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nanoparticlesims/growth_Melting_Silver_ICO_3269/growthSims/run_91/growth.log

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main_MD> Reading input file
read_input> Process type: growth
read_input> Input for metadynamics has been read
read_input> Metadynamics has not been chosen.
read_input> Reading initial positions from../seed.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 = 55 ntipo2 = 0
read_input> Finish reading input
main_MD> Allocating global variables
main_MD> Number of outputs that will be created: 1800
main_MD> Size of nv and nvoiz: 91 9100
main_MD> Size of nv and nvoiz: 91 9100
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 = 91
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> 1.3214643174617244E-002 -3.6953410753737870E-002 -9.3692011970034625E-004 initial drift of cluster / NP1 for coalescence
init> 0.29761677254658708 0.28863744001379871 0.30704932587591982 scaling for velocity /for coalescence NP1
init.f90 > facguy = 1.8596158565290337E-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) -0.00000 -0.00000 0.00000
force_rgl> df(natom) 0.00000 0.00000 2.88576
preparo> THERMALIZATION PROCESS AT 299.48868421907343
preparo> TOTAL ENERGY, KINETIC EN., POT. ENERGY, DELTA
5000 -137.85827948819812 1.7661718768168191 -139.62445136501495 3.6259237101183574E-004
preparo> END THERMALISATION ON NPAST DEFINE IN PARACLUSTER MODULE
main_MD> Time-loop is starting for growth
main_MD> Now the computation of EXECUTION TIME starts
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.50311 0.77195 1.11640
force_rgl> df(natom) 0.00000 0.00000 0.00000
5.0000 56 0 -138.71911 3.25608 1.84739 -138.15938 311.29310
10.0000 56 0 -140.05060 2.28791 1.75175 -139.55922 351.42255
15.0000 56 0 -140.31907 2.13108 1.71487 -140.09911 310.60760
20.0000 56 0 -140.73691 1.92226 1.67464 -140.68799 275.61347
25.0000 56 0 -139.93365 2.42840 1.69201 -140.43362 292.71481
30.0000 56 0 -139.44250 2.39685 1.72884 -139.89454 331.33314
35.0000 56 0 -139.91380 2.10101 1.73334 -139.82870 334.62223
40.0000 56 0 -139.97779 2.06272 1.70664 -140.21960 307.76625
45.0000 56 0 -139.90777 2.36745 1.73523 -139.80099 334.07121
50.0000 56 0 -140.24353 1.97232 1.70150 -140.29482 304.21242
55.0000 56 0 -140.70166 1.93709 1.70216 -140.28508 304.76686
60.0000 56 0 -140.09075 1.98709 1.68578 -140.52487 283.93154
65.0000 56 0 -139.99716 2.26432 1.71290 -140.12791 307.50569
70.0000 56 0 -139.88121 2.45872 1.70665 -140.21943 302.78704
75.0000 56 0 -139.66403 2.37095 1.74205 -139.70124 339.09589
80.0000 56 0 -140.26079 2.05188 1.71789 -140.05482 311.04487
85.0000 56 0 -140.32592 2.51142 1.70189 -140.28905 298.95681
90.0000 56 0 -140.28765 2.06041 1.71219 -140.13826 312.98461
95.0000 56 0 -140.13700 2.30001 1.69416 -140.40225 288.07248
100.0000 56 0 -140.83709 1.97982 1.69626 -140.37139 289.99332
105.0000 56 0 -140.29589 2.28937 1.68455 -140.54284 284.61626
110.0000 56 0 -140.04786 2.17194 1.70338 -140.26720 306.72716
115.0000 56 0 -140.61244 1.89782 1.69755 -140.35258 298.98162
120.0000 56 0 -140.76013 2.16207 1.67777 -140.64212 276.46158
125.0000 56 0 -140.15229 2.36437 1.68769 -140.49683 295.35096
130.0000 56 0 -139.71478 2.49130 1.70816 -140.19734 308.31344
135.0000 56 0 -140.21941 1.83618 1.73350 -139.82641 328.80367
140.0000 56 0 -139.57612 2.60538 1.70800 -140.19968 301.45793
145.0000 56 0 -140.19236 2.25258 1.72827 -139.90299 324.97610
150.0000 56 0 -140.72398 1.91672 1.68284 -140.56790 280.09355
155.0000 56 0 -140.48928 2.13837 1.68184 -140.58252 280.83606
160.0000 56 0 -140.11827 1.90953 1.69837 -140.34063 296.41051
165.0000 56 0 -139.76915 2.60524 1.71061 -140.16141 306.34584
170.0000 56 0 -139.25975 2.78641 1.75682 -139.48506 350.49987
175.0000 56 0 -140.38671 1.82292 1.72868 -139.89695 332.34631
180.0000 56 0 -140.84123 1.89679 1.68567 -140.52654 289.64357
185.0000 56 0 -140.20270 2.16893 1.68366 -140.55585 284.00109
190.0000 56 0 -140.18451 2.12362 1.71592 -140.08372 312.75353
195.0000 56 0 -140.08721 2.46510 1.71013 -140.16841 312.46219
200.0000 56 0 -140.25258 2.50266 1.71084 -140.15800 312.52548
205.0000 56 0 -140.45109 1.92269 1.69421 -140.40144 299.40655
210.0000 56 0 -140.34921 2.15983 1.69118 -140.44588 297.77198
215.0000 56 0 -139.92271 2.05863 1.71830 -140.04883 324.54195
220.0000 56 0 -140.55857 1.88075 1.71465 -140.10231 314.54474
225.0000 56 0 -141.28393 1.63396 1.66921 -140.76742 272.61528
230.0000 56 0 -140.82950 1.97604 1.65304 -141.00414 258.08094
235.0000 56 0 -140.36925 2.05783 1.69033 -140.45825 289.11728
240.0000 56 0 -140.65622 1.94763 1.67486 -140.68470 280.61341
245.0000 56 0 -140.44429 2.02651 1.68073 -140.59871 284.06678
250.0000 56 0 -140.12973 2.34079 1.70858 -140.19117 311.02613
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.77091 -0.17138 0.51893
force_rgl> df(natom) 0.00000 0.00000 0.00000
255.0000 57 0 -141.46181 2.51210 1.89566 -140.07350 326.97166
260.0000 57 0 -141.83482 2.56171 1.78219 -141.75404 364.17075
265.0000 57 0 -141.43237 2.86850 1.80904 -141.35638 387.52207
270.0000 57 0 -141.79692 2.64429 1.78693 -141.68392 362.42308
275.0000 57 0 -142.58980 2.41100 1.76546 -142.00188 354.55495
280.0000 57 0 -142.45817 2.19311 1.72884 -142.54429 317.36638
285.0000 57 0 -143.35413 2.02746 1.69588 -143.03240 285.89262
290.0000 57 0 -142.80457 1.99729 1.69368 -143.06494 281.18604
295.0000 57 0 -142.57865 2.25291 1.73036 -142.52165 319.86542
300.0000 57 0 -143.01380 1.88700 1.73208 -142.49626 321.26463
305.0000 57 0 -142.81806 2.22650 1.70519 -142.89444 299.69750
310.0000 57 0 -142.43383 2.04541 1.73079 -142.51537 320.31959
315.0000 57 0 -142.89327 2.13278 1.74352 -142.32673 333.22430
320.0000 57 0 -142.75269 2.31434 1.71291 -142.78021 301.46494
325.0000 57 0 -142.43240 2.39105 1.71159 -142.79970 300.02159
330.0000 57 0 -141.79951 2.14321 1.76160 -142.05905 349.59901
335.0000 57 0 -142.35916 2.64734 1.74314 -142.33246 329.68802
340.0000 57 0 -143.05625 1.96813 1.72606 -142.58540 312.17665
345.0000 57 0 -142.52298 2.39814 1.70285 -142.92908 291.98803
350.0000 57 0 -142.30373 2.07829 1.73521 -142.44992 323.28826
355.0000 57 0 -142.40030 2.22879 1.73972 -142.38309 327.31031
360.0000 57 0 -142.76584 1.90478 1.72942 -142.53569 315.91885
365.0000 57 0 -143.03322 2.08496 1.69727 -143.01179 288.15830
370.0000 57 0 -142.72165 2.40108 1.70567 -142.88745 294.55717
375.0000 57 0 -142.80610 2.12871 1.70368 -142.91684 289.22026
380.0000 57 0 -142.41239 2.42533 1.71153 -142.80053 303.88413
385.0000 57 0 -142.84212 2.19424 1.72351 -142.62314 315.71862
390.0000 57 0 -142.88460 2.26490 1.70824 -142.84939 297.49390
395.0000 57 0 -142.62914 1.90943 1.70999 -142.82344 299.47247
400.0000 57 0 -143.29317 2.07425 1.72459 -142.60719 314.20864
405.0000 57 0 -142.83811 2.31983 1.67938 -143.27673 268.18900
410.0000 57 0 -143.56424 1.96443 1.69277 -143.07849 282.16330
415.0000 57 0 -143.05833 1.96729 1.67556 -143.33340 263.18991
420.0000 57 0 -142.76684 2.69071 1.70083 -142.95909 288.08475
425.0000 57 0 -142.94425 2.16326 1.68789 -143.15077 274.08747
430.0000 57 0 -142.87966 2.26037 1.71060 -142.81439 289.70563
435.0000 57 0 -142.99776 2.28035 1.70077 -142.95993 288.65266
440.0000 57 0 -142.93011 2.30526 1.70704 -142.86706 300.46245
445.0000 57 0 -142.92943 2.13534 1.70036 -142.96605 287.93945
450.0000 57 0 -142.92051 1.81711 1.71178 -142.79688 301.05405
455.0000 57 0 -143.04835 2.02996 1.68854 -143.14107 276.50155
460.0000 57 0 -142.68703 2.13986 1.72695 -142.57222 315.58121
465.0000 57 0 -143.03747 2.03238 1.70825 -142.84919 299.42554
470.0000 57 0 -142.91285 2.00768 1.68696 -143.16453 275.16142
475.0000 57 0 -142.97304 1.97340 1.68919 -143.13146 273.88896
480.0000 57 0 -142.98440 2.10373 1.69463 -143.05092 284.43160
485.0000 57 0 -143.21882 2.11859 1.68600 -143.17873 274.28850
490.0000 57 0 -143.18518 2.12776 1.67855 -143.28909 268.07156
495.0000 57 0 -142.95179 2.19028 1.69238 -143.08422 284.69464
500.0000 57 0 -142.86660 2.01275 1.70901 -142.83795 299.90903
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.22344 3.65026 -0.55781
force_rgl> df(natom) 0.00000 0.00000 0.00000
505.0000 58 0 -142.83806 2.86400 1.89573 -142.69495 332.50993
510.0000 58 0 -144.41736 2.72740 1.83803 -143.55960 389.33490
515.0000 58 0 -144.58805 2.56560 1.76815 -144.60654 330.57727
520.0000 58 0 -145.30831 2.07263 1.74619 -144.93559 306.42073
525.0000 58 0 -144.90729 2.31125 1.74273 -144.98752 306.66255
530.0000 58 0 -145.40636 2.18761 1.75577 -144.79216 328.36049
535.0000 58 0 -145.64468 2.25420 1.71543 -145.39646 295.47679
540.0000 58 0 -145.36907 2.13835 1.69833 -145.65272 279.66040
545.0000 58 0 -145.55077 2.17179 1.71844 -145.35138 294.70889
550.0000 58 0 -145.01197 2.46086 1.72481 -145.25593 302.91759
555.0000 58 0 -144.99877 2.43338 1.72895 -145.19389 314.83146
560.0000 58 0 -144.88683 2.28135 1.75439 -144.81280 326.23281
565.0000 58 0 -145.09890 2.12847 1.74680 -144.92644 323.94415
570.0000 58 0 -145.18047 2.29679 1.72579 -145.24129 307.73397
575.0000 58 0 -144.08717 2.79427 1.77877 -144.44743 352.28071
580.0000 58 0 -144.89293 2.24620 1.77952 -144.43623 346.96165
585.0000 58 0 -145.07661 2.28876 1.72528 -145.24891 305.00124
590.0000 58 0 -145.70206 2.24581 1.73738 -145.06771 315.93154
595.0000 58 0 -145.23982 2.40431 1.69418 -145.71499 271.45217
600.0000 58 0 -145.34429 1.94891 1.73112 -145.16149 310.15048
605.0000 58 0 -145.49161 2.24283 1.71153 -145.45497 292.31086
610.0000 58 0 -145.18776 2.26238 1.71811 -145.35633 298.05021
615.0000 58 0 -145.20798 1.92458 1.71469 -145.40757 292.95796
620.0000 58 0 -144.97142 2.46145 1.73272 -145.13751 312.37237
625.0000 58 0 -145.06723 1.88831 1.72498 -145.25345 303.31708
630.0000 58 0 -144.70776 2.36992 1.73002 -145.17796 304.34688
635.0000 58 0 -145.07273 2.70903 1.73098 -145.16352 306.89399
640.0000 58 0 -145.78116 2.14321 1.71761 -145.36389 293.42745
645.0000 58 0 -145.49510 2.09712 1.69167 -145.75262 270.40505
650.0000 58 0 -144.85363 2.29638 1.73711 -145.07172 315.36439
655.0000 58 0 -145.18992 2.11496 1.72384 -145.27059 302.69558
660.0000 58 0 -144.97701 2.27747 1.74514 -144.95130 319.75155
665.0000 58 0 -144.89645 2.48169 1.72275 -145.28678 302.76370
670.0000 58 0 -144.75090 2.52817 1.73853 -145.05047 315.73192
675.0000 58 0 -145.44665 2.02727 1.73611 -145.08665 315.99462
680.0000 58 0 -145.16250 2.13952 1.73025 -145.17441 307.19081
685.0000 58 0 -145.80686 1.87161 1.70910 -145.49140 289.07625
690.0000 58 0 -145.88232 1.90487 1.68606 -145.83665 269.10596
695.0000 58 0 -146.01016 1.69343 1.67438 -146.01154 255.02494
700.0000 58 0 -145.26259 2.39890 1.70053 -145.61977 280.09912
705.0000 58 0 -144.91885 2.20203 1.73321 -145.13013 314.96268
710.0000 58 0 -145.76840 1.83368 1.71412 -145.41624 294.12274
715.0000 58 0 -145.74848 1.94550 1.69236 -145.74216 273.51965
720.0000 58 0 -145.54451 2.35920 1.68196 -145.89797 262.26533
725.0000 58 0 -145.28000 2.25680 1.70542 -145.54654 283.83869
730.0000 58 0 -144.96103 2.73048 1.72277 -145.28656 300.15192
735.0000 58 0 -145.22682 2.15311 1.73532 -145.09854 313.31957
740.0000 58 0 -145.45930 2.41595 1.72148 -145.30593 299.92333
745.0000 58 0 -145.97644 1.98418 1.71294 -145.43391 291.66312
750.0000 58 0 -145.66840 2.21806 1.69103 -145.76215 274.17662
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.10005 1.18242 1.20531
force_rgl> df(natom) 0.00000 0.00000 0.00000
755.0000 59 0 -145.59344 3.30619 1.87048 -145.70202 299.03127
760.0000 59 0 -146.91722 2.73046 1.82432 -146.40170 373.84299
765.0000 59 0 -147.41912 2.69417 1.74747 -147.56640 305.24022
770.0000 59 0 -147.42828 2.53722 1.75295 -147.48324 321.76773
775.0000 59 0 -147.44826 2.10396 1.75459 -147.45852 319.76070
780.0000 59 0 -147.84614 2.39029 1.73992 -147.68073 302.26800
785.0000 59 0 -148.12933 2.02382 1.72349 -147.92981 289.17447
790.0000 59 0 -147.84683 2.05596 1.71337 -148.08313 276.41959
795.0000 59 0 -147.74904 2.42697 1.73550 -147.74770 300.23396
800.0000 59 0 -148.13438 1.98704 1.73297 -147.78613 291.92764
805.0000 59 0 -147.50081 2.64317 1.72471 -147.91123 289.25317
810.0000 59 0 -147.58250 2.62529 1.76309 -147.32969 327.50147
815.0000 59 0 -147.80858 2.37764 1.74098 -147.66465 307.90733
820.0000 59 0 -147.36410 2.25700 1.73207 -147.79979 297.43446
825.0000 59 0 -147.64456 2.36209 1.75570 -147.44155 319.06626
830.0000 59 0 -147.65282 2.17675 1.73303 -147.78520 298.61139
835.0000 59 0 -148.17501 2.16567 1.71733 -148.02307 285.01782
840.0000 59 0 -147.96426 2.23889 1.72580 -147.89481 287.20464
845.0000 59 0 -147.92292 1.89797 1.72437 -147.91645 290.16514
850.0000 59 0 -147.74499 2.06715 1.71929 -147.99339 291.00685
855.0000 59 0 -147.75783 1.98707 1.75120 -147.50978 309.18007
860.0000 59 0 -147.92215 1.89462 1.72668 -147.88146 292.66827
865.0000 59 0 -147.78342 2.08253 1.73486 -147.75745 297.88515
870.0000 59 0 -147.37128 2.34375 1.76039 -147.37054 321.07880
875.0000 59 0 -147.81247 2.08738 1.73997 -147.68001 301.74494
880.0000 59 0 -147.34652 2.26142 1.75081 -147.51566 314.14353
885.0000 59 0 -147.29210 2.51932 1.76488 -147.30249 329.42566
890.0000 59 0 -147.13874 2.21031 1.77086 -147.21192 333.95776
895.0000 59 0 -147.18610 2.59643 1.78341 -147.02166 348.47772
900.0000 59 0 -147.83375 2.02966 1.74256 -147.64080 306.84327
905.0000 59 0 -147.77519 2.21540 1.72567 -147.89669 286.84908
910.0000 59 0 -146.59957 2.67763 1.75735 -147.41663 318.70391
915.0000 59 0 -147.55030 2.16958 1.76094 -147.36222 323.87060
920.0000 59 0 -147.39565 2.71241 1.75410 -147.46592 313.27299
925.0000 59 0 -147.51494 2.50372 1.76379 -147.31895 328.63860
930.0000 59 0 -147.81627 2.06081 1.74320 -147.63105 298.22958
935.0000 59 0 -147.22362 2.02344 1.74636 -147.58321 306.32686
940.0000 59 0 -147.82047 1.89313 1.75041 -147.52173 310.79502
945.0000 59 0 -147.69352 2.16555 1.73571 -147.74462 290.58605
950.0000 59 0 -147.25371 2.09380 1.77426 -147.16039 324.21493
955.0000 59 0 -148.09729 2.06230 1.73794 -147.71074 301.71250
960.0000 59 0 -147.17089 2.63566 1.73667 -147.73006 299.71699
965.0000 59 0 -147.41103 2.07053 1.74831 -147.55356 301.13148
970.0000 59 0 -147.93557 1.98858 1.75312 -147.48078 314.06932
975.0000 59 0 -147.45086 2.46243 1.74183 -147.65185 307.51077
980.0000 59 0 -147.41403 2.31392 1.76822 -147.25187 331.91858
985.0000 59 0 -147.27663 2.66748 1.75332 -147.47767 318.35160
990.0000 59 0 -147.38107 2.33150 1.75108 -147.51165 313.75770
995.0000 59 0 -147.74495 2.20099 1.75157 -147.50415 312.33885
1000.0000 59 0 -147.39072 2.11192 1.73687 -147.72708 289.52210
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.78486 2.01641 -1.31138
force_rgl> df(natom) 0.00000 0.00000 0.00000
1005.0000 60 0 -147.44780 2.72141 1.95709 -147.00522 354.04085
1010.0000 60 0 -149.27872 2.60767 1.83770 -148.83511 376.38932
1015.0000 60 0 -149.62105 2.45718 1.79130 -149.54617 331.42998
1020.0000 60 0 -149.82107 2.57712 1.77358 -149.81772 324.85460
1025.0000 60 0 -150.05558 2.55706 1.76691 -149.92008 328.15841
1030.0000 60 0 -150.29053 2.58734 1.75175 -150.15240 329.08842
1035.0000 60 0 -150.49139 2.49058 1.74674 -150.22920 331.03238
1040.0000 60 0 -151.13109 2.45988 1.69777 -150.97961 289.51648
1045.0000 60 0 -150.58370 2.28340 1.69770 -150.98078 284.76314
1050.0000 60 0 -150.59813 2.34623 1.72240 -150.60212 306.70538
1055.0000 60 0 -151.19566 1.99959 1.68896 -151.11469 276.97551
1060.0000 60 0 -150.97588 2.16081 1.68387 -151.19262 271.22437
1065.0000 60 0 -150.56890 2.61784 1.70294 -150.90040 287.73442
1070.0000 60 0 -150.53986 2.31327 1.72217 -150.60566 307.56220
1075.0000 60 0 -150.00269 2.53792 1.73888 -150.34962 322.92448
1080.0000 60 0 -150.64431 2.46168 1.73833 -150.35802 315.29518
1085.0000 60 0 -150.68136 2.09201 1.72103 -150.62318 305.61315
1090.0000 60 0 -150.74557 2.16706 1.70473 -150.87296 287.79091
1095.0000 60 0 -150.85664 2.27350 1.70653 -150.84540 293.49151
1100.0000 60 0 -150.72776 2.29904 1.71375 -150.73480 296.78512
1105.0000 60 0 -151.06355 2.18736 1.69103 -151.08293 279.18448
1110.0000 60 0 -150.75337 1.81744 1.68872 -151.11838 275.24285
1115.0000 60 0 -150.30540 2.47661 1.73925 -150.34396 319.10518
1120.0000 60 0 -150.47335 2.11078 1.73503 -150.40853 317.65459
1125.0000 60 0 -149.47841 3.27498 1.76544 -149.94254 346.53736
1130.0000 60 0 -149.90816 2.74035 1.79992 -149.41415 378.83463
1135.0000 60 0 -150.06033 2.52115 1.74952 -150.18655 336.33093
1140.0000 60 0 -150.38974 2.50329 1.74434 -150.26593 333.61083
1145.0000 60 0 -150.38481 2.24454 1.73163 -150.46077 313.24019
1150.0000 60 0 -150.26639 2.35888 1.74902 -150.19413 334.18671
1155.0000 60 0 -151.42594 2.02747 1.70402 -150.88393 290.07856
1160.0000 60 0 -150.94909 2.28427 1.69092 -151.08459 277.80694
1165.0000 60 0 -150.69498 2.46660 1.72855 -150.50791 317.04798
1170.0000 60 0 -150.56566 2.52762 1.72047 -150.63170 310.19981
1175.0000 60 0 -150.77687 2.19037 1.72366 -150.58292 303.01507
1180.0000 60 0 -150.71731 2.55695 1.74176 -150.30551 317.62942
1185.0000 60 0 -150.41962 2.56708 1.72337 -150.58731 307.99893
1190.0000 60 0 -150.14591 2.42634 1.76018 -150.02315 342.25894
1195.0000 60 0 -149.90282 2.74376 1.75462 -150.10833 334.74299
1200.0000 60 0 -150.55663 2.52473 1.72662 -150.53754 308.40517
1205.0000 60 0 -150.90119 2.18924 1.72488 -150.56410 307.63283
1210.0000 60 0 -151.43147 1.92360 1.68364 -151.19622 270.34964
1215.0000 60 0 -150.76972 2.27315 1.70024 -150.94183 287.83506
1220.0000 60 0 -150.80125 2.11274 1.72459 -150.56858 313.66412
1225.0000 60 0 -150.64475 1.79530 1.72356 -150.58447 313.40232
1230.0000 60 0 -150.54211 2.13129 1.73569 -150.39852 321.47503
1235.0000 60 0 -150.57270 2.15716 1.71819 -150.66667 298.90448
1240.0000 60 0 -150.18832 2.75463 1.73263 -150.44537 318.12139
1245.0000 60 0 -150.60530 2.15113 1.74704 -150.22449 330.17872
1250.0000 60 0 -151.16947 2.10134 1.70149 -150.92270 285.57735
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.69087 -1.63462 -1.29498
force_rgl> df(natom) 0.00000 0.00000 0.00000
1255.0000 61 0 -150.65449 3.33377 1.88538 -150.73417 322.21764
1260.0000 61 0 -151.79503 2.68936 1.84852 -151.30538 400.21217
1265.0000 61 0 -152.88620 2.45478 1.78654 -152.26577 364.70153
1270.0000 61 0 -152.95688 2.65226 1.73760 -153.02411 321.03067
1275.0000 61 0 -153.36598 2.07649 1.72595 -153.20467 313.19995
1280.0000 61 0 -153.42264 2.17776 1.72112 -153.27958 315.77035
1285.0000 61 0 -153.79396 2.35092 1.67828 -153.94336 268.71991
1290.0000 61 0 -153.40582 2.47862 1.70185 -153.57804 292.33439
1295.0000 61 0 -152.92745 2.58465 1.72069 -153.28613 310.88641
1300.0000 61 0 -152.94439 2.61469 1.73710 -153.03185 326.85692
1305.0000 61 0 -153.65683 2.35526 1.73837 -153.01223 325.20635
1310.0000 61 0 -152.80619 2.62001 1.73097 -153.12686 320.66961
1315.0000 61 0 -153.03086 2.75462 1.72904 -153.15672 320.89883
1320.0000 61 0 -152.79240 2.67828 1.74925 -152.84366 338.93427
1325.0000 61 0 -153.58969 2.25181 1.73769 -153.02280 328.01037
1330.0000 61 0 -152.86779 2.28188 1.73149 -153.11883 319.77487
1335.0000 61 0 -153.17094 2.21377 1.73267 -153.10056 321.08027
1340.0000 61 0 -152.88492 2.28090 1.72851 -153.16502 316.37159
1345.0000 61 0 -153.53613 2.17283 1.72394 -153.23584 311.02474
1350.0000 61 0 -154.06937 1.88801 1.69140 -153.74005 280.12363
1355.0000 61 0 -153.08438 2.90241 1.70144 -153.58439 294.15220
1360.0000 61 0 -153.79763 2.12080 1.69494 -153.68523 284.44831
1365.0000 61 0 -154.32628 1.84506 1.67322 -154.02170 264.42072
1370.0000 61 0 -154.20499 1.89290 1.66074 -154.21511 252.45945
1375.0000 61 0 -154.06918 2.07940 1.65768 -154.26261 249.61867
1380.0000 61 0 -153.42281 2.31606 1.69471 -153.68871 284.32316
1385.0000 61 0 -153.65143 2.03719 1.70595 -153.51454 293.55695
1390.0000 61 0 -153.22413 2.41087 1.71381 -153.39277 304.69766
1395.0000 61 0 -153.51932 2.18699 1.72687 -153.19040 311.76941
1400.0000 61 0 -152.51817 2.37436 1.73769 -153.02279 328.06739
1405.0000 61 0 -153.51869 2.12129 1.74693 -152.87951 336.57569
1410.0000 61 0 -153.20167 2.63799 1.72629 -153.19945 318.91687
1415.0000 61 0 -153.62920 2.02556 1.71881 -153.31524 309.73507
1420.0000 61 0 -153.58770 2.34757 1.69258 -153.72177 282.99705
1425.0000 61 0 -153.43498 2.45553 1.70554 -153.52090 295.52690
1430.0000 61 0 -153.66162 2.13851 1.70960 -153.45809 298.47570
1435.0000 61 0 -153.63005 1.98234 1.69282 -153.71810 284.14048
1440.0000 61 0 -153.76580 2.10934 1.68929 -153.77277 278.63464
1445.0000 61 0 -153.80586 2.15428 1.69473 -153.68851 285.58752
1450.0000 61 0 -153.91914 1.97972 1.68614 -153.82159 277.40699
1455.0000 61 0 -153.11368 2.41010 1.70458 -153.53576 293.64755
1460.0000 61 0 -153.62102 2.26990 1.72430 -153.23016 313.93555
1465.0000 61 0 -153.76217 2.39020 1.70666 -153.50359 299.34196
1470.0000 61 0 -153.72490 2.21652 1.68525 -153.83538 276.95344
1475.0000 61 0 -153.98205 2.06598 1.66724 -154.11439 258.04706
1480.0000 61 0 -152.79286 3.02122 1.72526 -153.21543 313.44116
1485.0000 61 0 -153.37575 2.09932 1.72689 -153.19017 315.54641
1490.0000 61 0 -152.65767 2.62452 1.75627 -152.73479 342.13271
1495.0000 61 0 -152.72182 2.94146 1.74135 -152.96609 328.30381
1500.0000 61 0 -153.13584 2.26426 1.73453 -153.07164 322.51867
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.64835 3.29470 5.01835
force_rgl> df(natom) 0.00000 0.00000 0.00000
1505.0000 62 0 -153.11445 3.11262 1.91215 -152.94635 340.08113
1510.0000 62 0 -154.66322 2.84546 1.86173 -153.73618 411.88849
1515.0000 62 0 -155.40888 2.28428 1.77786 -155.05000 326.51223
1520.0000 62 0 -154.94983 2.43809 1.77596 -155.07971 326.14696
1525.0000 62 0 -155.44358 2.50907 1.73631 -155.70086 293.53410
1530.0000 62 0 -155.89960 2.45440 1.74285 -155.59839 301.85051
1535.0000 62 0 -155.53553 2.32514 1.74716 -155.53090 302.31303
1540.0000 62 0 -155.59189 2.02996 1.73984 -155.64552 300.00803
1545.0000 62 0 -155.11627 2.52257 1.75729 -155.37221 316.13183
1550.0000 62 0 -155.41945 2.78851 1.75356 -155.43072 313.89347
1555.0000 62 0 -155.99678 2.02632 1.74956 -155.49328 311.53342
1560.0000 62 0 -155.33112 2.43357 1.74298 -155.59640 303.36860
1565.0000 62 0 -155.38714 2.50405 1.76955 -155.18015 322.52159
1570.0000 62 0 -155.51901 2.72733 1.74562 -155.55505 305.99669
1575.0000 62 0 -155.16452 2.33104 1.76219 -155.29541 313.24425
1580.0000 62 0 -155.44173 2.38808 1.74329 -155.59152 295.15891
1585.0000 62 0 -155.36856 2.38236 1.77307 -155.12503 334.45470
1590.0000 62 0 -155.37973 2.59375 1.76089 -155.31583 319.69441
1595.0000 62 0 -155.90733 2.14713 1.74095 -155.62817 298.01042
1600.0000 62 0 -155.43568 2.33607 1.73384 -155.73955 294.52404
1605.0000 62 0 -155.58310 2.16872 1.73977 -155.64666 299.99495
1610.0000 62 0 -155.94148 2.10492 1.74149 -155.61966 304.09979
1615.0000 62 0 -155.68246 2.25831 1.70564 -156.18135 270.28376
1620.0000 62 0 -155.53373 2.50954 1.75816 -155.35857 317.00917
1625.0000 62 0 -155.89077 2.09616 1.74496 -155.56529 305.23977
1630.0000 62 0 -155.55300 2.41999 1.71916 -155.96949 279.88889
1635.0000 62 0 -155.76494 2.42905 1.74026 -155.63891 304.22679
1640.0000 62 0 -154.94748 2.54099 1.74355 -155.58752 305.92591
1645.0000 62 0 -155.62615 2.34521 1.75997 -155.33024 316.27678
1650.0000 62 0 -155.84818 2.16787 1.73723 -155.68650 299.29281
1655.0000 62 0 -155.96666 2.15105 1.73260 -155.75898 294.07326
1660.0000 62 0 -155.99313 1.94151 1.70566 -156.18105 268.46112
1665.0000 62 0 -155.97113 2.13567 1.72871 -155.81995 290.83753
1670.0000 62 0 -155.89694 2.26292 1.72346 -155.90209 286.49996
1675.0000 62 0 -155.67019 2.36248 1.71254 -156.07316 276.32705
1680.0000 62 0 -156.29391 1.93207 1.72932 -155.81030 289.06180
1685.0000 62 0 -156.03758 2.27169 1.71400 -156.05029 275.78823
1690.0000 62 0 -155.68314 2.19180 1.74553 -155.55646 303.91268
1695.0000 62 0 -155.71728 1.96123 1.73164 -155.77408 281.84045
1700.0000 62 0 -155.61106 2.50245 1.73772 -155.67871 295.09230
1705.0000 62 0 -156.21664 2.14500 1.74620 -155.54598 309.25022
1710.0000 62 0 -155.64822 2.11901 1.72610 -155.86084 291.39073
1715.0000 62 0 -155.81039 2.51361 1.71717 -156.00070 277.94026
1720.0000 62 0 -155.44932 2.96812 1.73503 -155.72094 297.30330
1725.0000 62 0 -155.38204 2.54430 1.75468 -155.41307 315.35341
1730.0000 62 0 -155.31230 2.64926 1.76134 -155.30878 324.20869
1735.0000 62 0 -156.22725 2.15132 1.72823 -155.82746 290.89336
1740.0000 62 0 -155.95854 1.99546 1.71216 -156.07913 275.89864
1745.0000 62 0 -155.70628 2.22000 1.74235 -155.60628 300.14492
1750.0000 62 0 -155.46658 2.25986 1.72873 -155.81963 290.16301
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.02123 -1.59742 1.15113
force_rgl> df(natom) 0.00000 0.00000 0.00000
1755.0000 63 0 -155.83736 3.26052 1.91045 -155.60205 311.19762
1760.0000 63 0 -157.63790 2.44624 1.80941 -157.20180 342.34719
1765.0000 63 0 -157.27930 3.04789 1.77660 -157.72121 308.78189
1770.0000 63 0 -157.65624 2.60826 1.79017 -157.50638 326.40477
1775.0000 63 0 -157.49881 2.74298 1.80266 -157.30869 332.12922
1780.0000 63 0 -158.20364 2.00363 1.78354 -157.61134 314.83491
1785.0000 63 0 -158.08674 2.25140 1.75083 -158.12935 286.70218
1790.0000 63 0 -158.79129 1.89457 1.73608 -158.36282 276.14408
1795.0000 63 0 -158.25348 2.34154 1.73655 -158.35535 277.00349
1800.0000 63 0 -158.22879 2.17528 1.75284 -158.09743 286.40575
1805.0000 63 0 -157.80575 2.53428 1.76066 -157.97367 296.05437
1810.0000 63 0 -157.39238 2.39343 1.78996 -157.50980 321.49929
1815.0000 63 0 -157.48948 3.03003 1.78222 -157.63233 314.25857
1820.0000 63 0 -157.66591 2.55642 1.77592 -157.73201 306.40181
1825.0000 63 0 -157.63820 2.80976 1.77233 -157.78881 305.75558
1830.0000 63 0 -157.97936 2.56718 1.75760 -158.02207 293.25128
1835.0000 63 0 -157.87548 2.45744 1.77070 -157.81468 301.12820
1840.0000 63 0 -158.05396 2.10863 1.76539 -157.89880 299.44311
1845.0000 63 0 -157.81024 2.33344 1.76119 -157.96525 294.41541
1850.0000 63 0 -158.24170 2.15321 1.75835 -158.01020 292.47738
1855.0000 63 0 -157.90126 2.75664 1.75523 -158.05965 291.33964
1860.0000 63 0 -158.43230 2.38637 1.75749 -158.02377 292.54147
1865.0000 63 0 -158.42804 1.97748 1.72460 -158.54463 257.72119
1870.0000 63 0 -158.18283 2.06263 1.74983 -158.14505 284.55180
1875.0000 63 0 -158.42943 2.01254 1.73919 -158.31364 273.57554
1880.0000 63 0 -157.99001 2.78837 1.75797 -158.01622 292.96264
1885.0000 63 0 -158.00055 2.28852 1.75092 -158.12781 288.77183
1890.0000 63 0 -158.00928 2.48674 1.74242 -158.26243 278.48956
1895.0000 63 0 -157.75974 2.36552 1.79512 -157.42809 321.07363
1900.0000 63 0 -158.04945 2.51306 1.75949 -157.99215 292.93225
1905.0000 63 0 -157.72135 2.52982 1.75662 -158.03766 288.75607
1910.0000 63 0 -157.37302 2.87283 1.79575 -157.41811 324.87678
1915.0000 63 0 -158.15671 2.08377 1.78386 -157.60629 318.42464
1920.0000 63 0 -157.64009 2.62452 1.75998 -157.98450 293.78690
1925.0000 63 0 -157.88993 2.74228 1.76436 -157.91511 298.47080
1930.0000 63 0 -157.49642 2.69300 1.76477 -157.90857 303.57656
1935.0000 63 0 -157.15823 2.79646 1.79378 -157.44925 329.76315
1940.0000 63 0 -157.41210 2.43267 1.79793 -157.38360 330.71628
1945.0000 63 0 -157.70720 2.61850 1.80346 -157.29603 331.85166
1950.0000 63 0 -157.49908 2.38435 1.78043 -157.66068 316.12698
1955.0000 63 0 -157.36974 2.56398 1.78909 -157.52345 323.87231
1960.0000 63 0 -157.97123 2.22922 1.78031 -157.66260 314.50193
1965.0000 63 0 -157.40423 2.72532 1.78002 -157.66713 317.14070
1970.0000 63 0 -157.36326 2.58020 1.78785 -157.54317 325.93394
1975.0000 63 0 -157.36306 2.54328 1.78130 -157.64684 312.67399
1980.0000 63 0 -157.20855 2.47148 1.80076 -157.33883 334.15710
1985.0000 63 0 -157.87339 2.70503 1.78217 -157.63309 320.43984
1990.0000 63 0 -158.06899 2.37369 1.76330 -157.93190 305.87145
1995.0000 63 0 -157.66638 2.27887 1.76776 -157.86117 307.48367
2000.0000 63 0 -157.51465 2.40656 1.78255 -157.62704 318.21822
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.71021 -0.15158 0.22256
force_rgl> df(natom) 0.00000 0.00000 0.00000
2005.0000 64 0 -157.83774 3.45740 1.95648 -157.49631 339.58656
2010.0000 64 0 -159.59039 2.44951 1.87209 -158.84653 386.34818
2015.0000 64 0 -159.96237 2.02861 1.81461 -159.76631 331.55592
2020.0000 64 0 -160.39632 2.48769 1.78090 -160.30561 309.97652
2025.0000 64 0 -160.79123 2.05466 1.75721 -160.68471 288.35412
2030.0000 64 0 -159.84786 2.49087 1.78112 -160.30206 307.88259
2035.0000 64 0 -160.07643 2.37867 1.79041 -160.15340 317.07826
2040.0000 64 0 -160.25557 2.76217 1.78446 -160.24857 310.63113
2045.0000 64 0 -160.94406 1.99080 1.78462 -160.24602 316.28088
2050.0000 64 0 -160.99198 1.91830 1.72790 -161.15359 259.95767
2055.0000 64 0 -159.80032 2.45742 1.77356 -160.42307 303.43017
2060.0000 64 0 -159.91092 3.01487 1.81274 -159.79612 336.35062
2065.0000 64 0 -159.55627 2.82549 1.81215 -159.80553 337.04155
2070.0000 64 0 -160.16234 2.67424 1.80646 -159.89671 324.56495
2075.0000 64 0 -159.76143 2.70316 1.80042 -159.99327 319.83530
2080.0000 64 0 -160.20106 2.33342 1.78123 -160.30040 305.86503
2085.0000 64 0 -160.57300 2.33740 1.77192 -160.44933 296.70582
2090.0000 64 0 -160.48944 2.45899 1.76375 -160.58000 291.40815
2095.0000 64 0 -160.48510 2.62816 1.78210 -160.28634 298.88410
2100.0000 64 0 -160.62979 2.30134 1.75617 -160.70133 287.12559
2105.0000 64 0 -160.43583 2.07972 1.75661 -160.69419 288.49241
2110.0000 64 0 -160.22025 2.35937 1.77361 -160.42227 297.01744
2115.0000 64 0 -160.31964 2.70950 1.79979 -160.00339 341.49122
2120.0000 64 0 -161.29714 2.07165 1.73489 -161.04184 281.97170
2125.0000 64 0 -160.86526 2.39356 1.72586 -161.18627 275.25467
2130.0000 64 0 -160.36591 2.98760 1.74673 -160.85237 294.51124
2135.0000 64 0 -160.40193 2.53724 1.77178 -160.45145 309.26219
2140.0000 64 0 -160.55650 2.78919 1.78942 -160.16925 335.71354
2145.0000 64 0 -161.00897 2.64079 1.74700 -160.84805 320.70487
2150.0000 64 0 -161.22495 2.45544 1.73505 -161.03923 314.41082
2155.0000 64 0 -160.80343 2.69501 1.75334 -160.74650 332.85459
2160.0000 64 0 -161.63543 1.91093 1.72355 -161.22317 307.84950
2165.0000 64 0 -161.60733 2.11541 1.69848 -161.62427 279.73401
2170.0000 64 0 -161.26961 2.25299 1.70399 -161.53609 281.82653
2175.0000 64 0 -160.99263 2.52252 1.72212 -161.24611 296.40779
2180.0000 64 0 -161.59708 2.16719 1.72183 -161.25066 292.74775
2185.0000 64 0 -161.49908 2.26341 1.72195 -161.24876 299.27522
2190.0000 64 0 -161.25736 2.56729 1.73554 -161.03144 313.75518
2195.0000 64 0 -160.90868 2.37031 1.71797 -161.31250 295.33232
2200.0000 64 0 -160.84142 2.77769 1.76096 -160.62461 329.93543
2205.0000 64 0 -161.00615 2.40899 1.74386 -160.89817 319.14908
2210.0000 64 0 -160.77146 2.79160 1.72666 -161.17346 303.86307
2215.0000 64 0 -161.60265 2.35781 1.74048 -160.95231 316.36878
2220.0000 64 0 -161.83005 2.03860 1.71008 -161.43877 286.19925
2225.0000 64 0 -161.15533 2.52970 1.72557 -161.19087 303.15965
2230.0000 64 0 -160.97316 2.76448 1.73559 -161.03060 310.45962
2235.0000 64 0 -161.32571 2.47735 1.72443 -161.20915 302.76615
2240.0000 64 0 -161.18916 2.66619 1.72941 -161.12946 303.40568
2245.0000 64 0 -160.67418 2.73891 1.72884 -161.13848 305.19008
2250.0000 64 0 -160.78120 2.57217 1.75026 -160.79584 332.30150
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 5.35954 0.62830 -0.09048
force_rgl> df(natom) 0.00000 0.00000 0.00000
2255.0000 65 0 -161.59537 3.70692 1.92832 -160.57633 358.46491
2260.0000 65 0 -162.80288 2.95917 1.81433 -162.41918 359.06831
2265.0000 65 0 -162.94872 2.80859 1.77760 -163.01292 324.41728
2270.0000 65 0 -163.10963 2.55748 1.78648 -162.86939 331.31721
2275.0000 65 0 -163.03271 2.70441 1.78147 -162.95040 321.46408
2280.0000 65 0 -163.09280 2.88765 1.76072 -163.28582 304.34729
2285.0000 65 0 -163.53923 2.21739 1.76268 -163.25402 306.94603
2290.0000 65 0 -163.90009 2.35326 1.73472 -163.70619 287.38517
2295.0000 65 0 -163.46008 2.41148 1.74998 -163.45949 301.08301
2300.0000 65 0 -163.16687 2.60378 1.75981 -163.30057 308.76612
2305.0000 65 0 -163.05841 2.62644 1.76857 -163.15886 315.18347
2310.0000 65 0 -163.41475 2.44250 1.75170 -163.43163 298.92536
2315.0000 65 0 -163.32200 2.69648 1.76083 -163.28407 308.47334
2320.0000 65 0 -163.60629 2.78205 1.75021 -163.45571 300.00006
2325.0000 65 0 -163.46534 2.31581 1.74466 -163.54540 294.57284
2330.0000 65 0 -164.02776 2.41822 1.73680 -163.67242 287.33350
2335.0000 65 0 -163.65908 2.61279 1.74491 -163.54135 296.21329
2340.0000 65 0 -163.51326 2.68309 1.72418 -163.87648 278.50063
2345.0000 65 0 -163.87811 2.20452 1.74511 -163.53810 296.56535
2350.0000 65 0 -163.45631 2.36774 1.72914 -163.79638 279.25772
2355.0000 65 0 -163.23862 2.66499 1.76868 -163.15713 315.94151
2360.0000 65 0 -163.60520 2.33121 1.74989 -163.46090 301.07160
2365.0000 65 0 -164.38430 2.26731 1.72055 -163.93525 273.70211
2370.0000 65 0 -163.38378 2.80104 1.73762 -163.65920 289.76762
2375.0000 65 0 -163.45557 2.18293 1.75506 -163.37731 301.73730
2380.0000 65 0 -163.46344 2.44618 1.74352 -163.56390 292.04021
2385.0000 65 0 -162.99687 2.87964 1.75670 -163.35071 307.90936
2390.0000 65 0 -163.69834 2.35376 1.75628 -163.35750 303.14524
2395.0000 65 0 -163.32336 2.67323 1.73914 -163.63470 290.01551
2400.0000 65 0 -163.72424 2.22625 1.74240 -163.58188 294.18822
2405.0000 65 0 -163.16741 2.32572 1.74382 -163.55894 284.87475
2410.0000 65 0 -163.68745 2.52634 1.75400 -163.39442 299.81280
2415.0000 65 0 -163.18750 2.83864 1.73327 -163.72957 285.14596
2420.0000 65 0 -163.09466 2.41758 1.76447 -163.22514 313.74591
2425.0000 65 0 -163.05022 2.58630 1.75466 -163.38382 302.65695
2430.0000 65 0 -163.52439 2.41515 1.75085 -163.44535 300.46385
2435.0000 65 0 -163.51339 2.38834 1.74448 -163.54826 293.20163
2440.0000 65 0 -163.65037 2.15690 1.74615 -163.52137 296.92317
2445.0000 65 0 -163.49506 2.57954 1.75954 -163.30485 306.90015
2450.0000 65 0 -163.58242 3.12201 1.74206 -163.58749 296.53444
2455.0000 65 0 -163.08042 2.58712 1.75757 -163.33672 308.14192
2460.0000 65 0 -163.11397 2.92071 1.76018 -163.29445 308.35803
2465.0000 65 0 -162.36799 2.77434 1.77826 -163.00226 325.97203
2470.0000 65 0 -162.94509 2.82548 1.80139 -162.62826 339.07101
2475.0000 65 0 -162.52925 3.07659 1.78014 -162.97188 322.70174
2480.0000 65 0 -162.71133 2.25876 1.80077 -162.63827 334.39191
2485.0000 65 0 -162.73932 2.47043 1.78344 -162.91851 319.93606
2490.0000 65 0 -163.41003 2.49935 1.76772 -163.17256 309.64730
2495.0000 65 0 -163.78655 2.62079 1.73560 -163.69186 285.00173
2500.0000 65 0 -163.37900 2.45459 1.73147 -163.75859 282.84250
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.69952 -0.73379 -1.28231
force_rgl> df(natom) 0.00000 0.00000 0.00000
2505.0000 66 0 -163.49315 3.39284 1.91737 -163.38629 321.49900
2510.0000 66 0 -164.47160 2.92770 1.88261 -163.95391 400.61014
2515.0000 66 0 -164.83091 3.13867 1.84676 -164.53948 380.24984
2520.0000 66 0 -166.26959 2.50130 1.77720 -165.67547 321.59422
2525.0000 66 0 -165.90628 2.39171 1.74641 -166.17828 296.60125
2530.0000 66 0 -166.05804 2.74777 1.75643 -166.01468 300.84179
2535.0000 66 0 -165.55193 2.83596 1.78702 -165.51502 330.76150
2540.0000 66 0 -166.41336 2.18962 1.75818 -165.98615 295.14277
2545.0000 66 0 -165.96500 2.20934 1.74308 -166.23264 285.56483
2550.0000 66 0 -165.80482 2.57675 1.78465 -165.55384 328.17497
2555.0000 66 0 -166.20634 2.63963 1.75722 -166.00174 313.11989
2560.0000 66 0 -166.65623 2.36253 1.72773 -166.48331 289.33962
2565.0000 66 0 -165.86016 2.51359 1.73970 -166.28791 302.24195
2570.0000 66 0 -166.08035 2.65110 1.76219 -165.92054 317.37405
2575.0000 66 0 -165.89922 2.72371 1.76446 -165.88358 316.13662
2580.0000 66 0 -165.51505 3.29298 1.75946 -165.96525 315.99699
2585.0000 66 0 -165.92848 2.58636 1.76139 -165.93363 311.67654
2590.0000 66 0 -166.20759 2.71196 1.73824 -166.31173 297.97530
2595.0000 66 0 -166.70693 2.36244 1.72527 -166.52348 286.16418
2600.0000 66 0 -166.44412 2.44556 1.71981 -166.61264 288.01831
2605.0000 66 0 -165.57976 3.14263 1.75963 -165.96239 312.46440
2610.0000 66 0 -166.83722 2.20161 1.73420 -166.37767 296.48110
2615.0000 66 0 -166.40148 2.57475 1.71977 -166.61335 283.22966
2620.0000 66 0 -166.89836 2.43188 1.73523 -166.36094 299.03153
2625.0000 66 0 -165.74529 2.84876 1.73847 -166.30802 300.22480
2630.0000 66 0 -166.21150 2.47018 1.76393 -165.89217 321.61331
2635.0000 66 0 -166.27424 2.32356 1.73577 -166.35203 295.27831
2640.0000 66 0 -165.79941 2.80909 1.75057 -166.11039 308.79420
2645.0000 66 0 -166.21029 2.31110 1.74898 -166.13628 309.21314
2650.0000 66 0 -165.70998 2.80041 1.75262 -166.07689 314.89803
2655.0000 66 0 -166.59383 2.29873 1.73753 -166.32325 298.91853
2660.0000 66 0 -166.06321 2.90403 1.73927 -166.29498 300.68806
2665.0000 66 0 -166.36491 2.40158 1.77089 -165.77851 327.47062
2670.0000 66 0 -166.46027 2.28097 1.71534 -166.68572 280.02549
2675.0000 66 0 -166.90350 2.03803 1.73285 -166.39974 293.34983
2680.0000 66 0 -167.09748 2.21944 1.68183 -167.23297 247.79972
2685.0000 66 0 -166.73469 2.68672 1.71715 -166.65622 276.42175
2690.0000 66 0 -165.90339 3.08026 1.73510 -166.36298 291.45876
2695.0000 66 0 -165.87310 3.05628 1.76134 -165.93454 314.90103
2700.0000 66 0 -165.92125 2.84244 1.77311 -165.74230 333.56137
2705.0000 66 0 -166.48226 2.51218 1.74034 -166.27748 302.06542
2710.0000 66 0 -166.17119 2.92289 1.74535 -166.19562 307.05669
2715.0000 66 0 -166.05838 2.48539 1.76097 -165.94057 318.87377
2720.0000 66 0 -166.16422 2.10764 1.75206 -166.08597 310.23301
2725.0000 66 0 -166.23125 2.98982 1.74866 -166.14158 310.29718
2730.0000 66 0 -166.52911 2.52255 1.72881 -166.46576 298.29940
2735.0000 66 0 -166.40354 2.18919 1.72170 -166.58192 286.14805
2740.0000 66 0 -166.69966 2.22734 1.72327 -166.55614 288.36531
2745.0000 66 0 -166.82603 2.03771 1.71150 -166.74847 272.58517
2750.0000 66 0 -165.84562 2.74330 1.73504 -166.36390 297.42466
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.53001 -1.53720 1.30808
force_rgl> df(natom) 0.00000 0.00000 0.00000
2755.0000 67 0 -165.64324 3.59255 1.92263 -165.93391 338.19131
2760.0000 67 0 -167.38497 2.95028 1.87398 -166.73649 389.40668
2765.0000 67 0 -168.13713 3.04442 1.81019 -167.78886 346.09573
2770.0000 67 0 -168.43471 2.62927 1.77081 -168.43845 316.60344
2775.0000 67 0 -168.59157 3.19415 1.76160 -168.59040 312.62494
2780.0000 67 0 -168.62798 2.20679 1.76255 -168.57465 315.73028
2785.0000 67 0 -168.02010 2.98140 1.76757 -168.49184 318.08238
2790.0000 67 0 -168.43435 3.08335 1.76953 -168.45957 324.55640
2795.0000 67 0 -168.21407 2.57214 1.78121 -168.26679 333.19242
2800.0000 67 0 -168.69519 2.46008 1.76953 -168.45959 322.98487
2805.0000 67 0 -169.21850 2.39967 1.72801 -169.14439 282.86431
2810.0000 67 0 -169.02321 2.53127 1.72291 -169.22854 279.73656
2815.0000 67 0 -168.21986 2.82417 1.75394 -168.71665 304.22662
2820.0000 67 0 -168.49155 2.80027 1.77343 -168.39521 325.42466
2825.0000 67 0 -168.62476 2.50688 1.74811 -168.81295 302.91800
2830.0000 67 0 -168.42137 2.81089 1.77190 -168.42046 319.21484
2835.0000 67 0 -168.43753 2.71627 1.76825 -168.48065 321.59330
2840.0000 67 0 -168.73576 2.88047 1.75303 -168.73168 307.03248
2845.0000 67 0 -168.11453 2.93921 1.75971 -168.62151 316.37366
2850.0000 67 0 -168.85684 2.75070 1.76579 -168.52127 318.85752
2855.0000 67 0 -169.04365 2.32415 1.73572 -169.01727 292.66859
2860.0000 67 0 -168.71323 2.71577 1.75093 -168.76639 310.75718
2865.0000 67 0 -169.00701 2.21693 1.73078 -169.09871 288.31776
2870.0000 67 0 -169.05925 2.59940 1.73853 -168.97099 298.43872
2875.0000 67 0 -169.12226 2.61557 1.74472 -168.86887 303.72626
2880.0000 67 0 -168.54811 2.32931 1.74840 -168.80810 302.14921
2885.0000 67 0 -168.48980 2.71096 1.75806 -168.64868 307.34433
2890.0000 67 0 -168.19634 3.03646 1.77082 -168.43825 322.16415
2895.0000 67 0 -168.48383 2.26658 1.77507 -168.36819 321.84548
2900.0000 67 0 -168.25118 2.44101 1.75613 -168.68059 295.61201
2905.0000 67 0 -168.05519 2.38662 1.79064 -168.11123 326.00588
2910.0000 67 0 -167.99097 3.00115 1.80865 -167.81413 349.56989
2915.0000 67 0 -168.91871 2.39496 1.78151 -168.26185 332.91001
2920.0000 67 0 -169.10341 2.53945 1.74224 -168.90972 298.77423
2925.0000 67 0 -169.14323 2.38858 1.73229 -169.07382 285.53108
2930.0000 67 0 -169.24813 2.44424 1.73532 -169.02380 288.89480
2935.0000 67 0 -168.16674 2.78938 1.75371 -168.72053 307.36277
2940.0000 67 0 -168.63110 2.91179 1.76988 -168.45368 320.07031
2945.0000 67 0 -168.82755 2.02774 1.74442 -168.87369 298.13891
2950.0000 67 0 -169.08770 2.51582 1.74332 -168.89195 300.14683
2955.0000 67 0 -169.38937 2.33140 1.71843 -169.30245 276.38335
2960.0000 67 0 -168.71551 2.85177 1.74229 -168.90890 294.30994
2965.0000 67 0 -168.90654 2.39436 1.76032 -168.61145 314.12457
2970.0000 67 0 -168.94541 2.66423 1.73867 -168.96859 290.63222
2975.0000 67 0 -168.70005 2.47462 1.74904 -168.79753 303.89419
2980.0000 67 0 -168.33966 2.67000 1.74847 -168.80695 296.44168
2985.0000 67 0 -168.71044 2.47898 1.75341 -168.72544 306.49771
2990.0000 67 0 -168.73469 2.65701 1.75426 -168.71147 305.99110
2995.0000 67 0 -169.43861 2.28773 1.72662 -169.16743 282.39653
3000.0000 67 0 -168.70649 2.69844 1.73457 -169.03617 291.20229
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.97205 0.58226 -1.43045
force_rgl> df(natom) 0.00000 0.00000 0.00000
3005.0000 68 0 -168.24610 3.51041 1.91929 -168.62478 326.01240
3010.0000 68 0 -170.44232 3.00969 1.87435 -169.37353 377.47780
3015.0000 68 0 -170.74919 2.84124 1.77843 -170.97149 306.76849
3020.0000 68 0 -171.17795 2.34276 1.78188 -170.91409 319.83730
3025.0000 68 0 -171.08373 2.48443 1.77443 -171.03823 310.92775
3030.0000 68 0 -170.49491 2.74021 1.78737 -170.82265 319.46469
3035.0000 68 0 -171.11361 2.51925 1.79250 -170.73719 321.00739
3040.0000 68 0 -171.59822 2.72100 1.75409 -171.37710 291.43272
3045.0000 68 0 -171.68535 2.32821 1.74380 -171.54839 279.91795
3050.0000 68 0 -171.13961 3.00235 1.76221 -171.24169 301.98417
3055.0000 68 0 -172.18045 2.11526 1.75085 -171.43094 290.13437
3060.0000 68 0 -171.40655 2.65039 1.73515 -171.69254 277.85365
3065.0000 68 0 -171.11797 2.65669 1.75234 -171.40619 291.78424
3070.0000 68 0 -171.67943 2.52582 1.77254 -171.06968 299.41875
3075.0000 68 0 -171.20619 2.65194 1.75342 -171.38824 289.79426
3080.0000 68 0 -170.85942 3.11690 1.78225 -170.90791 316.51968
3085.0000 68 0 -170.62963 2.80506 1.78716 -170.82614 313.86391
3090.0000 68 0 -170.69842 2.92106 1.80086 -170.59785 329.10100
3095.0000 68 0 -171.23147 2.60086 1.78404 -170.87801 316.39582
3100.0000 68 0 -171.97791 2.21751 1.74658 -171.50208 282.60496
3105.0000 68 0 -171.64649 2.52488 1.74472 -171.53315 281.00192
3110.0000 68 0 -171.00725 2.65363 1.74899 -171.46206 285.16732
3115.0000 68 0 -170.99499 2.47247 1.75052 -171.43650 285.82127
3120.0000 68 0 -170.74508 2.65631 1.78710 -170.82703 319.63243
3125.0000 68 0 -170.66195 2.70970 1.80346 -170.55448 328.37465
3130.0000 68 0 -170.45110 3.15872 1.80077 -170.59929 324.23551
3135.0000 68 0 -170.49396 2.31955 1.80617 -170.50936 330.65661
3140.0000 68 0 -170.50292 2.76040 1.80285 -170.56463 332.90708
3145.0000 68 0 -171.12266 2.89770 1.76709 -171.16046 304.61991
3150.0000 68 0 -171.55365 2.61229 1.75858 -171.30219 297.91339
3155.0000 68 0 -171.33454 2.64003 1.75070 -171.43345 290.82352
3160.0000 68 0 -171.58535 2.67041 1.75551 -171.35343 293.30646
3165.0000 68 0 -171.55333 2.45806 1.74590 -171.51350 283.68116
3170.0000 68 0 -170.68607 2.33719 1.76868 -171.13390 302.75736
3175.0000 68 0 -170.24422 3.37769 1.80342 -170.55512 333.60957
3180.0000 68 0 -170.78579 2.87110 1.80637 -170.50600 337.24891
3185.0000 68 0 -171.26211 2.74103 1.76271 -171.23338 296.68844
3190.0000 68 0 -170.81099 3.01981 1.77134 -171.08972 302.26025
3195.0000 68 0 -171.09540 2.56771 1.77976 -170.94931 309.35057
3200.0000 68 0 -170.96656 2.85663 1.77545 -171.02122 304.28792
3205.0000 68 0 -170.99087 2.95219 1.77861 -170.96856 308.97763
3210.0000 68 0 -171.26419 2.49247 1.77738 -170.98899 308.44381
3215.0000 68 0 -171.54191 2.03648 1.74182 -171.58137 276.86302
3220.0000 68 0 -170.70011 2.95984 1.78658 -170.83573 316.07622
3225.0000 68 0 -170.97149 2.66031 1.79555 -170.68625 320.59964
3230.0000 68 0 -170.90735 2.74989 1.78615 -170.84286 315.05726
3235.0000 68 0 -171.51558 2.18157 1.74945 -171.45431 286.72605
3240.0000 68 0 -171.19112 2.72956 1.74754 -171.48613 283.89567
3245.0000 68 0 -170.91620 2.84449 1.78337 -170.88917 314.36190
3250.0000 68 0 -171.06026 2.48976 1.77271 -171.06684 304.62784
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -2.60719 0.07631 -2.51983
force_rgl> df(natom) 0.00000 0.00000 0.00000
3255.0000 69 0 -170.61882 4.00983 1.94210 -170.87829 320.43371
3260.0000 69 0 -172.60937 3.13348 1.89227 -171.71662 384.88041
3265.0000 69 0 -173.50207 2.63003 1.83017 -172.76129 347.50087
3270.0000 69 0 -174.07721 2.57605 1.77978 -173.60899 307.24223
3275.0000 69 0 -174.59346 2.16137 1.75274 -174.06391 283.60284
3280.0000 69 0 -173.29719 2.44249 1.75594 -174.01006 284.25303
3285.0000 69 0 -173.71682 2.48885 1.77888 -173.62425 304.67413
3290.0000 69 0 -174.30204 2.50307 1.75913 -173.95640 286.47846
3295.0000 69 0 -173.93529 2.27822 1.74814 -174.14140 278.30413
3300.0000 69 0 -173.90731 2.26423 1.75579 -174.01269 283.90407
3305.0000 69 0 -173.64091 2.50451 1.77888 -173.62417 308.23435
3310.0000 69 0 -173.13999 3.04809 1.77566 -173.67840 303.35910
3315.0000 69 0 -173.28283 2.69798 1.80417 -173.19877 327.11218
3320.0000 69 0 -173.88589 2.60460 1.79305 -173.38579 314.14106
3325.0000 69 0 -173.47950 2.97964 1.76010 -173.94015 288.01933
3330.0000 69 0 -174.22943 2.20874 1.76625 -173.83671 294.45021
3335.0000 69 0 -174.43628 2.33831 1.74456 -174.20159 273.26961
3340.0000 69 0 -173.83695 2.81307 1.74505 -174.19337 272.40618
3345.0000 69 0 -173.73906 3.03371 1.76322 -173.88757 292.38175
3350.0000 69 0 -173.99675 2.73544 1.76716 -173.82131 294.77011
3355.0000 69 0 -174.29212 2.21723 1.74217 -174.24174 267.18316
3360.0000 69 0 -173.99082 2.42662 1.77356 -173.71368 302.78954
3365.0000 69 0 -173.97131 2.54233 1.76087 -173.92711 284.98176
3370.0000 69 0 -173.00968 3.23051 1.78558 -173.51153 311.01123
3375.0000 69 0 -174.05440 2.29111 1.77887 -173.62437 302.54316
3380.0000 69 0 -174.02855 2.08513 1.74764 -174.14978 274.10603
3385.0000 69 0 -173.59335 2.75455 1.76631 -173.83564 294.98512
3390.0000 69 0 -173.82365 3.07765 1.75421 -174.03915 284.09242
3395.0000 69 0 -173.84342 2.30250 1.77440 -173.69958 301.14099
3400.0000 69 0 -174.02967 2.34436 1.77121 -173.75313 291.92236
3405.0000 69 0 -172.94970 2.55400 1.77192 -173.74135 288.33755
3410.0000 69 0 -173.40774 2.87370 1.79340 -173.37992 306.41042
3415.0000 69 0 -173.64893 2.41083 1.78246 -173.56390 298.29652
3420.0000 69 0 -173.29271 2.98102 1.78921 -173.45035 306.31736
3425.0000 69 0 -173.43224 2.82859 1.77850 -173.63057 301.10606
3430.0000 69 0 -173.87232 2.48677 1.76749 -173.81581 300.31042
3435.0000 69 0 -173.80889 2.83159 1.78824 -173.46676 317.45660
3440.0000 69 0 -173.94454 2.82773 1.77483 -173.69230 304.82612
3445.0000 69 0 -173.92406 2.58675 1.76311 -173.88948 292.49682
3450.0000 69 0 -174.20826 2.64594 1.76022 -173.93815 290.37282
3455.0000 69 0 -173.36603 2.96778 1.77144 -173.74937 301.70529
3460.0000 69 0 -173.49795 2.61736 1.79101 -173.42017 319.39238
3465.0000 69 0 -173.35811 2.70836 1.79498 -173.35333 323.02376
3470.0000 69 0 -174.18166 2.46670 1.77824 -173.63493 310.56177
3475.0000 69 0 -173.87399 2.75753 1.76923 -173.78647 293.80322
3480.0000 69 0 -174.14037 2.59362 1.75225 -174.07209 283.85996
3485.0000 69 0 -174.28545 2.30318 1.75502 -174.02558 294.34103
3490.0000 69 0 -174.45472 2.48484 1.75043 -174.10276 293.71614
3495.0000 69 0 -173.62449 2.37234 1.74059 -174.26832 283.72599
3500.0000 69 0 -173.76621 2.52606 1.76917 -173.78754 305.67142
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.23164 0.48507 -2.35687
force_rgl> df(natom) 0.00000 0.00000 0.00000
3505.0000 70 0 -173.97587 3.70481 1.92335 -173.83187 317.67253
3510.0000 70 0 -174.82102 3.51466 1.87648 -174.62803 383.39924
3515.0000 70 0 -176.18539 3.17326 1.82880 -175.43784 352.90659
3520.0000 70 0 -176.63538 2.49905 1.77615 -176.33205 309.94428
3525.0000 70 0 -176.48103 2.58062 1.76167 -176.57799 297.78447
3530.0000 70 0 -176.74477 2.27586 1.77495 -176.35247 310.18885
3535.0000 70 0 -176.56744 2.59602 1.76346 -176.54762 299.49696
3540.0000 70 0 -176.63585 2.45411 1.75327 -176.72077 286.98972
3545.0000 70 0 -177.05910 2.25061 1.74503 -176.86066 282.57898
3550.0000 70 0 -176.44436 2.57066 1.75499 -176.69145 296.78709
3555.0000 70 0 -176.81379 2.21649 1.77186 -176.40493 308.58715
3560.0000 70 0 -176.13064 2.88558 1.76268 -176.56084 296.47751
3565.0000 70 0 -176.37811 2.98097 1.77500 -176.35166 316.07144
3570.0000 70 0 -175.87210 2.97993 1.78702 -176.14751 325.32705
3575.0000 70 0 -176.77161 2.26007 1.77555 -176.34237 306.72631
3580.0000 70 0 -176.31391 2.98776 1.77600 -176.33459 305.43700
3585.0000 70 0 -176.30364 2.84839 1.77816 -176.29789 317.18256
3590.0000 70 0 -176.23438 2.61580 1.78548 -176.17362 324.27056
3595.0000 70 0 -176.57023 2.79203 1.76892 -176.45493 309.46336
3600.0000 70 0 -176.55995 2.90180 1.76704 -176.48679 310.39222
3605.0000 70 0 -176.42117 2.60808 1.76168 -176.57789 302.84052
3610.0000 70 0 -177.07752 2.49242 1.73887 -176.96536 282.29975
3615.0000 70 0 -176.50299 2.64046 1.75819 -176.63720 297.16910
3620.0000 70 0 -176.61606 2.67142 1.76724 -176.48346 302.37610
3625.0000 70 0 -176.39243 3.24247 1.76634 -176.49866 307.04708
3630.0000 70 0 -176.62684 2.53638 1.76124 -176.58531 307.00270
3635.0000 70 0 -175.73753 2.92312 1.79021 -176.09336 329.41332
3640.0000 70 0 -176.17749 2.68512 1.81608 -175.65392 351.73510
3645.0000 70 0 -176.39634 2.72566 1.78983 -176.09970 327.81056
3650.0000 70 0 -176.88646 2.63650 1.76651 -176.49590 309.34915
3655.0000 70 0 -176.50635 2.78413 1.76329 -176.55046 307.88038
3660.0000 70 0 -176.57711 3.04773 1.74939 -176.78658 293.29797
3665.0000 70 0 -176.51125 2.72126 1.74969 -176.78149 291.13028
3670.0000 70 0 -175.87556 3.05347 1.77005 -176.43569 311.22981
3675.0000 70 0 -175.90205 2.82621 1.80874 -175.77857 344.70240
3680.0000 70 0 -177.51102 2.26336 1.74675 -176.83141 287.20811
3685.0000 70 0 -176.52512 2.59680 1.71404 -177.38702 260.86194
3690.0000 70 0 -176.60302 2.74343 1.76168 -176.57788 305.21548
3695.0000 70 0 -177.34982 2.36782 1.74489 -176.86308 289.63528
3700.0000 70 0 -176.92770 2.56811 1.72227 -177.24719 267.59340
3705.0000 70 0 -176.52434 2.85114 1.73127 -177.09445 276.70834
3710.0000 70 0 -175.95911 2.98935 1.78539 -176.17513 323.60461
3715.0000 70 0 -176.01791 3.01838 1.79004 -176.09616 328.25776
3720.0000 70 0 -176.87319 2.75017 1.76950 -176.44500 311.06798
3725.0000 70 0 -177.13975 2.60442 1.74849 -176.80187 291.79200
3730.0000 70 0 -177.04428 2.50658 1.73265 -177.07103 276.42771
3735.0000 70 0 -176.81615 2.58088 1.75050 -176.76785 294.34168
3740.0000 70 0 -176.84181 2.57335 1.74493 -176.86233 293.21150
3745.0000 70 0 -176.68345 2.69805 1.75530 -176.68623 294.92768
3750.0000 70 0 -176.32267 2.74133 1.74811 -176.80835 291.10000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.61498 2.71521 0.25858
force_rgl> df(natom) 0.00000 0.00000 0.00000
3755.0000 71 0 -176.52015 3.63475 1.93902 -176.20289 335.02791
3760.0000 71 0 -178.48425 3.02560 1.86636 -177.44867 372.35430
3765.0000 71 0 -178.60751 2.73709 1.79147 -178.73284 301.49120
3770.0000 71 0 -179.24780 2.58336 1.76104 -179.25456 282.18964
3775.0000 71 0 -179.10464 2.37441 1.75860 -179.29632 278.44651
3780.0000 71 0 -178.74076 2.45502 1.79323 -178.70269 310.77333
3785.0000 71 0 -178.47683 3.17714 1.80862 -178.43868 323.39235
3790.0000 71 0 -178.46357 2.70123 1.80933 -178.42659 305.25434
3795.0000 71 0 -178.83286 2.65483 1.79136 -178.73463 295.49641
3800.0000 71 0 -178.95150 2.35459 1.78626 -178.82213 294.44363
3805.0000 71 0 -178.85817 2.61011 1.79096 -178.74160 298.71531
3810.0000 71 0 -178.64311 3.03083 1.77493 -179.01641 284.91459
3815.0000 71 0 -178.69443 2.55888 1.79629 -178.65006 307.90401
3820.0000 71 0 -178.80279 2.88880 1.80833 -178.44362 316.76098
3825.0000 71 0 -178.59622 2.38955 1.78511 -178.84183 296.92381
3830.0000 71 0 -178.57504 2.74535 1.79976 -178.59072 305.98250
3835.0000 71 0 -178.25264 2.90924 1.80360 -178.52475 310.44934
3840.0000 71 0 -178.73134 2.91999 1.79986 -178.58893 307.59932
3845.0000 71 0 -178.84357 2.69158 1.79159 -178.73079 298.84267
3850.0000 71 0 -178.81943 2.85493 1.78482 -178.84675 295.21409
3855.0000 71 0 -178.42135 2.52575 1.80313 -178.53292 307.95802
3860.0000 71 0 -178.56140 2.84539 1.80519 -178.49757 312.38089
3865.0000 71 0 -178.89034 2.58945 1.79529 -178.66735 302.73249
3870.0000 71 0 -178.47179 2.91560 1.80586 -178.48609 309.01557
3875.0000 71 0 -178.58020 2.80623 1.79771 -178.62572 292.56696
3880.0000 71 0 -178.54432 2.83078 1.79445 -178.68170 292.45523
3885.0000 71 0 -178.68537 2.58218 1.79940 -178.59684 302.94825
3890.0000 71 0 -178.29870 2.81910 1.79486 -178.67471 299.30013
3895.0000 71 0 -178.15118 3.28135 1.82552 -178.14891 323.76927
3900.0000 71 0 -178.13918 2.22583 1.81719 -178.29180 313.79842
3905.0000 71 0 -178.27554 3.04480 1.80996 -178.41581 313.99622
3910.0000 71 0 -178.16305 3.04185 1.83163 -178.04417 329.94793
3915.0000 71 0 -178.67637 2.79137 1.81780 -178.28130 318.23990
3920.0000 71 0 -178.49080 3.21710 1.80312 -178.53307 317.12842
3925.0000 71 0 -179.16611 2.37986 1.77960 -178.93628 307.02871
3930.0000 71 0 -178.72596 2.79252 1.78383 -178.86375 307.68936
3935.0000 71 0 -178.60409 2.77939 1.80073 -178.57407 322.28161
3940.0000 71 0 -178.31816 2.98861 1.79660 -178.64490 318.34538
3945.0000 71 0 -179.01797 2.64560 1.79170 -178.72892 313.96297
3950.0000 71 0 -178.75121 2.82734 1.76792 -179.13667 292.83807
3955.0000 71 0 -178.77664 2.87780 1.77812 -178.96172 301.96672
3960.0000 71 0 -178.33256 2.96389 1.79218 -178.72069 318.93061
3965.0000 71 0 -178.05854 3.07319 1.80333 -178.52941 328.09127
3970.0000 71 0 -179.05195 2.63149 1.78721 -178.80577 312.77877
3975.0000 71 0 -179.37871 2.43420 1.77430 -179.02723 301.02634
3980.0000 71 0 -179.61030 2.21523 1.74826 -179.47365 278.48897
3985.0000 71 0 -179.17713 2.63741 1.74828 -179.47341 271.56341
3990.0000 71 0 -178.80545 2.23437 1.76811 -179.13337 290.03800
3995.0000 71 0 -178.81024 2.68737 1.78550 -178.83515 311.39416
4000.0000 71 0 -178.54414 2.81008 1.80419 -178.51466 327.83985
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 3.17210 -0.71275 -1.28361
force_rgl> df(natom) 0.00000 0.00000 0.00000
4005.0000 72 0 -178.42681 4.10609 1.96202 -178.44332 345.61604
4010.0000 72 0 -180.58103 3.00749 1.88036 -179.85660 391.99819
4015.0000 72 0 -180.94430 2.89188 1.82710 -180.77841 342.66710
4020.0000 72 0 -181.00472 2.86626 1.79444 -181.34362 308.48391
4025.0000 72 0 -181.97267 2.38923 1.78029 -181.58856 303.60417
4030.0000 72 0 -181.71006 3.02215 1.76522 -181.84932 293.33184
4035.0000 72 0 -181.56070 2.61602 1.77112 -181.74727 297.90411
4040.0000 72 0 -181.58641 2.62775 1.76888 -181.78603 295.50824
4045.0000 72 0 -181.51215 2.66099 1.77865 -181.61692 303.43004
4050.0000 72 0 -180.82470 3.19193 1.81119 -181.05376 331.85527
4055.0000 72 0 -181.89131 2.66923 1.79589 -181.31862 320.93771
4060.0000 72 0 -181.56828 2.78824 1.77568 -181.66837 302.75485
4065.0000 72 0 -181.79199 2.62950 1.78318 -181.53852 309.00531
4070.0000 72 0 -181.48420 2.83882 1.76640 -181.82884 297.60427
4075.0000 72 0 -181.42339 2.92258 1.78467 -181.51270 314.29087
4080.0000 72 0 -181.96339 2.45610 1.77247 -181.72386 300.76929
4085.0000 72 0 -181.21193 3.07676 1.77601 -181.66262 304.53936
4090.0000 72 0 -181.51745 2.72580 1.78426 -181.51980 309.84320
4095.0000 72 0 -181.79505 2.88648 1.77181 -181.73525 297.91030
4100.0000 72 0 -181.64265 2.69350 1.76615 -181.83333 296.58362
4105.0000 72 0 -181.23689 3.35890 1.78284 -181.54432 314.12123
4110.0000 72 0 -182.03605 2.69173 1.77779 -181.63180 307.43738
4115.0000 72 0 -182.01987 2.73070 1.75638 -182.00230 286.28980
4120.0000 72 0 -181.93591 2.84994 1.75737 -181.98525 288.75052
4125.0000 72 0 -180.56253 3.33633 1.81146 -181.04901 335.60711
4130.0000 72 0 -181.38969 3.04088 1.80397 -181.17869 327.19523
4135.0000 72 0 -181.49837 3.03920 1.78251 -181.55003 314.54768
4140.0000 72 0 -181.60847 2.41383 1.76600 -181.83591 295.47450
4145.0000 72 0 -181.57478 2.81286 1.77294 -181.71572 300.60499
4150.0000 72 0 -182.32234 2.37298 1.76789 -181.80308 291.47411
4155.0000 72 0 -181.26518 3.02846 1.77645 -181.65496 304.45063
4160.0000 72 0 -181.70779 2.75350 1.78459 -181.51413 315.63787
4165.0000 72 0 -181.89102 2.54891 1.77819 -181.62488 305.06222
4170.0000 72 0 -181.99490 2.72500 1.75392 -182.04484 282.92263
4175.0000 72 0 -181.73896 2.77895 1.76624 -181.83169 292.33169
4180.0000 72 0 -181.24990 3.16350 1.76552 -181.84409 291.11106
4185.0000 72 0 -181.25264 2.75765 1.80431 -181.17280 323.62527
4190.0000 72 0 -181.59388 2.74497 1.79024 -181.41635 318.79018
4195.0000 72 0 -182.24381 2.27489 1.77003 -181.76613 296.21842
4200.0000 72 0 -181.68463 2.82469 1.76104 -181.92163 289.23768
4205.0000 72 0 -181.09002 2.52561 1.78034 -181.58760 309.14227
4210.0000 72 0 -181.51606 2.91536 1.80604 -181.14284 326.51988
4215.0000 72 0 -182.01104 2.57141 1.78323 -181.53758 308.31670
4220.0000 72 0 -182.87451 2.25671 1.73221 -182.42067 262.57501
4225.0000 72 0 -182.60746 2.01259 1.72922 -182.47241 258.79952
4230.0000 72 0 -181.50983 2.89030 1.74663 -182.17107 277.65646
4235.0000 72 0 -182.31402 2.58046 1.76683 -181.82148 295.23296
4240.0000 72 0 -182.04676 2.57379 1.75223 -182.07424 284.28578
4245.0000 72 0 -181.73115 2.80435 1.74667 -182.17031 278.96977
4250.0000 72 0 -182.35822 2.69288 1.74471 -182.20428 277.38371
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.13023 0.93041 0.49459
force_rgl> df(natom) 0.00000 0.00000 0.00000
4255.0000 73 0 -181.66392 3.73012 1.91248 -181.94493 299.40124
4260.0000 73 0 -183.05385 3.00741 1.88652 -182.39845 384.13372
4265.0000 73 0 -183.27993 3.58275 1.83785 -183.24852 341.80317
4270.0000 73 0 -183.03927 3.02196 1.85487 -182.95117 352.79412
4275.0000 73 0 -183.52321 3.10327 1.83506 -183.29719 342.03806
4280.0000 73 0 -183.45663 3.25324 1.81570 -183.63535 327.02185
4285.0000 73 0 -184.08377 2.76762 1.80181 -183.87796 308.13724
4290.0000 73 0 -183.85478 2.68963 1.78777 -184.12321 290.42716
4295.0000 73 0 -184.24490 2.83394 1.80042 -183.90223 313.76875
4300.0000 73 0 -184.73067 2.47009 1.76624 -184.49932 287.85035
4305.0000 73 0 -183.94614 2.80488 1.77740 -184.30431 296.24897
4310.0000 73 0 -183.93988 3.01761 1.79788 -183.94665 317.31902
4315.0000 73 0 -183.61954 2.70212 1.79684 -183.96490 319.73771
4320.0000 73 0 -184.11103 2.90446 1.79937 -183.92064 319.16194
4325.0000 73 0 -183.52274 3.26364 1.79473 -184.00161 319.17750
4330.0000 73 0 -184.34679 3.13092 1.80110 -183.89049 323.14695
4335.0000 73 0 -184.40963 2.64384 1.77263 -184.38776 296.59547
4340.0000 73 0 -184.71534 2.59072 1.75534 -184.68962 280.56303
4345.0000 73 0 -183.50404 3.42534 1.80233 -183.86884 319.18933
4350.0000 73 0 -184.30105 2.82820 1.81597 -183.63068 334.38320
4355.0000 73 0 -184.34162 2.82553 1.77531 -184.34088 297.72855
4360.0000 73 0 -184.25561 2.95512 1.78576 -184.15835 305.98219
4365.0000 73 0 -184.26488 2.82440 1.76762 -184.47525 292.29002
4370.0000 73 0 -183.97883 2.59573 1.77112 -184.41414 295.62503
4375.0000 73 0 -184.06833 3.06547 1.78320 -184.20315 302.68077
4380.0000 73 0 -184.75321 2.73606 1.78915 -184.09915 310.61742
4385.0000 73 0 -184.26378 3.18741 1.76204 -184.57275 287.87090
4390.0000 73 0 -183.66692 3.39910 1.80395 -183.84055 320.95443
4395.0000 73 0 -184.28412 2.92542 1.78877 -184.10576 307.97091
4400.0000 73 0 -184.45290 2.65411 1.77882 -184.27956 300.64823
4405.0000 73 0 -183.48414 3.05832 1.79475 -184.00137 316.10062
4410.0000 73 0 -184.39921 2.71716 1.77055 -184.42396 292.79290
4415.0000 73 0 -184.57736 2.68580 1.76297 -184.55646 287.91408
4420.0000 73 0 -184.97283 2.67404 1.74704 -184.83459 273.41321
4425.0000 73 0 -184.59480 2.71310 1.74189 -184.92466 272.63694
4430.0000 73 0 -184.24483 2.82556 1.78771 -184.12422 307.06262
4435.0000 73 0 -184.50363 2.49569 1.77795 -184.29468 299.01923
4440.0000 73 0 -184.36895 2.54043 1.77144 -184.40847 293.02772
4445.0000 73 0 -184.07907 3.01358 1.76723 -184.48203 291.27472
4450.0000 73 0 -183.90270 2.87903 1.79403 -184.01387 312.04580
4455.0000 73 0 -183.64310 3.19795 1.81787 -183.59754 330.48795
4460.0000 73 0 -184.23400 2.99853 1.79886 -183.92957 328.49282
4465.0000 73 0 -184.79267 2.83554 1.76908 -184.44963 309.38299
4470.0000 73 0 -184.96364 2.92469 1.75752 -184.65156 299.11610
4475.0000 73 0 -185.10655 2.71973 1.73658 -185.01743 280.48776
4480.0000 73 0 -184.88483 2.60382 1.73681 -185.01332 279.61023
4485.0000 73 0 -183.88324 3.27073 1.78777 -184.12322 323.77159
4490.0000 73 0 -183.68329 2.77951 1.79600 -183.97947 331.75962
4495.0000 73 0 -183.90661 2.81275 1.80740 -183.78032 335.87172
4500.0000 73 0 -184.42744 3.05810 1.77888 -184.27859 315.03147
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.64261 -0.34502 1.92961
force_rgl> df(natom) 0.00000 0.00000 0.00000
4505.0000 74 0 -184.46854 3.46880 1.93347 -184.22066 330.31709
4510.0000 74 0 -186.21458 3.11568 1.86457 -185.43500 370.02759
4515.0000 74 0 -186.32394 3.24310 1.82427 -186.14545 331.13609
4520.0000 74 0 -186.76534 2.67898 1.81526 -186.30416 329.87894
4525.0000 74 0 -186.74729 3.02628 1.80887 -186.41680 318.12139
4530.0000 74 0 -186.70928 3.12060 1.78905 -186.76614 304.18080
4535.0000 74 0 -187.03404 3.00904 1.78391 -186.85683 297.35152
4540.0000 74 0 -186.89536 2.49675 1.77832 -186.95522 295.53038
4545.0000 74 0 -186.69967 2.83489 1.77860 -186.95033 295.85352
4550.0000 74 0 -187.03899 2.73908 1.79519 -186.65800 306.95429
4555.0000 74 0 -186.49960 3.01174 1.79151 -186.72279 305.41906
4560.0000 74 0 -186.59131 3.12061 1.79779 -186.61209 312.59732
4565.0000 74 0 -187.00213 2.65517 1.78663 -186.80879 299.81053
4570.0000 74 0 -186.81482 2.93749 1.78159 -186.89762 295.30639
4575.0000 74 0 -187.32979 2.61511 1.76915 -187.11689 283.98205
4580.0000 74 0 -186.74531 3.08231 1.76532 -187.18442 284.46955
4585.0000 74 0 -186.48125 2.91428 1.80341 -186.51312 313.49476
4590.0000 74 0 -186.57318 2.70813 1.79974 -186.57781 313.02189
4595.0000 74 0 -186.31613 3.13945 1.81929 -186.23313 329.95967
4600.0000 74 0 -186.69126 2.95583 1.79420 -186.67543 309.00101
4605.0000 74 0 -186.87577 2.79910 1.80698 -186.45009 317.67523
4610.0000 74 0 -187.01347 2.80415 1.78614 -186.81736 302.08272
4615.0000 74 0 -186.70420 2.93324 1.77040 -187.09495 286.24592
4620.0000 74 0 -186.97150 2.47269 1.77790 -186.96262 290.34839
4625.0000 74 0 -186.55881 3.01971 1.79424 -186.67462 315.84750
4630.0000 74 0 -186.64846 3.27773 1.77548 -187.00527 305.89187
4635.0000 74 0 -186.43164 3.09741 1.80234 -186.53188 327.83398
4640.0000 74 0 -186.69596 3.48215 1.80286 -186.52274 327.10907
4645.0000 74 0 -187.17460 2.63986 1.76566 -187.17849 295.39790
4650.0000 74 0 -187.68017 2.62667 1.74992 -187.45588 279.94433
4655.0000 74 0 -187.27477 2.77349 1.75229 -187.41416 282.95861
4660.0000 74 0 -187.65879 2.49007 1.76033 -187.27245 291.76624
4665.0000 74 0 -186.42258 3.74599 1.77468 -187.01944 304.61505
4670.0000 74 0 -186.65950 3.08069 1.79834 -186.60245 323.75216
4675.0000 74 0 -186.74174 2.83097 1.79414 -186.67649 323.33274
4680.0000 74 0 -187.03884 3.26000 1.78590 -186.82166 317.07623
4685.0000 74 0 -187.12912 2.75043 1.76686 -187.15735 296.05181
4690.0000 74 0 -187.29897 2.99073 1.76194 -187.24392 293.93843
4695.0000 74 0 -187.10461 2.53430 1.77494 -187.01485 304.52014
4700.0000 74 0 -187.13878 2.90650 1.76506 -187.18906 292.85804
4705.0000 74 0 -187.52449 2.89258 1.75811 -187.31149 288.59532
4710.0000 74 0 -187.24448 2.56907 1.73875 -187.65268 270.08658
4715.0000 74 0 -187.00364 2.84325 1.76632 -187.16677 294.82921
4720.0000 74 0 -187.34587 3.07087 1.77387 -187.03378 299.72842
4725.0000 74 0 -187.17799 2.67055 1.75339 -187.39466 285.17899
4730.0000 74 0 -187.09177 2.90329 1.77842 -186.95357 309.33778
4735.0000 74 0 -186.34422 3.18097 1.78886 -186.76944 316.17592
4740.0000 74 0 -186.25909 3.14385 1.81234 -186.35570 332.47124
4745.0000 74 0 -186.99153 2.87714 1.78444 -186.84734 310.02246
4750.0000 74 0 -187.53599 2.83368 1.75724 -187.32692 282.55570
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.30848 1.10591 -0.43517
force_rgl> df(natom) 0.00000 0.00000 0.00000
4755.0000 75 0 -186.86791 3.80094 1.91265 -187.23457 305.58256
4760.0000 75 0 -188.29056 3.64588 1.87571 -187.89146 361.45308
4765.0000 75 0 -189.37691 3.05173 1.82143 -188.85681 320.64853
4770.0000 75 0 -188.95631 3.12019 1.81745 -188.92761 331.43578
4775.0000 75 0 -189.51369 2.81296 1.79471 -189.33200 312.20671
4780.0000 75 0 -189.54048 3.07626 1.78712 -189.46698 306.24637
4785.0000 75 0 -189.34192 2.56680 1.80192 -189.20384 318.65297
4790.0000 75 0 -189.92616 3.02563 1.78310 -189.53847 295.37863
4795.0000 75 0 -190.08539 2.67598 1.75361 -190.06305 276.35433
4800.0000 75 0 -190.09074 2.81347 1.74985 -190.12985 276.34497
4805.0000 75 0 -189.90686 2.76049 1.74992 -190.12868 275.84462
4810.0000 75 0 -189.09794 2.53051 1.78435 -189.51621 304.43146
4815.0000 75 0 -189.51818 2.80785 1.80072 -189.22523 321.01235
4820.0000 75 0 -188.73745 3.39665 1.80307 -189.18331 317.41675
4825.0000 75 0 -189.63164 3.29469 1.81523 -188.96716 332.22346
4830.0000 75 0 -189.59292 3.08930 1.78306 -189.53929 308.43874
4835.0000 75 0 -190.67356 2.25661 1.75916 -189.96428 287.56686
4840.0000 75 0 -189.49266 3.13569 1.75401 -190.05579 286.54722
4845.0000 75 0 -189.99513 2.68034 1.76526 -189.85587 290.92484
4850.0000 75 0 -189.23700 2.95090 1.77084 -189.75663 300.32436
4855.0000 75 0 -190.02144 2.50481 1.76176 -189.91811 293.30806
4860.0000 75 0 -189.26484 2.95932 1.77538 -189.67581 304.77386
4865.0000 75 0 -189.19565 2.92500 1.79895 -189.25668 322.43900
4870.0000 75 0 -189.44361 3.14008 1.78888 -189.43574 309.74643
4875.0000 75 0 -189.69374 2.89126 1.77707 -189.64569 304.19046
4880.0000 75 0 -189.26830 3.27277 1.79724 -189.28712 320.11373
4885.0000 75 0 -189.63676 2.61696 1.79354 -189.35287 319.15837
4890.0000 75 0 -189.14922 3.00483 1.78579 -189.49062 312.21863
4895.0000 75 0 -189.87635 2.60088 1.76926 -189.78457 296.31929
4900.0000 75 0 -189.99048 2.89879 1.76327 -189.89111 287.63120
4905.0000 75 0 -189.77890 2.82556 1.80148 -189.21172 323.00465
4910.0000 75 0 -189.71979 2.98800 1.76226 -189.90914 290.46314
4915.0000 75 0 -189.76799 2.62029 1.77082 -189.75699 296.81084
4920.0000 75 0 -189.38500 3.12079 1.77415 -189.69768 300.12108
4925.0000 75 0 -189.82684 2.76345 1.76033 -189.94343 287.47251
4930.0000 75 0 -189.88627 2.55061 1.77216 -189.73315 298.31316
4935.0000 75 0 -190.05992 2.73135 1.76670 -189.83018 292.26030
4940.0000 75 0 -189.84785 2.82457 1.76350 -189.88709 289.44063
4945.0000 75 0 -189.81718 2.89376 1.78287 -189.54261 308.07237
4950.0000 75 0 -190.22000 2.50458 1.76133 -189.92564 291.19982
4955.0000 75 0 -189.07049 2.61741 1.77057 -189.76131 288.03796
4960.0000 75 0 -188.53319 3.39494 1.81476 -188.97539 329.02058
4965.0000 75 0 -189.42399 2.70264 1.80373 -189.17164 322.36288
4970.0000 75 0 -189.63629 2.89316 1.79600 -189.30914 317.73059
4975.0000 75 0 -189.83874 2.52185 1.75818 -189.98165 285.48664
4980.0000 75 0 -189.81639 2.56305 1.75536 -190.03183 279.95917
4985.0000 75 0 -189.66327 2.48207 1.77482 -189.68580 297.13079
4990.0000 75 0 -189.17835 3.44553 1.78003 -189.59310 299.58576
4995.0000 75 0 -189.24318 2.77794 1.79377 -189.34876 319.13305
5000.0000 75 0 -189.93564 2.56864 1.77315 -189.71548 296.11689
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.15030 0.86016 2.23020
force_rgl> df(natom) 0.00000 0.00000 0.00000
5005.0000 76 0 -190.42075 3.23797 1.89297 -190.23592 288.47707
5010.0000 76 0 -191.82923 2.92079 1.84613 -191.07637 335.16572
5015.0000 76 0 -191.17932 3.09673 1.81535 -191.62864 312.29519
5020.0000 76 0 -191.54433 2.90600 1.82631 -191.43193 326.59135
5025.0000 76 0 -191.96380 2.95002 1.81066 -191.71273 314.57765
5030.0000 76 0 -191.75965 2.91972 1.80662 -191.78523 312.84245
5035.0000 76 0 -191.73800 2.46099 1.80049 -191.89531 304.10043
5040.0000 76 0 -192.10605 3.10283 1.79325 -192.02520 298.91125
5045.0000 76 0 -192.07067 3.05055 1.80625 -191.79181 309.99626
5050.0000 76 0 -191.76073 2.81978 1.79531 -191.98821 301.91906
5055.0000 76 0 -191.61140 2.92076 1.81139 -191.69965 315.32394
5060.0000 76 0 -192.09880 2.63335 1.79007 -192.08213 295.89714
5065.0000 76 0 -192.42316 2.72393 1.77147 -192.41597 282.48074
5070.0000 76 0 -192.36705 2.73068 1.78051 -192.25376 286.70734
5075.0000 76 0 -191.96193 2.42299 1.79798 -191.94029 303.34510
5080.0000 76 0 -191.99683 2.52944 1.79709 -191.95623 295.77030
5085.0000 76 0 -191.81347 2.88880 1.80374 -191.83702 298.03628
5090.0000 76 0 -191.41023 3.20779 1.84224 -191.14607 334.31592
5095.0000 76 0 -192.79092 2.58151 1.79630 -191.97045 305.88764
5100.0000 76 0 -191.66285 2.75397 1.78257 -192.21669 289.08071
5105.0000 76 0 -191.31064 3.01085 1.80986 -191.72711 312.08190
5110.0000 76 0 -192.06215 3.28415 1.80372 -191.83728 305.77223
5115.0000 76 0 -192.20409 2.80511 1.77306 -192.38741 281.69809
5120.0000 76 0 -192.19656 2.66855 1.78544 -192.16528 292.90904
5125.0000 76 0 -191.90660 3.08711 1.78981 -192.08679 293.46902
5130.0000 76 0 -191.35029 2.76003 1.81753 -191.58951 320.36359
5135.0000 76 0 -191.66248 3.12495 1.81931 -191.55761 319.71006
5140.0000 76 0 -191.86118 2.76244 1.79317 -192.02658 294.57954
5145.0000 76 0 -192.12429 2.80023 1.77927 -192.27606 289.03629
5150.0000 76 0 -191.57422 3.32234 1.79768 -191.94570 302.21516
5155.0000 76 0 -191.28184 3.25520 1.82448 -191.46486 325.32683
5160.0000 76 0 -191.10272 2.97788 1.84705 -191.05990 335.86418
5165.0000 76 0 -192.42617 2.50146 1.80578 -191.80042 304.10751
5170.0000 76 0 -192.29579 2.90636 1.77707 -192.31537 282.33510
5175.0000 76 0 -192.62318 2.54277 1.77011 -192.44025 278.61013
5180.0000 76 0 -192.20354 2.85033 1.77357 -192.37823 282.94780
5185.0000 76 0 -192.02006 2.78297 1.79584 -191.97863 306.97894
5190.0000 76 0 -192.00411 2.95072 1.78276 -192.21335 290.44125
5195.0000 76 0 -191.61207 2.92629 1.80002 -191.90372 314.24419
5200.0000 76 0 -191.54527 3.54853 1.82232 -191.50360 334.72539
5205.0000 76 0 -191.38551 3.32485 1.81370 -191.65821 318.67113
5210.0000 76 0 -192.27126 2.68108 1.79803 -191.93940 308.02448
5215.0000 76 0 -192.19374 2.83323 1.78029 -192.25769 290.09822
5220.0000 76 0 -192.60407 2.72761 1.77035 -192.43594 281.35632
5225.0000 76 0 -192.77763 2.21775 1.74956 -192.80904 260.47735
5230.0000 76 0 -192.38365 2.96804 1.76802 -192.47778 279.66118
5235.0000 76 0 -192.24350 2.78024 1.78413 -192.18879 297.27441
5240.0000 76 0 -192.18480 2.69574 1.77701 -192.31650 295.27203
5245.0000 76 0 -192.03002 3.21555 1.79790 -191.94170 309.89798
5250.0000 76 0 -191.34890 3.52809 1.80658 -191.78600 322.00223
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.27310 -1.22164 -3.25068
force_rgl> df(natom) 0.00000 0.00000 0.00000
5255.0000 77 0 -192.95440 3.11045 1.95355 -191.79224 324.53654
5260.0000 77 0 -193.81427 3.22269 1.87047 -193.29586 359.63687
5265.0000 77 0 -194.25662 3.07373 1.83638 -193.91292 333.15877
5270.0000 77 0 -194.48197 3.24239 1.80174 -194.53990 305.84749
5275.0000 77 0 -193.79295 3.54176 1.82356 -194.14495 325.91976
5280.0000 77 0 -195.03488 2.74536 1.81195 -194.35510 313.06167
5285.0000 77 0 -194.22977 3.12723 1.80414 -194.49640 301.97239
5290.0000 77 0 -194.80635 2.95302 1.81102 -194.37182 315.72863
5295.0000 77 0 -194.53635 2.80700 1.77855 -194.95959 287.81607
5300.0000 77 0 -194.78610 3.24797 1.79676 -194.62996 303.52175
5305.0000 77 0 -194.78941 2.96822 1.78894 -194.77146 297.13631
5310.0000 77 0 -194.26953 3.11511 1.81347 -194.32750 315.94881
5315.0000 77 0 -194.46496 3.03923 1.81571 -194.28709 318.12066
5320.0000 77 0 -194.24473 3.18436 1.81591 -194.28336 317.39560
5325.0000 77 0 -193.62552 3.20876 1.81977 -194.21354 312.43580
5330.0000 77 0 -194.18466 3.32904 1.83199 -193.99238 330.08503
5335.0000 77 0 -194.18181 3.50754 1.82269 -194.16065 325.01680
5340.0000 77 0 -194.52133 2.77005 1.81012 -194.38825 308.96322
5345.0000 77 0 -194.51304 3.06014 1.81176 -194.35850 317.73588
5350.0000 77 0 -194.92193 2.77565 1.78720 -194.80307 293.97297
5355.0000 77 0 -195.36645 2.36810 1.76255 -195.24922 274.19039
5360.0000 77 0 -194.52599 2.88477 1.77868 -194.95731 285.00285
5365.0000 77 0 -194.40452 2.84890 1.81071 -194.37747 315.95840
5370.0000 77 0 -194.53539 2.83978 1.80196 -194.53580 309.88967
5375.0000 77 0 -193.88045 3.06941 1.82572 -194.10578 327.97495
5380.0000 77 0 -194.58107 2.83150 1.81379 -194.32168 318.67174
5385.0000 77 0 -195.08412 3.01550 1.78241 -194.88979 288.91764
5390.0000 77 0 -194.37214 3.02856 1.78498 -194.84327 294.07369
5395.0000 77 0 -194.69013 2.71145 1.80955 -194.39857 311.90149
5400.0000 77 0 -194.46845 2.68194 1.78808 -194.78718 289.48219
5405.0000 77 0 -194.76975 2.89470 1.80397 -194.49946 308.31138
5410.0000 77 0 -194.57201 3.06682 1.80058 -194.56092 306.70084
5415.0000 77 0 -194.11748 3.55231 1.82300 -194.15515 327.74343
5420.0000 77 0 -194.88398 2.83518 1.79815 -194.60492 306.76608
5425.0000 77 0 -194.47767 3.41528 1.80102 -194.55290 301.34512
5430.0000 77 0 -194.08610 3.07085 1.81454 -194.30822 315.98393
5435.0000 77 0 -194.34599 2.81729 1.81460 -194.30708 316.97740
5440.0000 77 0 -194.24542 3.01640 1.80364 -194.50553 305.57031
5445.0000 77 0 -194.43532 3.37797 1.80328 -194.51192 308.56172
5450.0000 77 0 -194.97335 2.96878 1.80116 -194.55035 307.75743
5455.0000 77 0 -194.93156 2.66397 1.77901 -194.95133 288.90680
5460.0000 77 0 -194.52935 2.98892 1.79049 -194.74349 299.74125
5465.0000 77 0 -194.87661 2.66418 1.78340 -194.87172 291.83599
5470.0000 77 0 -194.22857 2.97456 1.81878 -194.23139 316.93275
5475.0000 77 0 -194.52216 3.34738 1.81471 -194.30517 318.36037
5480.0000 77 0 -195.07985 2.26465 1.77740 -194.98035 282.53757
5485.0000 77 0 -195.42325 2.93800 1.76645 -195.17851 278.15745
5490.0000 77 0 -194.74962 2.75949 1.77573 -195.01071 285.06046
5495.0000 77 0 -194.64554 3.06727 1.78860 -194.77760 299.58946
5500.0000 77 0 -194.51167 2.85009 1.80536 -194.47434 310.45382
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.88070 1.00142 -0.03461
force_rgl> df(natom) 0.00000 0.00000 0.00000
5505.0000 78 0 -194.60225 4.18263 1.93717 -194.73572 308.02241
5510.0000 78 0 -195.91087 3.14562 1.90345 -195.35131 369.89599
5515.0000 78 0 -196.94216 2.93171 1.83510 -196.59915 312.58737
5520.0000 78 0 -197.11582 2.82734 1.81084 -197.04194 293.20165
5525.0000 78 0 -196.80985 3.00887 1.82106 -196.85542 301.76245
5530.0000 78 0 -196.71324 3.26121 1.83012 -196.68995 321.95786
5535.0000 78 0 -197.44452 2.54057 1.82433 -196.79571 312.22145
5540.0000 78 0 -197.10952 3.47147 1.80489 -197.15071 298.23406
5545.0000 78 0 -197.32139 3.08168 1.80505 -197.14767 297.08854
5550.0000 78 0 -196.33000 3.51112 1.84194 -196.47432 327.06358
5555.0000 78 0 -196.95884 2.92627 1.80897 -197.07616 297.76516
5560.0000 78 0 -196.65080 3.06843 1.82940 -196.70311 320.62610
5565.0000 78 0 -196.58342 3.32023 1.83354 -196.62755 318.38564
5570.0000 78 0 -196.87704 2.72681 1.81744 -196.92148 307.84332
5575.0000 78 0 -197.35540 3.05051 1.80642 -197.12275 306.83916
5580.0000 78 0 -197.42583 3.07944 1.79446 -197.34097 292.23706
5585.0000 78 0 -197.28594 3.03860 1.80487 -197.15092 308.25709
5590.0000 78 0 -197.24760 3.13850 1.79282 -197.37088 301.69032
5595.0000 78 0 -197.17944 3.11384 1.80737 -197.10533 313.24295
5600.0000 78 0 -196.88899 3.48403 1.81544 -196.95804 321.33864
5605.0000 78 0 -197.53695 2.63218 1.79901 -197.25796 305.19125
5610.0000 78 0 -196.96479 3.59535 1.79469 -197.33675 300.11737
5615.0000 78 0 -196.97424 3.38688 1.81064 -197.04560 317.68389
5620.0000 78 0 -196.54232 3.42813 1.82898 -196.71081 333.94085
5625.0000 78 0 -197.33425 3.03837 1.80359 -197.17441 309.30045
5630.0000 78 0 -197.12584 2.81183 1.78928 -197.43558 293.77013
5635.0000 78 0 -197.17213 3.42684 1.78504 -197.51294 297.66549
5640.0000 78 0 -197.10383 3.04880 1.79685 -197.29739 313.50829
5645.0000 78 0 -197.41305 3.13389 1.79617 -197.30978 310.56023
5650.0000 78 0 -197.41911 3.40223 1.79331 -197.36200 303.38207
5655.0000 78 0 -197.59652 3.42308 1.79580 -197.31661 304.27575
5660.0000 78 0 -197.24856 3.07443 1.79252 -197.37644 304.17578
5665.0000 78 0 -197.52039 2.52051 1.79182 -197.38926 300.27162
5670.0000 78 0 -197.53165 3.01842 1.77737 -197.65294 287.92394
5675.0000 78 0 -196.88861 3.41550 1.79255 -197.37589 303.50780
5680.0000 78 0 -197.84029 2.73947 1.79283 -197.37086 301.34964
5685.0000 78 0 -197.55208 2.79695 1.78279 -197.55406 295.59172
5690.0000 78 0 -197.52072 3.08246 1.78276 -197.55459 292.67895
5695.0000 78 0 -198.01891 2.38646 1.79057 -197.41207 300.35302
5700.0000 78 0 -197.97116 2.99725 1.75031 -198.14706 268.79756
5705.0000 78 0 -197.29851 2.80487 1.78449 -197.52312 302.54371
5710.0000 78 0 -197.74220 2.80144 1.77776 -197.64597 291.50010
5715.0000 78 0 -198.08246 2.72001 1.78628 -197.49039 303.91923
5720.0000 78 0 -197.45321 3.04674 1.76426 -197.89235 282.67880
5725.0000 78 0 -197.46222 2.97205 1.78073 -197.59171 303.55458
5730.0000 78 0 -198.37780 2.59831 1.75772 -198.01170 287.27292
5735.0000 78 0 -197.99189 2.72130 1.76478 -197.88288 288.67241
5740.0000 78 0 -198.05148 2.57556 1.75104 -198.13360 277.59407
5745.0000 78 0 -197.64034 3.07465 1.76851 -197.81468 290.08882
5750.0000 78 0 -198.01614 2.95111 1.75687 -198.02723 285.16848
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.38294 -2.47700 -0.53918
force_rgl> df(natom) 0.00000 0.00000 0.00000
5755.0000 79 0 -198.63883 4.08867 1.90535 -197.96995 301.22251
5760.0000 79 0 -199.46484 3.72338 1.84159 -199.14390 351.41723
5765.0000 79 0 -200.31005 3.06497 1.78945 -200.10395 308.07733
5770.0000 79 0 -199.71619 3.27268 1.81603 -199.61453 332.61530
5775.0000 79 0 -199.51017 3.62187 1.80966 -199.73170 328.47645
5780.0000 79 0 -199.51208 3.36079 1.83022 -199.35329 342.10322
5785.0000 79 0 -200.01135 3.07945 1.81284 -199.67329 327.67666
5790.0000 79 0 -199.11216 3.85020 1.81512 -199.63118 329.50264
5795.0000 79 0 -199.91636 3.22413 1.80597 -199.79974 323.93597
5800.0000 79 0 -200.37644 3.25783 1.78272 -200.22779 299.72511
5805.0000 79 0 -199.64640 3.10694 1.78656 -200.15709 305.68014
5810.0000 79 0 -200.34393 3.13820 1.77949 -200.28730 300.62574
5815.0000 79 0 -200.87997 2.77821 1.76676 -200.52171 290.63982
5820.0000 79 0 -200.17783 3.01856 1.77688 -200.33526 301.21069
5825.0000 79 0 -200.05219 3.36976 1.79603 -199.98273 317.77519
5830.0000 79 0 -200.34587 3.18710 1.78969 -200.09949 308.19132
5835.0000 79 0 -200.48290 3.00456 1.77128 -200.43846 292.48935
5840.0000 79 0 -199.79192 3.26122 1.79197 -200.05752 310.50668
5845.0000 79 0 -200.00817 3.26346 1.80782 -199.76573 326.08784
5850.0000 79 0 -199.93831 3.58915 1.79505 -200.00084 317.48408
5855.0000 79 0 -200.14320 2.83049 1.79486 -200.00423 311.44183
5860.0000 79 0 -200.20904 3.28522 1.78960 -200.10119 308.62139
5865.0000 79 0 -200.62535 3.16646 1.78407 -200.20286 303.06738
5870.0000 79 0 -200.34204 3.05572 1.77276 -200.41122 297.18400
5875.0000 79 0 -200.19733 3.44310 1.78288 -200.22482 306.72742
5880.0000 79 0 -199.87482 2.83098 1.79824 -199.94196 316.67382
5885.0000 79 0 -199.58729 3.35120 1.80754 -199.77085 323.71227
5890.0000 79 0 -200.39170 2.95576 1.79466 -200.00799 314.14833
5895.0000 79 0 -200.28292 2.90790 1.78833 -200.12446 308.46996
5900.0000 79 0 -200.72063 2.76332 1.75792 -200.68431 285.17253
5905.0000 79 0 -200.94550 2.79347 1.73791 -201.05282 265.95660
5910.0000 79 0 -200.42837 3.19179 1.75527 -200.73310 280.73290
5915.0000 79 0 -200.78291 3.05529 1.74977 -200.83452 277.11450
5920.0000 79 0 -200.21160 3.03417 1.76754 -200.50720 292.35727
5925.0000 79 0 -200.18064 3.22086 1.77627 -200.34649 297.20339
5930.0000 79 0 -200.63640 3.02611 1.77650 -200.34224 303.24434
5935.0000 79 0 -200.52529 2.88447 1.76063 -200.63450 283.49050
5940.0000 79 0 -200.44856 2.84040 1.78290 -200.22449 303.76829
5945.0000 79 0 -200.08368 3.04326 1.78432 -200.19824 301.77909
5950.0000 79 0 -200.12954 2.95088 1.80110 -199.88945 314.90975
5955.0000 79 0 -200.55676 2.99001 1.76668 -200.52303 287.03999
5960.0000 79 0 -200.25553 2.81846 1.78716 -200.14606 304.34718
5965.0000 79 0 -200.91139 2.68556 1.78100 -200.25947 295.85354
5970.0000 79 0 -200.66037 3.12012 1.76482 -200.55729 288.58334
5975.0000 79 0 -200.10634 2.88212 1.76190 -200.61114 286.62129
5980.0000 79 0 -200.80836 2.81422 1.77076 -200.44801 294.80326
5985.0000 79 0 -200.60908 2.81265 1.73776 -201.05552 264.06609
5990.0000 79 0 -200.25478 2.76693 1.76317 -200.58768 286.51011
5995.0000 79 0 -199.74102 3.50357 1.79411 -200.01809 314.65776
6000.0000 79 0 -199.93483 2.96465 1.80214 -199.87023 321.82658
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -3.36816 0.13705 0.31281
force_rgl> df(natom) 0.00000 0.00000 0.00000
6005.0000 80 0 -200.32436 3.83034 1.94763 -199.83967 345.39319
6010.0000 80 0 -202.26058 3.52148 1.86963 -201.28788 357.14786
6015.0000 80 0 -201.59718 3.57255 1.84084 -201.82234 338.68852
6020.0000 80 0 -202.70624 3.18711 1.83512 -201.92845 334.86049
6025.0000 80 0 -202.32841 3.11584 1.79534 -202.66703 304.56338
6030.0000 80 0 -203.11555 3.18369 1.79096 -202.74842 307.66071
6035.0000 80 0 -202.84561 2.76283 1.77815 -202.98630 292.61352
6040.0000 80 0 -202.56277 3.39561 1.79640 -202.64737 303.14043
6045.0000 80 0 -203.64003 2.52375 1.76609 -203.21010 284.78419
6050.0000 80 0 -203.05105 2.88629 1.75466 -203.42239 274.85941
6055.0000 80 0 -203.14285 2.91714 1.77014 -203.13504 285.17726
6060.0000 80 0 -203.04970 2.83429 1.78732 -202.81607 302.01629
6065.0000 80 0 -203.26198 2.99087 1.77524 -203.04034 293.31906
6070.0000 80 0 -202.84296 3.23637 1.77473 -203.04972 295.82142
6075.0000 80 0 -201.60390 3.44993 1.81292 -202.34062 320.97905
6080.0000 80 0 -202.91473 3.53910 1.80985 -202.39760 324.26747
6085.0000 80 0 -202.90940 3.00082 1.77303 -203.08134 292.07521
6090.0000 80 0 -202.38615 3.87956 1.79916 -202.59619 317.02363
6095.0000 80 0 -203.20143 2.92447 1.78515 -202.85636 299.65554
6100.0000 80 0 -202.84333 2.85508 1.76329 -203.26212 281.91676
6105.0000 80 0 -202.86827 2.99501 1.77523 -203.04040 294.22014
6110.0000 80 0 -202.76164 3.25914 1.78992 -202.76772 306.60981
6115.0000 80 0 -203.29736 2.98155 1.77095 -203.11982 293.12336
6120.0000 80 0 -202.74170 3.15955 1.77514 -203.04208 295.55216
6125.0000 80 0 -203.46940 2.85669 1.74723 -203.56029 270.89336
6130.0000 80 0 -202.57459 2.87429 1.78521 -202.85521 302.92358
6135.0000 80 0 -203.39400 2.49346 1.78004 -202.95111 296.35709
6140.0000 80 0 -202.49046 3.24046 1.78648 -202.83164 303.05514
6145.0000 80 0 -202.14552 3.34497 1.81210 -202.35585 327.24499
6150.0000 80 0 -202.28518 3.29791 1.81735 -202.25851 331.33210
6155.0000 80 0 -202.34601 3.31004 1.82666 -202.08556 336.04539
6160.0000 80 0 -202.69601 2.68936 1.81330 -202.33363 321.75460
6165.0000 80 0 -202.53700 3.19703 1.80134 -202.55562 317.03243
6170.0000 80 0 -202.32279 3.02496 1.81208 -202.35628 324.12210
6175.0000 80 0 -202.71072 3.49833 1.79268 -202.71639 309.75365
6180.0000 80 0 -203.14423 2.90757 1.78395 -202.87850 303.16122
6185.0000 80 0 -202.65794 3.42353 1.77978 -202.95606 300.62068
6190.0000 80 0 -202.82694 3.54008 1.79670 -202.64183 314.09536
6195.0000 80 0 -202.91564 3.61102 1.78126 -202.92858 300.14642
6200.0000 80 0 -202.85598 2.68265 1.80137 -202.55514 316.64487
6205.0000 80 0 -202.52706 3.69111 1.77531 -203.03891 290.83352
6210.0000 80 0 -203.11914 2.90435 1.77634 -203.01975 295.40529
6215.0000 80 0 -202.40524 3.11874 1.78945 -202.77651 304.79838
6220.0000 80 0 -202.28472 3.28133 1.79805 -202.61667 305.89708
6225.0000 80 0 -202.81163 3.07086 1.79758 -202.62543 314.53716
6230.0000 80 0 -202.83216 3.26368 1.79820 -202.61389 313.47293
6235.0000 80 0 -202.43441 3.71338 1.77970 -202.95753 295.82528
6240.0000 80 0 -203.13953 2.88256 1.79502 -202.67299 311.70512
6245.0000 80 0 -202.45127 2.77391 1.78897 -202.78531 309.52118
6250.0000 80 0 -202.79423 3.26530 1.79951 -202.58964 316.95423
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.25408 3.01712 -0.03130
force_rgl> df(natom) 0.00000 0.00000 0.00000
6255.0000 81 0 -203.31256 3.94090 1.90933 -203.20585 295.85405
6260.0000 81 0 -204.46974 3.69873 1.86247 -204.08318 351.48951
6265.0000 81 0 -204.86879 3.42060 1.81925 -204.89223 316.64110
6270.0000 81 0 -205.11663 3.05586 1.81872 -204.90216 313.86681
6275.0000 81 0 -204.41237 3.68100 1.82945 -204.70123 325.41723
6280.0000 81 0 -205.20403 3.23668 1.81567 -204.95933 319.04823
6285.0000 81 0 -204.94085 3.08250 1.79117 -205.41802 294.97197
6290.0000 81 0 -205.23932 2.97897 1.81571 -204.95847 314.43779
6295.0000 81 0 -204.80088 3.43269 1.81969 -204.88394 318.39696
6300.0000 81 0 -204.76527 3.34339 1.85101 -204.29763 338.78517
6305.0000 81 0 -204.85797 3.14694 1.81531 -204.96604 307.55856
6310.0000 81 0 -204.53798 3.78463 1.83174 -204.65852 322.31941
6315.0000 81 0 -205.28901 3.03961 1.81603 -204.95259 309.30797
6320.0000 81 0 -205.53424 2.97261 1.79051 -205.43037 290.71663
6325.0000 81 0 -205.27047 3.16713 1.79103 -205.42054 294.53102
6330.0000 81 0 -205.18496 3.11765 1.80727 -205.11651 304.28164
6335.0000 81 0 -205.55620 3.07169 1.79914 -205.26876 304.22771
6340.0000 81 0 -205.43345 2.92039 1.77989 -205.62912 292.73517
6345.0000 81 0 -205.48580 2.98047 1.77681 -205.68678 286.41921
6350.0000 81 0 -205.63367 2.90418 1.78945 -205.45011 299.49980
6355.0000 81 0 -205.29491 3.05822 1.78886 -205.46111 297.64521
6360.0000 81 0 -205.01470 2.96615 1.82198 -204.84121 323.71215
6365.0000 81 0 -205.15310 3.01716 1.80235 -205.20865 310.37655
6370.0000 81 0 -205.16096 3.04110 1.80769 -205.10860 314.80383
6375.0000 81 0 -204.98984 3.12327 1.81820 -204.91191 319.66670
6380.0000 81 0 -204.64502 3.09885 1.81456 -204.98007 317.45820
6385.0000 81 0 -204.59831 2.80522 1.83279 -204.63883 330.73827
6390.0000 81 0 -204.74250 3.70666 1.84145 -204.47659 342.21339
6395.0000 81 0 -205.02039 3.28036 1.81110 -205.04484 319.14601
6400.0000 81 0 -205.20836 2.87570 1.79663 -205.31573 305.42851
6405.0000 81 0 -204.55575 3.66297 1.81058 -205.05465 314.51197
6410.0000 81 0 -205.40991 3.02353 1.81918 -204.89356 324.85595
6415.0000 81 0 -205.26046 3.33140 1.81227 -205.02289 319.76104
6420.0000 81 0 -204.68199 3.53465 1.81075 -205.05130 318.94349
6425.0000 81 0 -205.42777 3.35021 1.81758 -204.92359 325.86993
6430.0000 81 0 -205.52939 3.18201 1.79175 -205.40705 304.48066
6435.0000 81 0 -206.08305 2.78649 1.77637 -205.69502 291.05021
6440.0000 81 0 -205.84025 3.09130 1.78332 -205.56498 299.92908
6445.0000 81 0 -205.45664 3.24837 1.78554 -205.52325 295.08084
6450.0000 81 0 -205.05635 3.35548 1.79076 -205.42553 302.62718
6455.0000 81 0 -205.05575 3.21814 1.81217 -205.02488 320.71983
6460.0000 81 0 -204.95607 3.22602 1.82030 -204.87264 324.59201
6465.0000 81 0 -205.56943 3.18566 1.78951 -205.44899 298.17815
6470.0000 81 0 -204.65334 3.62612 1.80635 -205.13372 312.74590
6475.0000 81 0 -205.06703 3.36614 1.82727 -204.74218 330.46931
6480.0000 81 0 -205.85474 3.04616 1.78506 -205.53229 295.60047
6485.0000 81 0 -205.60242 3.31441 1.78093 -205.60958 287.70475
6490.0000 81 0 -205.94520 2.69588 1.77812 -205.66226 289.22809
6495.0000 81 0 -205.35871 3.18465 1.78458 -205.54139 294.57738
6500.0000 81 0 -205.26931 2.88540 1.80105 -205.23295 307.10104
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.41369 0.14774 2.29841
force_rgl> df(natom) 0.00000 0.00000 0.00000
6505.0000 82 0 -205.44236 4.07161 1.95805 -204.94280 343.39843
6510.0000 82 0 -207.02111 4.01720 1.89459 -206.14049 372.08690
6515.0000 82 0 -207.88965 3.51635 1.80782 -207.77825 311.49250
6520.0000 82 0 -208.55805 2.83445 1.79225 -208.07208 301.49235
6525.0000 82 0 -208.15738 3.16607 1.78053 -208.29340 291.56835
6530.0000 82 0 -207.70887 3.25895 1.79935 -207.93811 307.49955
6535.0000 82 0 -207.89694 3.11866 1.80635 -207.80600 315.93021
6540.0000 82 0 -207.87496 2.98521 1.80907 -207.75460 316.51907
6545.0000 82 0 -207.66902 3.18706 1.78165 -208.27230 298.94120
6550.0000 82 0 -208.09751 3.46824 1.80791 -207.77661 320.10438
6555.0000 82 0 -207.60647 3.65308 1.80369 -207.85631 319.75212
6560.0000 82 0 -208.23137 3.49880 1.81341 -207.67284 321.31209
6565.0000 82 0 -207.70551 3.08628 1.81632 -207.61778 321.90668
6570.0000 82 0 -208.19523 2.86427 1.80699 -207.79396 312.17297
6575.0000 82 0 -207.32298 3.77868 1.79834 -207.95721 305.89860
6580.0000 82 0 -207.86505 3.21336 1.81763 -207.59315 322.29417
6585.0000 82 0 -208.29222 3.23790 1.79867 -207.95097 307.85159
6590.0000 82 0 -208.15627 2.99901 1.78080 -208.28824 296.42620
6595.0000 82 0 -208.24027 2.57819 1.77882 -208.32570 290.78697
6600.0000 82 0 -206.94184 3.91168 1.82314 -207.48904 327.07765
6605.0000 82 0 -208.26929 2.99095 1.83434 -207.27767 331.64543
6610.0000 82 0 -207.79364 3.29405 1.79959 -207.93354 307.17153
6615.0000 82 0 -208.29963 3.10496 1.79367 -208.04528 303.98138
6620.0000 82 0 -207.94344 3.21997 1.77591 -208.38053 288.92224
6625.0000 82 0 -208.14181 3.05749 1.78936 -208.12677 297.20512
6630.0000 82 0 -208.50998 2.75565 1.78211 -208.26352 294.97968
6635.0000 82 0 -208.34281 2.81580 1.78309 -208.24511 296.23934
6640.0000 82 0 -208.70629 2.75556 1.77629 -208.37337 287.55048
6645.0000 82 0 -207.03230 3.89762 1.79025 -208.10990 300.65493
6650.0000 82 0 -207.79668 3.04244 1.82664 -207.42305 332.02460
6655.0000 82 0 -207.81387 3.26531 1.80873 -207.76104 318.32314
6660.0000 82 0 -207.67508 3.02363 1.80463 -207.83848 315.27621
6665.0000 82 0 -207.46654 3.49584 1.81064 -207.72503 318.21649
6670.0000 82 0 -208.11224 3.16602 1.79566 -208.00773 302.41926
6675.0000 82 0 -207.72093 3.22933 1.80868 -207.76205 312.96125
6680.0000 82 0 -207.59118 3.25490 1.81549 -207.63344 319.18811
6685.0000 82 0 -207.55062 3.26090 1.81203 -207.69872 314.03671
6690.0000 82 0 -207.71398 3.53517 1.81309 -207.67871 316.88773
6695.0000 82 0 -207.34905 3.62915 1.81837 -207.57905 324.09393
6700.0000 82 0 -207.09377 3.35710 1.82678 -207.42034 332.21567
6705.0000 82 0 -208.57253 2.63563 1.80562 -207.81977 313.71656
6710.0000 82 0 -207.51993 3.58872 1.79987 -207.92838 305.64814
6715.0000 82 0 -208.02885 3.21544 1.81453 -207.65160 315.68849
6720.0000 82 0 -208.45373 2.89843 1.77387 -208.41909 286.60333
6725.0000 82 0 -207.51686 3.06623 1.78375 -208.23249 290.65535
6730.0000 82 0 -207.94578 3.23924 1.81177 -207.70367 316.65893
6735.0000 82 0 -208.54602 2.95149 1.80118 -207.90368 304.10254
6740.0000 82 0 -208.90092 2.95322 1.76800 -208.52994 278.61168
6745.0000 82 0 -208.67842 3.32689 1.76002 -208.68040 273.51578
6750.0000 82 0 -208.18287 3.31342 1.76385 -208.60818 275.47543
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.79582 -0.10058 -0.71322
force_rgl> df(natom) 0.00000 0.00000 0.00000
6755.0000 83 0 -208.21558 4.50662 1.92786 -208.16730 311.69102
6760.0000 83 0 -209.49027 3.50226 1.87544 -209.16480 356.93945
6765.0000 83 0 -209.98905 3.07614 1.84671 -209.71152 325.98875
6770.0000 83 0 -210.02577 3.33524 1.82568 -210.11151 313.30973
6775.0000 83 0 -210.61317 3.23087 1.80470 -210.51087 300.27958
6780.0000 83 0 -210.62964 3.43502 1.80879 -210.43291 301.55996
6785.0000 83 0 -210.35143 2.80019 1.82376 -210.14807 311.64552
6790.0000 83 0 -210.10953 2.90153 1.83493 -209.93548 315.85211
6795.0000 83 0 -210.41135 2.96076 1.80470 -210.51085 300.73450
6800.0000 83 0 -210.46303 3.10355 1.80728 -210.46162 312.39108
6805.0000 83 0 -211.11713 3.22819 1.79532 -210.68927 295.83635
6810.0000 83 0 -210.58417 2.96707 1.79370 -210.71999 297.03996
6815.0000 83 0 -210.64326 3.09422 1.79376 -210.71892 296.42684
6820.0000 83 0 -211.14121 3.18421 1.79199 -210.75256 293.63338
6825.0000 83 0 -211.39768 2.69573 1.78460 -210.89317 285.14635
6830.0000 83 0 -210.81109 3.27583 1.78605 -210.86569 289.81423
6835.0000 83 0 -210.96569 2.84959 1.78399 -210.90488 287.06972
6840.0000 83 0 -210.90270 3.33197 1.76378 -211.28933 273.06396
6845.0000 83 0 -210.23919 3.31373 1.78669 -210.85353 289.63763
6850.0000 83 0 -211.20102 2.76550 1.79543 -210.68718 299.30611
6855.0000 83 0 -210.93879 2.86785 1.76646 -211.23833 273.53312
6860.0000 83 0 -210.56690 3.34200 1.80503 -210.50452 305.52639
6865.0000 83 0 -210.23504 3.66597 1.81408 -210.33234 311.93284
6870.0000 83 0 -210.01828 3.46141 1.82899 -210.04861 328.75523
6875.0000 83 0 -210.32530 3.36151 1.83223 -209.98687 328.46705
6880.0000 83 0 -210.70531 2.94366 1.79999 -210.60048 301.43595
6885.0000 83 0 -211.41009 2.57739 1.78754 -210.83735 292.51239
6890.0000 83 0 -211.34766 3.08532 1.76369 -211.29116 271.56118
6895.0000 83 0 -210.54918 3.28721 1.77424 -211.09037 275.62603
6900.0000 83 0 -211.10779 2.96452 1.76705 -211.22725 272.54954
6905.0000 83 0 -210.90561 3.06066 1.77114 -211.14940 275.87708
6910.0000 83 0 -210.71815 2.79511 1.79741 -210.64948 301.50228
6915.0000 83 0 -210.30200 3.17618 1.82333 -210.15634 322.93885
6920.0000 83 0 -210.73424 3.28934 1.80700 -210.46703 300.91722
6925.0000 83 0 -210.07399 3.21767 1.80153 -210.57111 294.75164
6930.0000 83 0 -211.28945 2.80168 1.81145 -210.38241 311.36584
6935.0000 83 0 -210.81194 3.31356 1.77831 -211.01297 282.95174
6940.0000 83 0 -210.69504 2.77846 1.80573 -210.49120 308.17454
6945.0000 83 0 -210.53988 3.35731 1.81300 -210.35293 312.47004
6950.0000 83 0 -210.82749 2.84728 1.78741 -210.83971 287.73090
6955.0000 83 0 -210.20703 3.81341 1.80801 -210.44785 302.74369
6960.0000 83 0 -210.75980 3.07545 1.81171 -210.37734 311.81760
6965.0000 83 0 -210.58554 2.72978 1.80084 -210.58428 304.37362
6970.0000 83 0 -211.07080 2.79228 1.78757 -210.83679 290.24267
6975.0000 83 0 -211.06971 2.85858 1.76614 -211.24450 270.18762
6980.0000 83 0 -210.76046 3.17065 1.78549 -210.87631 289.45749
6985.0000 83 0 -210.82923 3.32304 1.77165 -211.13969 275.17257
6990.0000 83 0 -210.90265 2.78623 1.78818 -210.82511 285.16576
6995.0000 83 0 -210.35020 3.59419 1.79594 -210.67742 293.63965
7000.0000 83 0 -210.38047 3.42651 1.80724 -210.46252 304.03757
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.44007 -2.56755 2.03817
force_rgl> df(natom) 0.00000 0.00000 0.00000
7005.0000 84 0 -211.08777 3.92876 1.94513 -210.49199 313.56325
7010.0000 84 0 -212.10173 3.76025 1.88087 -211.72458 340.68922
7015.0000 84 0 -212.64435 3.45206 1.83361 -212.63105 306.46437
7020.0000 84 0 -213.12043 3.13377 1.81134 -213.05823 290.13419
7025.0000 84 0 -213.25250 3.40598 1.79616 -213.34925 279.12267
7030.0000 84 0 -213.64333 2.86661 1.79924 -213.29021 284.03747
7035.0000 84 0 -213.34620 3.35195 1.79834 -213.30751 282.89356
7040.0000 84 0 -212.92078 3.24621 1.80758 -213.13028 291.23686
7045.0000 84 0 -212.32171 3.72269 1.83156 -212.67039 311.34261
7050.0000 84 0 -212.19545 3.48037 1.85273 -212.26426 330.98598
7055.0000 84 0 -213.74500 2.78073 1.81493 -212.98938 298.16908
7060.0000 84 0 -213.09067 3.18765 1.80067 -213.26284 283.11831
7065.0000 84 0 -212.79016 3.38837 1.82620 -212.77320 309.86534
7070.0000 84 0 -212.52402 3.48990 1.82784 -212.74167 313.70188
7075.0000 84 0 -212.63554 3.11111 1.83923 -212.52320 319.09628
7080.0000 84 0 -212.40530 3.54405 1.82620 -212.77323 308.79419
7085.0000 84 0 -212.82756 3.29511 1.82234 -212.84709 302.10731
7090.0000 84 0 -212.09640 3.53936 1.84441 -212.42388 321.25878
7095.0000 84 0 -212.31421 3.14326 1.86060 -212.11341 334.56970
7100.0000 84 0 -212.87353 3.48288 1.82817 -212.73544 310.41509
7105.0000 84 0 -213.06270 3.24268 1.82109 -212.87107 303.85212
7110.0000 84 0 -212.84711 3.30684 1.82276 -212.83905 305.49605
7115.0000 84 0 -213.31227 2.98312 1.81339 -213.01886 296.86753
7120.0000 84 0 -213.61139 2.95870 1.79091 -213.44998 275.61121
7125.0000 84 0 -213.32772 2.83641 1.78064 -213.64699 267.79219
7130.0000 84 0 -213.65158 3.05406 1.79178 -213.43331 287.53077
7135.0000 84 0 -212.46650 3.50310 1.82057 -212.88104 317.60348
7140.0000 84 0 -212.57439 3.72279 1.82790 -212.74048 318.07678
7145.0000 84 0 -213.44195 3.35342 1.81100 -213.06465 301.41760
7150.0000 84 0 -214.05537 3.25568 1.78241 -213.61297 287.33667
7155.0000 84 0 -213.10512 3.49570 1.79067 -213.45461 296.25176
7160.0000 84 0 -212.85018 3.22647 1.80566 -213.16707 306.33561
7165.0000 84 0 -213.16533 3.57574 1.81220 -213.04172 315.84510
7170.0000 84 0 -213.19871 3.43803 1.80552 -213.16977 309.69941
7175.0000 84 0 -213.13525 3.11920 1.80844 -213.11378 304.27938
7180.0000 84 0 -213.06926 3.31792 1.80468 -213.18585 303.09252
7185.0000 84 0 -213.35400 3.05806 1.79511 -213.36946 296.41090
7190.0000 84 0 -213.35807 3.13977 1.78910 -213.48477 301.88794
7195.0000 84 0 -213.12241 3.56466 1.79761 -213.32148 307.92855
7200.0000 84 0 -213.68169 3.34789 1.82154 -212.86259 327.74412
7205.0000 84 0 -213.84003 2.80232 1.77663 -213.72397 289.91399
7210.0000 84 0 -213.73493 3.29202 1.76436 -213.95919 279.50801
7215.0000 84 0 -213.40901 3.12415 1.78606 -213.54303 297.59293
7220.0000 84 0 -213.23778 3.26342 1.79399 -213.39097 308.34215
7225.0000 84 0 -213.80316 3.05487 1.79519 -213.36788 303.62868
7230.0000 84 0 -213.50849 3.60726 1.80213 -213.23475 306.60172
7235.0000 84 0 -213.59641 3.11506 1.77049 -213.84168 281.27766
7240.0000 84 0 -212.94551 3.16902 1.78083 -213.64337 290.67778
7245.0000 84 0 -212.86159 3.48138 1.82027 -212.88697 323.79487
7250.0000 84 0 -213.33854 3.52585 1.80225 -213.23245 308.30260
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.19497 -0.25983 1.16856
force_rgl> df(natom) 0.00000 0.00000 0.00000
7255.0000 85 0 -213.73761 4.32299 1.92798 -213.47799 316.60706
7260.0000 85 0 -214.96409 3.52279 1.89328 -214.14897 363.07154
7265.0000 85 0 -215.90570 2.94184 1.82818 -215.40741 315.19007
7270.0000 85 0 -216.69734 2.90855 1.79048 -216.13628 278.11708
7275.0000 85 0 -215.97505 3.11760 1.78139 -216.31193 267.60213
7280.0000 85 0 -216.10343 3.15658 1.80980 -215.76269 292.65354
7285.0000 85 0 -215.61134 3.03343 1.79140 -216.11840 276.37998
7290.0000 85 0 -215.91321 3.14190 1.79594 -216.03075 285.61263
7295.0000 85 0 -216.29351 3.21980 1.79281 -216.09111 296.64672
7300.0000 85 0 -215.65452 3.03841 1.79775 -215.99564 304.14105
7305.0000 85 0 -216.11668 3.20683 1.80164 -215.92059 308.22675
7310.0000 85 0 -215.76205 2.93139 1.80818 -215.79406 312.79783
7315.0000 85 0 -216.14820 3.25605 1.78431 -216.25551 295.43704
7320.0000 85 0 -215.79765 3.05806 1.79642 -216.02136 306.93960
7325.0000 85 0 -216.80235 2.92014 1.78842 -216.17598 302.30446
7330.0000 85 0 -215.92939 3.71753 1.78874 -216.16996 299.00836
7335.0000 85 0 -215.57187 3.57859 1.79790 -215.99280 307.45780
7340.0000 85 0 -216.54381 2.95614 1.81003 -215.75836 320.96764
7345.0000 85 0 -215.73055 3.06986 1.80248 -215.90427 308.62102
7350.0000 85 0 -215.52477 3.72755 1.81487 -215.66477 320.69883
7355.0000 85 0 -216.00054 3.34531 1.80174 -215.91847 311.54860
7360.0000 85 0 -215.45941 3.67293 1.79861 -215.97910 306.10754
7365.0000 85 0 -215.88741 3.55213 1.81336 -215.69401 314.33182
7370.0000 85 0 -215.87148 3.21461 1.80048 -215.94294 307.51219
7375.0000 85 0 -215.95700 3.18760 1.80360 -215.88252 309.15548
7380.0000 85 0 -216.15810 3.65611 1.80365 -215.88167 312.15173
7385.0000 85 0 -215.32583 3.99007 1.80600 -215.83624 312.28462
7390.0000 85 0 -215.90423 3.35545 1.80823 -215.79307 315.54064
7395.0000 85 0 -215.71474 3.51383 1.79203 -216.10622 303.86872
7400.0000 85 0 -215.95033 3.36645 1.80186 -215.91619 313.62450
7405.0000 85 0 -216.07904 3.28419 1.80571 -215.84189 314.80388
7410.0000 85 0 -215.85381 3.08461 1.79561 -216.03714 298.35296
7415.0000 85 0 -216.04263 3.27453 1.78697 -216.20401 292.72550
7420.0000 85 0 -216.16383 3.04589 1.80296 -215.89492 307.58073
7425.0000 85 0 -216.04402 2.91200 1.80139 -215.92526 299.52924
7430.0000 85 0 -215.42440 3.65485 1.79980 -215.95605 298.50059
7435.0000 85 0 -216.38363 3.10820 1.79211 -216.10472 296.17507
7440.0000 85 0 -216.46830 2.71173 1.78501 -216.24207 287.94230
7445.0000 85 0 -216.00969 3.27979 1.78721 -216.19952 295.06073
7450.0000 85 0 -216.23900 3.40568 1.80404 -215.87409 308.93972
7455.0000 85 0 -216.37759 3.08636 1.78087 -216.32208 283.19071
7460.0000 85 0 -216.10218 2.94554 1.79107 -216.12490 293.64497
7465.0000 85 0 -215.72749 3.34694 1.79102 -216.12577 297.24726
7470.0000 85 0 -215.61150 3.55921 1.81192 -215.72175 313.81442
7475.0000 85 0 -216.10856 3.11144 1.82053 -215.55523 314.32677
7480.0000 85 0 -216.15596 2.95431 1.77806 -216.37642 283.06415
7485.0000 85 0 -216.21317 2.91355 1.79004 -216.14481 290.76650
7490.0000 85 0 -215.81669 3.26684 1.79519 -216.04524 296.95860
7495.0000 85 0 -215.56808 3.33900 1.81327 -215.69572 315.50965
7500.0000 85 0 -215.13751 4.03209 1.82968 -215.37833 329.99026
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.44555 -3.04592 1.64013
force_rgl> df(natom) 0.00000 0.00000 0.00000
7505.0000 86 0 -216.14270 4.16776 1.95223 -215.66375 316.66138
7510.0000 86 0 -217.33013 3.75424 1.89328 -216.81234 356.50637
7515.0000 86 0 -218.28088 3.37105 1.84641 -217.72564 331.20400
7520.0000 86 0 -218.34735 3.58618 1.80644 -218.50433 302.98078
7525.0000 86 0 -218.87166 3.01990 1.79803 -218.66810 293.53516
7530.0000 86 0 -218.52944 3.63405 1.80281 -218.57500 301.40210
7535.0000 86 0 -218.64287 3.34724 1.80794 -218.47517 305.02590
7540.0000 86 0 -218.49328 3.26431 1.80329 -218.56570 302.99178
7545.0000 86 0 -218.56560 3.22336 1.80602 -218.51256 304.43244
7550.0000 86 0 -218.33774 2.91836 1.81655 -218.30738 311.20612
7555.0000 86 0 -218.71507 3.11942 1.79287 -218.76872 293.21526
7560.0000 86 0 -218.81450 3.28744 1.80072 -218.61584 297.15760
7565.0000 86 0 -218.55412 3.08085 1.80202 -218.59037 293.90626
7570.0000 86 0 -218.62636 3.54252 1.78183 -218.98384 281.45921
7575.0000 86 0 -218.54456 3.18979 1.80319 -218.56762 304.03576
7580.0000 86 0 -218.45431 3.28697 1.82218 -218.19768 314.40056
7585.0000 86 0 -218.53564 3.52789 1.81751 -218.28856 312.73355
7590.0000 86 0 -218.00047 3.18982 1.83532 -217.94159 324.10537
7595.0000 86 0 -218.24587 3.44337 1.82885 -218.06775 311.35387
7600.0000 86 0 -217.72906 3.88534 1.82404 -218.16150 309.32155
7605.0000 86 0 -218.12050 3.81898 1.82009 -218.23830 313.02284
7610.0000 86 0 -219.18771 2.87385 1.81759 -218.28709 312.14307
7615.0000 86 0 -218.70131 2.73749 1.79608 -218.70619 294.51507
7620.0000 86 0 -217.79187 3.65571 1.82445 -218.15334 319.55039
7625.0000 86 0 -218.44645 3.64659 1.82884 -218.06793 318.04489
7630.0000 86 0 -217.80444 3.32109 1.82476 -218.14743 315.32069
7635.0000 86 0 -218.71345 3.29846 1.82771 -218.08986 320.75835
7640.0000 86 0 -218.49998 3.31480 1.78878 -218.84843 287.25229
7645.0000 86 0 -219.38015 2.73782 1.77066 -219.20154 273.49836
7650.0000 86 0 -218.67988 3.21281 1.78138 -218.99255 279.93107
7655.0000 86 0 -218.56037 3.16801 1.78332 -218.95485 282.66240
7660.0000 86 0 -219.07695 3.19208 1.79909 -218.64761 298.43515
7665.0000 86 0 -219.07213 2.91999 1.78719 -218.87937 286.68143
7670.0000 86 0 -219.20413 3.15118 1.77847 -219.04925 278.53490
7675.0000 86 0 -218.73315 3.42730 1.77409 -219.13472 275.81819
7680.0000 86 0 -218.13895 3.08200 1.80795 -218.47488 305.23816
7685.0000 86 0 -218.04085 3.95507 1.83335 -217.97995 320.12438
7690.0000 86 0 -217.34646 3.93751 1.84833 -217.68811 334.38032
7695.0000 86 0 -217.61854 3.54325 1.85401 -217.57754 339.28451
7700.0000 86 0 -218.76257 3.29406 1.80899 -218.45456 305.03621
7705.0000 86 0 -219.12603 2.71520 1.79011 -218.82251 289.11872
7710.0000 86 0 -218.80827 3.01189 1.77292 -219.15747 273.33571
7715.0000 86 0 -218.81725 3.27063 1.78924 -218.83948 289.47257
7720.0000 86 0 -218.51050 3.71185 1.80783 -218.47724 306.12818
7725.0000 86 0 -218.77752 3.32293 1.80334 -218.56477 300.37117
7730.0000 86 0 -218.67460 3.54351 1.78340 -218.95330 279.18097
7735.0000 86 0 -218.66780 3.41640 1.80250 -218.58108 298.09158
7740.0000 86 0 -218.26175 3.56722 1.82297 -218.18232 316.62749
7745.0000 86 0 -217.61807 4.30688 1.84404 -217.77168 325.42628
7750.0000 86 0 -218.40626 3.36996 1.84334 -217.78538 332.07615
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.32360 1.06816 0.36375
force_rgl> df(natom) 0.00000 0.00000 0.00000
7755.0000 87 0 -218.41455 4.84032 1.94399 -218.48132 316.72906
7760.0000 87 0 -219.53629 4.09299 1.90717 -219.20423 375.95499
7765.0000 87 0 -219.90257 4.02664 1.87713 -219.79406 353.92997
7770.0000 87 0 -221.08611 3.18879 1.82932 -220.73287 315.44037
7775.0000 87 0 -220.34862 3.93093 1.82635 -220.79118 311.61034
7780.0000 87 0 -221.38701 3.48123 1.83026 -220.71427 313.68314
7785.0000 87 0 -221.27410 2.65527 1.79929 -221.32236 287.72703
7790.0000 87 0 -221.80085 3.24119 1.80287 -221.25220 288.77487
7795.0000 87 0 -221.29477 3.01811 1.78552 -221.59279 274.63861
7800.0000 87 0 -220.30783 3.62937 1.83039 -220.71171 314.30377
7805.0000 87 0 -220.38948 3.76073 1.86137 -220.10348 332.22913
7810.0000 87 0 -221.32973 3.10082 1.80815 -221.14841 295.36989
7815.0000 87 0 -220.78114 3.70548 1.82215 -220.87348 306.89087
7820.0000 87 0 -221.39910 3.00996 1.80594 -221.19194 299.51571
7825.0000 87 0 -221.56713 3.26558 1.79288 -221.44830 285.27522
7830.0000 87 0 -220.18048 4.12920 1.81230 -221.06688 302.77723
7835.0000 87 0 -220.73036 3.64779 1.83982 -220.52658 324.68681
7840.0000 87 0 -221.33170 3.09601 1.80730 -221.16518 297.11595
7845.0000 87 0 -221.14444 3.87806 1.79856 -221.33683 292.77183
7850.0000 87 0 -221.03517 3.19314 1.82991 -220.72128 314.85219
7855.0000 87 0 -221.06754 3.33098 1.82962 -220.72693 311.65845
7860.0000 87 0 -221.26679 3.25397 1.81226 -221.06777 297.98297
7865.0000 87 0 -221.52063 3.49018 1.79331 -221.43979 292.75778
7870.0000 87 0 -221.35737 3.67566 1.80627 -221.18546 311.48438
7875.0000 87 0 -221.97464 2.88306 1.78581 -221.58714 299.83998
7880.0000 87 0 -221.55284 3.48583 1.79560 -221.39496 304.81833
7885.0000 87 0 -222.41085 3.07740 1.75913 -222.11100 273.77660
7890.0000 87 0 -221.06705 3.60544 1.77754 -221.74936 289.26466
7895.0000 87 0 -221.58686 3.22147 1.80230 -221.26341 308.76818
7900.0000 87 0 -221.33329 3.23217 1.78025 -221.69634 292.05610
7905.0000 87 0 -221.68342 3.36802 1.79974 -221.31356 309.21287
7910.0000 87 0 -221.00102 3.60434 1.78510 -221.60100 295.28821
7915.0000 87 0 -221.95387 2.97402 1.80091 -221.29051 305.62319
7920.0000 87 0 -221.62975 3.35011 1.77527 -221.79396 288.17497
7925.0000 87 0 -221.72808 3.37596 1.78495 -221.60391 296.48765
7930.0000 87 0 -221.39503 3.00426 1.77758 -221.74875 288.86309
7935.0000 87 0 -221.40174 3.36982 1.79890 -221.33012 310.46276
7940.0000 87 0 -220.79588 3.68563 1.80657 -221.17946 314.90951
7945.0000 87 0 -221.21208 3.36208 1.81089 -221.09456 319.16637
7950.0000 87 0 -221.47475 3.42909 1.80264 -221.25667 313.19784
7955.0000 87 0 -221.40577 3.61914 1.80096 -221.28962 307.29308
7960.0000 87 0 -222.32138 2.90148 1.77673 -221.76529 288.80723
7965.0000 87 0 -221.36146 3.28945 1.78585 -221.58622 295.98415
7970.0000 87 0 -221.51301 3.47603 1.79337 -221.43856 298.82047
7975.0000 87 0 -221.26827 3.27405 1.77998 -221.70160 291.86331
7980.0000 87 0 -221.42426 2.96957 1.80070 -221.29482 309.56928
7985.0000 87 0 -221.24485 3.41338 1.80388 -221.23237 309.79785
7990.0000 87 0 -221.90166 3.07273 1.79086 -221.48798 298.33076
7995.0000 87 0 -221.85302 3.23502 1.77271 -221.84428 287.77243
8000.0000 87 0 -220.94431 3.69270 1.79849 -221.33815 307.33813
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.63496 0.09495 0.25583
force_rgl> df(natom) 0.00000 0.00000 0.00000
8005.0000 88 0 -222.16816 3.65621 1.93202 -221.37633 313.69704
8010.0000 88 0 -223.18485 3.94893 1.87149 -222.57388 347.53680
8015.0000 88 0 -223.59937 3.12660 1.84180 -223.16118 331.72789
8020.0000 88 0 -224.22102 3.13687 1.80168 -223.95501 303.36688
8025.0000 88 0 -224.35765 3.11838 1.79422 -224.10243 296.01664
8030.0000 88 0 -223.55367 3.03401 1.80941 -223.80205 309.62234
8035.0000 88 0 -223.13421 3.64904 1.83045 -223.38571 325.36466
8040.0000 88 0 -224.20185 3.48600 1.80837 -223.82249 308.05494
8045.0000 88 0 -224.50354 3.33095 1.77689 -224.44547 279.29038
8050.0000 88 0 -224.03587 3.79864 1.78969 -224.19219 290.55121
8055.0000 88 0 -223.06395 3.32270 1.82430 -223.50734 320.24855
8060.0000 88 0 -223.51191 3.37217 1.82816 -223.43105 321.83052
8065.0000 88 0 -223.52397 3.74395 1.81482 -223.69496 311.69482
8070.0000 88 0 -223.70534 3.50904 1.82430 -223.50732 317.27662
8075.0000 88 0 -223.63523 3.56206 1.82150 -223.56290 312.17873
8080.0000 88 0 -224.16679 3.42316 1.79023 -224.18140 290.84769
8085.0000 88 0 -224.29464 3.16957 1.78605 -224.26411 287.57788
8090.0000 88 0 -223.75447 3.30541 1.82134 -223.56601 314.26392
8095.0000 88 0 -224.33732 2.76910 1.79352 -224.11634 293.73277
8100.0000 88 0 -223.88691 3.32781 1.78709 -224.24363 286.26177
8105.0000 88 0 -223.94263 3.21320 1.79679 -224.05177 294.45127
8110.0000 88 0 -223.70556 3.50012 1.81887 -223.61483 312.54262
8115.0000 88 0 -224.26466 2.92158 1.79643 -224.05874 294.21678
8120.0000 88 0 -223.98154 3.45323 1.80407 -223.90764 302.03140
8125.0000 88 0 -224.49960 2.96424 1.78496 -224.28564 284.52672
8130.0000 88 0 -223.81828 3.17969 1.78562 -224.27263 286.92216
8135.0000 88 0 -224.45532 2.96232 1.79882 -224.01145 299.22962
8140.0000 88 0 -223.93953 3.24221 1.77302 -224.52192 294.30118
8145.0000 88 0 -223.99034 3.70599 1.78812 -224.22315 306.36292
8150.0000 88 0 -223.77659 3.61081 1.81401 -223.71097 324.69185
8155.0000 88 0 -223.74275 3.82079 1.80191 -223.95043 318.26250
8160.0000 88 0 -223.91981 3.93993 1.80331 -223.92273 319.40883
8165.0000 88 0 -224.26165 3.33702 1.79230 -224.14045 306.57907
8170.0000 88 0 -224.44389 3.43278 1.77603 -224.46240 297.23877
8175.0000 88 0 -224.31789 3.38326 1.77922 -224.39933 302.53502
8180.0000 88 0 -224.65499 2.87950 1.79414 -224.10417 313.32895
8185.0000 88 0 -224.22711 3.30629 1.76926 -224.59625 294.48345
8190.0000 88 0 -224.78763 3.14998 1.77817 -224.42005 299.92125
8195.0000 88 0 -224.26147 3.46738 1.74696 -225.03745 271.79838
8200.0000 88 0 -224.44634 3.73788 1.77014 -224.57885 291.53294
8205.0000 88 0 -224.06766 3.50107 1.77932 -224.39730 299.15433
8210.0000 88 0 -224.19886 3.12455 1.78641 -224.25699 306.58905
8215.0000 88 0 -224.81255 3.33207 1.76023 -224.77509 283.80309
8220.0000 88 0 -223.67915 3.33782 1.78362 -224.31215 305.51422
8225.0000 88 0 -224.85686 3.07763 1.77185 -224.54518 293.46313
8230.0000 88 0 -224.73900 3.13371 1.77379 -224.50677 296.27466
8235.0000 88 0 -224.29681 3.13593 1.75264 -224.92510 276.50355
8240.0000 88 0 -224.46252 3.31700 1.78233 -224.33785 301.31349
8245.0000 88 0 -224.00215 3.42583 1.78404 -224.30389 304.57183
8250.0000 88 0 -224.05904 3.61651 1.80731 -223.84351 323.18133
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.21817 0.12059 0.52204
force_rgl> df(natom) 0.00000 0.00000 0.00000
8255.0000 89 0 -223.56569 4.35698 1.93621 -223.95367 327.45161
8260.0000 89 0 -225.95063 3.99132 1.86605 -225.35225 344.14471
8265.0000 89 0 -226.47384 3.42101 1.81724 -226.32522 309.50248
8270.0000 89 0 -226.60727 3.43644 1.81109 -226.44790 307.36279
8275.0000 89 0 -227.31040 3.27459 1.78132 -227.04116 283.07304
8280.0000 89 0 -226.83449 3.01655 1.77800 -227.10737 279.17322
8285.0000 89 0 -226.45673 3.45509 1.78508 -226.96621 281.47530
8290.0000 89 0 -226.50387 3.30105 1.79732 -226.72223 292.86691
8295.0000 89 0 -226.34138 3.44873 1.80063 -226.65628 296.21280
8300.0000 89 0 -226.92578 3.30292 1.79461 -226.77628 291.30851
8305.0000 89 0 -226.95688 3.24864 1.77309 -227.20540 272.34612
8310.0000 89 0 -226.38979 3.40194 1.80338 -226.60142 297.90346
8315.0000 89 0 -227.31764 3.14848 1.77772 -227.11299 274.12175
8320.0000 89 0 -226.93897 3.09896 1.77806 -227.10618 277.70793
8325.0000 89 0 -227.39814 3.18509 1.78429 -226.98205 285.13459
8330.0000 89 0 -227.48836 3.21742 1.76905 -227.28586 272.75741
8335.0000 89 0 -226.22568 3.63285 1.80164 -226.63623 298.27648
8340.0000 89 0 -226.33187 3.33444 1.83152 -226.04065 322.61263
8345.0000 89 0 -226.93037 3.18128 1.80538 -226.56166 301.01533
8350.0000 89 0 -226.89467 3.33074 1.79313 -226.80587 293.75659
8355.0000 89 0 -226.86137 3.21855 1.80122 -226.64451 298.41445
8360.0000 89 0 -226.56182 3.47953 1.78372 -226.99351 283.74879
8365.0000 89 0 -226.09111 3.85133 1.79289 -226.81062 286.96603
8370.0000 89 0 -226.21063 3.57586 1.84057 -225.86008 329.10008
8375.0000 89 0 -226.38513 3.53803 1.81952 -226.27981 313.20775
8380.0000 89 0 -225.97855 3.98725 1.81570 -226.35593 311.94778
8385.0000 89 0 -226.80212 3.46071 1.81331 -226.40364 308.16790
8390.0000 89 0 -226.03542 3.30331 1.81692 -226.33168 306.13747
8395.0000 89 0 -226.01576 3.78061 1.83241 -226.02277 320.11653
8400.0000 89 0 -225.74492 3.36008 1.83153 -226.04043 317.88956
8405.0000 89 0 -225.47928 4.21000 1.84549 -225.76217 334.36456
8410.0000 89 0 -226.78190 2.94834 1.81408 -226.38818 309.79294
8415.0000 89 0 -226.14344 3.32671 1.80806 -226.50826 303.18391
8420.0000 89 0 -225.97541 3.87145 1.83709 -225.92960 324.69666
8425.0000 89 0 -226.76848 3.53945 1.82739 -226.12281 319.90770
8430.0000 89 0 -227.09806 3.24764 1.76144 -227.43746 265.59171
8435.0000 89 0 -227.02053 3.23764 1.79046 -226.85908 290.82179
8440.0000 89 0 -226.62659 3.62737 1.79126 -226.84304 287.31491
8445.0000 89 0 -226.61014 3.34842 1.80785 -226.51243 305.98242
8450.0000 89 0 -226.72941 3.17564 1.80281 -226.61279 295.07978
8455.0000 89 0 -226.99070 3.27588 1.78916 -226.88490 286.59904
8460.0000 89 0 -227.26337 2.79713 1.79067 -226.85478 287.78938
8465.0000 89 0 -226.57898 3.45425 1.79233 -226.82177 289.96696
8470.0000 89 0 -226.15623 3.85872 1.83351 -226.00097 323.15551
8475.0000 89 0 -225.97965 3.81266 1.81738 -226.32254 308.77417
8480.0000 89 0 -226.68321 3.46153 1.79281 -226.81214 295.81320
8485.0000 89 0 -226.61082 3.22068 1.80292 -226.61059 304.08595
8490.0000 89 0 -226.46349 4.11136 1.80766 -226.51612 307.95181
8495.0000 89 0 -226.33728 3.73443 1.81080 -226.45361 312.28744
8500.0000 89 0 -226.49717 2.86357 1.81364 -226.39696 314.60881
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.09761 2.57708 -1.22954
force_rgl> df(natom) 0.00000 0.00000 0.00000
8505.0000 90 0 -226.54954 4.65172 1.93519 -226.63565 317.01220
8510.0000 90 0 -228.75381 3.66302 1.85080 -228.33034 323.61446
8515.0000 90 0 -228.22561 3.41742 1.82283 -228.89214 303.51223
8520.0000 90 0 -228.61806 4.13108 1.82801 -228.78818 312.90211
8525.0000 90 0 -228.95825 3.56818 1.82506 -228.84731 319.95187
8530.0000 90 0 -228.35928 3.62413 1.83356 -228.67658 327.85593
8535.0000 90 0 -228.37119 3.62430 1.85856 -228.17460 345.21373
8540.0000 90 0 -228.72353 3.35133 1.84002 -228.54682 329.14252
8545.0000 90 0 -228.37243 4.33455 1.84782 -228.39020 335.03853
8550.0000 90 0 -229.44521 3.46671 1.83567 -228.63436 328.56390
8555.0000 90 0 -229.17307 3.55299 1.79675 -229.41593 295.83567
8560.0000 90 0 -228.95614 3.39389 1.81106 -229.12855 306.64658
8565.0000 90 0 -228.81406 3.78860 1.83133 -228.72133 325.51441
8570.0000 90 0 -229.29347 3.48977 1.80342 -229.28196 304.29633
8575.0000 90 0 -229.16812 3.17447 1.82056 -228.93776 314.25908
8580.0000 90 0 -229.22351 3.64188 1.80704 -229.20915 300.71852
8585.0000 90 0 -229.27138 3.39762 1.81023 -229.14514 308.86706
8590.0000 90 0 -229.60333 3.52543 1.79690 -229.41278 294.23090
8595.0000 90 0 -229.44013 3.23950 1.79352 -229.48069 293.06520
8600.0000 90 0 -229.78491 3.49616 1.78322 -229.68767 285.51725
8605.0000 90 0 -229.40048 3.77056 1.79831 -229.38461 296.95676
8610.0000 90 0 -229.68800 3.47610 1.79400 -229.47103 294.81426
8615.0000 90 0 -229.28468 3.34154 1.79493 -229.45237 296.05418
8620.0000 90 0 -229.62433 3.56698 1.79538 -229.44338 293.12194
8625.0000 90 0 -229.72631 3.12843 1.78803 -229.59096 288.90095
8630.0000 90 0 -229.43626 3.68364 1.79776 -229.39551 297.87450
8635.0000 90 0 -229.19912 3.42623 1.80729 -229.20417 304.66575
8640.0000 90 0 -228.83554 4.39185 1.80946 -229.16056 305.72546
8645.0000 90 0 -228.72660 3.97803 1.81651 -229.01899 311.14419
8650.0000 90 0 -228.90797 3.77176 1.82025 -228.94389 316.46872
8655.0000 90 0 -229.19582 3.46309 1.79655 -229.41998 297.45624
8660.0000 90 0 -230.36578 2.94518 1.78111 -229.73007 282.96182
8665.0000 90 0 -230.08251 3.00312 1.75157 -230.32317 259.31864
8670.0000 90 0 -229.41538 3.35990 1.76695 -230.01431 272.38167
8675.0000 90 0 -229.65828 3.21522 1.78689 -229.61384 290.65785
8680.0000 90 0 -229.85705 2.98251 1.79273 -229.49663 290.91922
8685.0000 90 0 -229.26680 3.62852 1.78590 -229.63371 289.20229
8690.0000 90 0 -229.56310 3.34859 1.80896 -229.17068 308.71800
8695.0000 90 0 -229.47278 3.56105 1.80891 -229.17163 309.57222
8700.0000 90 0 -228.82122 3.87898 1.80890 -229.17182 306.13550
8705.0000 90 0 -228.92561 3.83726 1.82547 -228.83901 320.08636
8710.0000 90 0 -229.37755 3.15398 1.81116 -229.12656 305.13418
8715.0000 90 0 -229.36145 3.63845 1.79577 -229.43555 294.01210
8720.0000 90 0 -229.41228 3.20983 1.79348 -229.48155 291.69477
8725.0000 90 0 -229.34131 3.31891 1.80610 -229.22821 305.83369
8730.0000 90 0 -229.46206 3.19450 1.80049 -229.34073 300.10808
8735.0000 90 0 -229.83570 3.46641 1.78043 -229.74360 281.61118
8740.0000 90 0 -229.76762 3.39643 1.78112 -229.72983 280.76657
8745.0000 90 0 -229.67732 3.38052 1.78093 -229.73355 281.63700
8750.0000 90 0 -229.19037 3.58734 1.79149 -229.52160 291.60951
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.02958 0.21037 0.51222
force_rgl> df(natom) 0.00000 0.00000 0.00000
8755.0000 91 0 -229.30720 4.29931 1.93099 -229.38315 309.35873
8760.0000 91 0 -231.40094 3.55864 1.85780 -230.86403 325.25730
8765.0000 91 0 -230.70587 4.01099 1.83422 -231.34100 306.39066
8770.0000 91 0 -231.31484 3.51773 1.86022 -230.81495 328.68509
8775.0000 91 0 -230.86184 3.58268 1.85222 -230.97693 322.13328
8780.0000 91 0 -231.35652 3.47658 1.84027 -231.21863 311.41048
8785.0000 91 0 -231.05995 3.83528 1.84310 -231.16146 312.83011
8790.0000 91 0 -230.52489 4.01077 1.86487 -230.72086 330.68160
8795.0000 91 0 -230.11876 4.22742 1.89636 -230.08382 355.37301
8800.0000 91 0 -229.74070 4.04260 1.88658 -230.28171 349.06935
8805.0000 91 0 -230.95585 3.77116 1.89170 -230.17818 352.88988
8810.0000 91 0 -231.38309 3.63035 1.83994 -231.22530 308.58398
8815.0000 91 0 -231.42352 3.36562 1.83606 -231.30374 309.91031
8820.0000 91 0 -231.79743 3.56801 1.81072 -231.81650 286.28154
8825.0000 91 0 -231.81371 3.34666 1.81060 -231.81888 286.24638
8830.0000 91 0 -231.93090 3.37851 1.80240 -231.98485 282.11475
8835.0000 91 0 -231.23855 3.37825 1.82863 -231.45420 301.15545
8840.0000 91 0 -230.81607 3.65307 1.84161 -231.19157 308.73106
8845.0000 91 0 -231.46137 3.21492 1.84038 -231.21647 311.37263
8850.0000 91 0 -231.04288 3.35234 1.84830 -231.05608 317.82465
8855.0000 91 0 -230.12414 4.15148 1.85616 -230.89711 324.76963
8860.0000 91 0 -231.42033 3.55756 1.85571 -230.90616 321.11297
8865.0000 91 0 -231.31186 3.42444 1.81539 -231.72199 291.56045
8870.0000 91 0 -232.11068 3.43314 1.80480 -231.93624 284.41053
8875.0000 91 0 -232.50213 2.86455 1.79507 -232.13313 274.55204
8880.0000 91 0 -232.12899 3.09649 1.78070 -232.42379 263.73057
8885.0000 91 0 -230.94055 3.80707 1.83080 -231.41023 307.46657
8890.0000 91 0 -231.85366 3.28479 1.82103 -231.60797 296.43496
8895.0000 91 0 -231.73771 3.28386 1.81619 -231.70583 291.09116
8900.0000 91 0 -231.23828 3.63807 1.81494 -231.73117 290.40208
8905.0000 91 0 -232.16149 3.55621 1.82919 -231.44288 301.96938
8910.0000 91 0 -232.36193 3.32441 1.78127 -232.41235 262.44365
8915.0000 91 0 -230.88977 3.77459 1.83645 -231.29586 308.89716
8920.0000 91 0 -231.75164 3.37788 1.84222 -231.17909 313.34998
8925.0000 91 0 -231.35762 3.41253 1.82573 -231.51277 298.22359
8930.0000 91 0 -231.54231 3.12686 1.82480 -231.53167 300.51782
8935.0000 91 0 -231.62585 3.50914 1.82629 -231.50153 299.61589
8940.0000 91 0 -231.46786 3.63394 1.82152 -231.59796 297.25816
8945.0000 91 0 -231.78789 3.15900 1.81817 -231.66573 292.75708
8950.0000 91 0 -231.08344 3.53210 1.83087 -231.40877 299.39413
8955.0000 91 0 -231.00567 3.78914 1.82237 -231.58084 296.60188
8960.0000 91 0 -231.21421 3.27099 1.84625 -231.09773 315.02985
8965.0000 91 0 -231.19903 3.18791 1.83832 -231.25799 310.96926
8970.0000 91 0 -232.19956 2.91306 1.81571 -231.71557 292.29968
8975.0000 91 0 -231.10403 3.90503 1.80886 -231.85411 286.49869
8980.0000 91 0 -231.43654 3.49619 1.83556 -231.31392 308.09993
8985.0000 91 0 -230.99424 3.33391 1.81718 -231.68580 289.53439
8990.0000 91 0 -230.96898 4.07410 1.85090 -231.00363 321.82605
8995.0000 91 0 -230.79483 3.91265 1.85554 -230.90966 322.63562
9000.0000 91 0 -231.25995 3.13474 1.85694 -230.88126 324.56895
main_MD> EXECUTION TIME: 0 [day], 0 [hour], 8 [min], 21.5724199 [s].
main_MD> Deallocating global variables
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