 1112.43067
8705.0000 -117.41843 -108.69621 8.72222 2.98047 -109.46118 1270.61536
8710.0000 -116.82625 -108.97356 7.85269 3.02840 -108.80210 1288.73851
8715.0000 -117.79794 -110.55806 7.23988 3.00643 -109.10423 1205.80560
8720.0000 -119.12545 -110.64866 8.47679 2.90757 -110.46379 1205.39311
8725.0000 -118.03058 -110.65684 7.37374 2.90014 -110.56601 1149.24355
8730.0000 -117.62968 -108.86208 8.76760 2.85845 -111.13935 1135.23171
8735.0000 -118.97830 -110.29552 8.68278 2.99333 -109.28435 1256.10738
8740.0000 -120.39872 -112.94488 7.45384 2.84748 -111.29016 1178.00382
8745.0000 -119.16958 -113.06044 6.10914 2.73884 -112.78428 1073.36090
8750.0000 -118.58351 -111.18006 7.40346 2.79403 -112.02519 1052.88283
MELTING PROCESS: loop number 36 T-loop= 1172.0000000000000
main_MD> interactions number 36 at Temperature= 1172.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.10997 0.22608 2.59018
force_rgl> df(natom) 0.03171 0.48466 0.95192
8755.0000 -118.56245 -109.35198 9.21046 2.89079 -110.69452 1187.85775
8760.0000 -119.06402 -111.44039 7.62362 2.88162 -110.82073 1161.05605
8765.0000 -118.62713 -110.04664 8.58049 2.84652 -111.30340 1124.97302
8770.0000 -118.53601 -110.10025 8.43576 2.95776 -109.77360 1226.33764
8775.0000 -115.38436 -108.52427 6.86009 3.00676 -109.09972 1270.71396
8780.0000 -117.16631 -110.33188 6.83443 2.97784 -109.49740 1209.87818
8785.0000 -118.42883 -111.03825 7.39058 2.94979 -109.88321 1209.42289
8790.0000 -120.21723 -112.46402 7.75321 2.80497 -111.87475 1133.16212
8795.0000 -120.45145 -111.25076 9.20068 2.81586 -111.72503 1088.14793
8800.0000 -117.35048 -111.43135 5.91913 2.76108 -112.47839 1049.19922
8805.0000 -117.99502 -110.42214 7.57288 2.88423 -110.78480 1159.71738
8810.0000 -117.13607 -108.24038 8.89568 2.99157 -109.30864 1220.73470
8815.0000 -117.16236 -107.93516 9.22720 3.01959 -108.92322 1293.67692
8820.0000 -117.52290 -110.43542 7.08748 2.99634 -109.24302 1253.11999
8825.0000 -117.10128 -110.76272 6.33856 2.90862 -110.44933 1198.96325
8830.0000 -117.27110 -110.71776 6.55334 2.92827 -110.17917 1184.16803
8835.0000 -119.77502 -111.58413 8.19089 2.90246 -110.53412 1139.69830
8840.0000 -116.20667 -109.16872 7.03795 2.91580 -110.35066 1147.62379
8845.0000 -116.08108 -106.05535 10.02573 3.10226 -107.78629 1327.55465
8850.0000 -116.13120 -108.87275 7.25845 3.12805 -107.43164 1356.16699
8855.0000 -119.09926 -110.47224 8.62702 2.94805 -109.90708 1228.27866
8860.0000 -116.91981 -109.78573 7.13409 2.93568 -110.07727 1197.43019
8865.0000 -118.45280 -109.01697 9.43583 3.03019 -108.77753 1275.66119
8870.0000 -117.41313 -110.95562 6.45751 2.92256 -110.25760 1184.80078
8875.0000 -117.78241 -109.67728 8.10513 2.89118 -110.68918 1203.85847
8880.0000 -118.50381 -111.59355 6.91027 2.88058 -110.83498 1125.06628
8885.0000 -118.31484 -111.50388 6.81096 2.82766 -111.56274 1109.31538
8890.0000 -117.91995 -111.97179 5.94816 2.77088 -112.34355 1090.49834
8895.0000 -118.80980 -111.59341 7.21639 2.85695 -111.15991 1157.24115
8900.0000 -120.12475 -112.04532 8.07943 2.78412 -112.16159 1056.36626
8905.0000 -118.06095 -109.21638 8.84457 2.90562 -110.49059 1168.19448
8910.0000 -117.30688 -109.21039 8.09650 3.00151 -109.17186 1231.72950
8915.0000 -117.64536 -107.77081 9.87455 3.04062 -108.63401 1289.72178
8920.0000 -118.05319 -109.36946 8.68373 3.06717 -108.26895 1287.80849
8925.0000 -116.56603 -108.06108 8.50495 3.08347 -108.04473 1331.61395
8930.0000 -116.54189 -107.98948 8.55241 3.11126 -107.66256 1327.37193
8935.0000 -118.07810 -110.40932 7.66878 3.01417 -108.99771 1210.22206
8940.0000 -116.90315 -108.78604 8.11711 2.89059 -110.69731 1201.67615
8945.0000 -115.78386 -107.36932 8.41454 3.02876 -108.79706 1287.05079
8950.0000 -116.45429 -109.36480 7.08949 3.08621 -108.00706 1255.39041
8955.0000 -118.42332 -110.36993 8.05340 2.91967 -110.29742 1132.98205
8960.0000 -120.18626 -112.00590 8.18035 2.87163 -110.95799 1185.66240
8965.0000 -119.27217 -111.46611 7.80605 2.78847 -112.10167 1157.04961
8970.0000 -117.73706 -110.03180 7.70526 2.83734 -111.42956 1133.01961
8975.0000 -119.03272 -111.36049 7.67223 2.88818 -110.73045 1186.33788
8980.0000 -118.27932 -110.25023 8.02908 2.86775 -111.01139 1149.29034
8985.0000 -120.23292 -111.57419 8.65872 2.96393 -109.68871 1203.72390
8990.0000 -120.67230 -113.01435 7.65795 2.77717 -112.25708 1075.45942
8995.0000 -120.36982 -114.01919 6.35063 2.67638 -113.64315 994.42116
9000.0000 -117.53673 -111.33980 6.19693 2.76186 -112.46761 1089.77471
MELTING PROCESS: loop number 37 T-loop= 1197.0000000000000
main_MD> interactions number 37 at Temperature= 1197.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 4.82552 2.44341 -0.39971
force_rgl> df(natom) -2.20065 1.56609 -1.81715
9005.0000 -120.10110 -111.87618 8.22491 2.73506 -112.83628 1072.21957
9010.0000 -118.36244 -110.83967 7.52278 2.80252 -111.90850 1105.38509
9015.0000 -118.15990 -110.56423 7.59567 2.89205 -110.67721 1133.78440
9020.0000 -119.10376 -109.89277 9.21098 2.92803 -110.18239 1175.13507
9025.0000 -115.18466 -107.82605 7.35861 2.97745 -109.50282 1234.30635
9030.0000 -118.69901 -110.08569 8.61332 3.10318 -107.77371 1348.77923
9035.0000 -120.44868 -112.95413 7.49455 2.83213 -111.50125 1184.89278
9040.0000 -119.50661 -110.93727 8.56934 2.83008 -111.52952 1113.80991
9045.0000 -117.59859 -109.61347 7.98513 2.96917 -109.61668 1256.81751
9050.0000 -118.18337 -109.23137 8.95200 2.95101 -109.86642 1209.69555
9055.0000 -116.84102 -107.67134 9.16968 3.02332 -108.87199 1268.26693
9060.0000 -117.44424 -109.10854 8.33570 3.12601 -107.45974 1370.51430
9065.0000 -117.04156 -110.34988 6.69167 2.97828 -109.49130 1224.96799
9070.0000 -117.90251 -110.02281 7.87970 2.87137 -110.96165 1117.07905
9075.0000 -117.59725 -110.70673 6.89052 2.92228 -110.26153 1194.60168
9080.0000 -119.03456 -110.34861 8.68594 2.88728 -110.74286 1148.89026
9085.0000 -119.02981 -110.96399 8.06582 2.91375 -110.37873 1208.57491
9090.0000 -118.95512 -110.27179 8.68333 2.96593 -109.66125 1242.17797
9095.0000 -118.67419 -110.90034 7.77385 2.84850 -111.27610 1128.83760
9100.0000 -118.81080 -110.98352 7.82728 2.83024 -111.52726 1133.79167
9105.0000 -119.66238 -112.41149 7.25089 2.83435 -111.47076 1148.42553
9110.0000 -119.03416 -112.62872 6.40543 2.82253 -111.63323 1079.65567
9115.0000 -117.95416 -110.12373 7.83044 2.84196 -111.36612 1133.34698
9120.0000 -119.51519 -112.64275 6.87244 2.84538 -111.31906 1157.91702
9125.0000 -118.36861 -109.81583 8.55278 2.87433 -110.92089 1159.16438
9130.0000 -116.98330 -109.64926 7.33403 3.00922 -109.06591 1238.38182
9135.0000 -117.58260 -110.68568 6.89692 2.96293 -109.70249 1199.10240
9140.0000 -118.77203 -110.17502 8.59700 2.90637 -110.48029 1159.73140
9145.0000 -118.83311 -112.00465 6.82845 2.88864 -110.72413 1117.71497
9150.0000 -119.17580 -111.94326 7.23254 2.88659 -110.75229 1163.34565
9155.0000 -117.02837 -109.33949 7.68888 2.82011 -111.66663 1115.60259
9160.0000 -116.57265 -109.18569 7.38696 3.00704 -109.09582 1226.62575
9165.0000 -119.62086 -110.38288 9.23797 3.01861 -108.93668 1274.30517
9170.0000 -118.86966 -110.67360 8.19606 2.90371 -110.51689 1207.77564
9175.0000 -119.97336 -111.89242 8.08094 2.78438 -112.15792 1072.74385
9180.0000 -119.98930 -112.83477 7.15453 2.79829 -111.96664 1120.08658
9185.0000 -115.59415 -108.41874 7.17541 2.96163 -109.72038 1251.32527
9190.0000 -115.86437 -108.84889 7.01549 2.99962 -109.19783 1231.79544
9195.0000 -116.62564 -107.30669 9.31895 3.03302 -108.73857 1267.94121
9200.0000 -115.72299 -106.90889 8.81411 3.11552 -107.60398 1341.87191
9205.0000 -117.48072 -108.92572 8.55499 3.05925 -108.37780 1306.47862
9210.0000 -116.61866 -109.99017 6.62849 2.96083 -109.73132 1250.20800
9215.0000 -118.37756 -110.68378 7.69378 2.90535 -110.49436 1204.60818
9220.0000 -119.05189 -111.51330 7.53860 2.86364 -111.06795 1114.91777
9225.0000 -118.81414 -111.74721 7.06693 2.85375 -111.20394 1106.49371
9230.0000 -119.17910 -111.72060 7.45850 2.80476 -111.87773 1077.33010
9235.0000 -120.30836 -112.10808 8.20029 2.83636 -111.44308 1072.66178
9240.0000 -117.97162 -110.97563 6.99599 2.84421 -111.33514 1110.22032
9245.0000 -119.19688 -111.07384 8.12304 2.88557 -110.76633 1184.14189
9250.0000 -117.96609 -110.03763 7.92847 2.92157 -110.27121 1206.14342
main_MD> EXECUTION TIME: 0 [day], 0 [hour], 10 [min], 25.2367769 [s].
main_MD> Deallocating global variables
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