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nanoparticlesims/growth_Melting_Silver_ICO_4091/growthSims/run_79/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: 1200
main_MD> Size of nv and nvoiz: 79 7900
main_MD> Size of nv and nvoiz: 79 7900
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 = 79
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> 0.17360185607051037 7.6367816392796842E-002 -0.10302275578301499 initial drift of cluster / NP1 for coalescence
init> 0.32436222945668236 0.32810190917016085 0.28141299377379403 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 299.38168639311766
preparo> TOTAL ENERGY, KINETIC EN., POT. ENERGY, DELTA
5000 -137.57732320016254 2.5632352971624148 -140.14055849732495 3.6564285253000721E-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) 1.18740 0.30435 0.66987
force_rgl> df(natom) 0.00000 0.00000 0.00000
5.0000 56 0 -137.80577 3.26362 1.85856 -137.99591 312.56267
10.0000 56 0 -139.87443 2.23350 1.80722 -138.74727 402.63599
15.0000 56 0 -140.19038 2.00192 1.72689 -139.92309 336.65621
20.0000 56 0 -139.83298 2.23923 1.72011 -140.02234 321.03142
25.0000 56 0 -140.49106 1.85929 1.69884 -140.33370 298.74733
30.0000 56 0 -139.88946 2.23597 1.70518 -140.24090 309.20481
35.0000 56 0 -139.71902 2.33893 1.73550 -139.79703 337.14759
40.0000 56 0 -140.21220 2.32082 1.73339 -139.82805 328.60301
45.0000 56 0 -140.27278 2.07695 1.68661 -140.51264 287.82385
50.0000 56 0 -140.01474 1.77818 1.70756 -140.20603 307.28256
55.0000 56 0 -140.32485 2.18477 1.70377 -140.26155 304.00254
60.0000 56 0 -139.87745 2.15202 1.70673 -140.21816 308.21876
65.0000 56 0 -140.10617 2.48531 1.72638 -139.93058 327.40971
70.0000 56 0 -140.13280 2.46977 1.70465 -140.24866 304.50452
75.0000 56 0 -140.48809 2.08610 1.71117 -140.15329 314.64077
80.0000 56 0 -139.78903 2.16550 1.71328 -140.12232 316.11480
85.0000 56 0 -140.57404 1.90417 1.71868 -140.04323 319.21860
90.0000 56 0 -140.62236 1.97931 1.67230 -140.72215 276.22128
95.0000 56 0 -140.58439 2.60661 1.69010 -140.46163 292.93443
100.0000 56 0 -140.60166 1.90935 1.67890 -140.62560 279.71089
105.0000 56 0 -140.44672 2.19800 1.67554 -140.67471 278.93081
110.0000 56 0 -140.42786 2.10082 1.68149 -140.58765 289.70163
115.0000 56 0 -140.49930 1.82150 1.70027 -140.31278 304.87165
120.0000 56 0 -139.35525 2.59373 1.72814 -139.90487 326.73212
125.0000 56 0 -140.56511 2.09752 1.71451 -140.10427 315.18159
130.0000 56 0 -139.85450 2.28991 1.70428 -140.25413 305.49361
135.0000 56 0 -139.88444 2.48332 1.73753 -139.76746 338.12921
140.0000 56 0 -139.63085 2.54385 1.72600 -139.93615 326.68141
145.0000 56 0 -140.02023 2.19072 1.73662 -139.78077 330.33691
150.0000 56 0 -140.13472 2.08978 1.73134 -139.85795 333.36985
155.0000 56 0 -139.80853 2.44969 1.71342 -140.12035 314.14444
160.0000 56 0 -139.82217 2.13248 1.70727 -140.21028 309.19681
165.0000 56 0 -140.37968 2.51674 1.71056 -140.16211 314.57131
170.0000 56 0 -140.49323 2.06651 1.69382 -140.40713 295.16981
175.0000 56 0 -140.34167 2.42729 1.70224 -140.28395 303.52732
180.0000 56 0 -140.57223 2.01362 1.69152 -140.44079 292.03579
185.0000 56 0 -140.34245 2.43192 1.68285 -140.56777 285.79494
190.0000 56 0 -140.31841 2.45764 1.71242 -140.13492 317.95893
195.0000 56 0 -140.36594 1.96525 1.70224 -140.28397 304.95775
200.0000 56 0 -140.19342 2.26299 1.70627 -140.22492 312.03443
205.0000 56 0 -140.23863 2.04982 1.71312 -140.12472 318.24346
210.0000 56 0 -140.37413 2.25700 1.69547 -140.38300 298.96279
215.0000 56 0 -140.02889 2.36573 1.70016 -140.31432 300.50088
220.0000 56 0 -139.84562 2.50471 1.72862 -139.89775 330.22339
225.0000 56 0 -140.17659 2.26837 1.72114 -140.00734 322.68277
230.0000 56 0 -140.13120 2.37416 1.71273 -140.13046 314.33357
235.0000 56 0 -139.66852 2.54735 1.72790 -139.90834 327.01305
240.0000 56 0 -140.19304 2.35475 1.72500 -139.95073 319.51270
245.0000 56 0 -140.71687 1.95098 1.69226 -140.42994 293.22004
250.0000 56 0 -140.60266 1.81847 1.69640 -140.36938 292.39182
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.28402 0.19591 -2.13798
force_rgl> df(natom) 0.00000 0.00000 0.00000
255.0000 57 0 -140.23752 2.48616 1.88936 -140.16673 309.82598
260.0000 57 0 -141.85914 2.66530 1.84698 -140.79442 413.38344
265.0000 57 0 -142.10688 2.62331 1.76448 -142.01636 340.22852
270.0000 57 0 -142.04957 2.63192 1.74595 -142.29081 320.05370
275.0000 57 0 -142.32784 1.93757 1.74752 -142.26757 317.45741
280.0000 57 0 -142.24337 2.27656 1.74760 -142.26630 318.33278
285.0000 57 0 -142.56706 2.15443 1.74899 -142.24576 317.13066
290.0000 57 0 -142.41357 2.23376 1.73055 -142.51886 306.01422
295.0000 57 0 -142.15153 2.60540 1.73567 -142.44310 313.58244
300.0000 57 0 -142.48803 2.24184 1.74480 -142.30791 321.80167
305.0000 57 0 -143.04261 1.84457 1.70526 -142.89347 285.54301
310.0000 57 0 -142.78173 1.78547 1.69963 -142.97686 283.84187
315.0000 57 0 -142.39032 1.98531 1.70998 -142.82358 299.16162
320.0000 57 0 -142.68607 2.27955 1.72584 -142.58868 312.82917
325.0000 57 0 -142.34498 2.17701 1.73391 -142.46911 321.95570
330.0000 57 0 -142.14904 2.76014 1.75331 -142.18185 326.34712
335.0000 57 0 -142.99084 2.07484 1.73150 -142.50485 312.30923
340.0000 57 0 -142.58333 2.43610 1.71653 -142.72658 295.45041
345.0000 57 0 -142.95104 2.31902 1.71291 -142.78014 286.73250
350.0000 57 0 -142.66777 2.14571 1.72383 -142.61838 304.39016
355.0000 57 0 -142.48880 2.05348 1.72501 -142.60098 301.12712
360.0000 57 0 -143.00394 2.18514 1.72329 -142.62648 300.88615
365.0000 57 0 -142.30361 2.35659 1.71724 -142.71599 294.94586
370.0000 57 0 -142.28070 2.53491 1.75021 -142.22765 323.89671
375.0000 57 0 -142.75778 2.09241 1.72369 -142.62042 300.59332
380.0000 57 0 -142.75481 2.33898 1.71122 -142.80524 298.13360
385.0000 57 0 -142.57656 2.30039 1.71754 -142.71165 312.62728
390.0000 57 0 -142.98086 2.04188 1.72345 -142.62403 310.34651
395.0000 57 0 -143.10557 2.24860 1.70135 -142.95131 290.23940
400.0000 57 0 -142.87072 2.31859 1.69969 -142.97595 294.30377
405.0000 57 0 -142.93740 1.99996 1.69731 -143.01121 286.96288
410.0000 57 0 -142.88658 2.13393 1.71233 -142.78877 308.04496
415.0000 57 0 -142.58654 1.91726 1.71513 -142.74735 305.83015
420.0000 57 0 -143.41364 1.75127 1.68202 -143.23772 274.94116
425.0000 57 0 -143.08719 1.88699 1.68971 -143.12382 284.12711
430.0000 57 0 -143.33113 2.16994 1.67403 -143.35601 262.32336
435.0000 57 0 -142.46658 2.33617 1.70905 -142.83732 296.12712
440.0000 57 0 -142.44611 2.70076 1.73281 -142.48539 319.74813
445.0000 57 0 -142.37309 2.42774 1.71823 -142.70139 309.42527
450.0000 57 0 -142.30725 2.22402 1.73976 -142.38253 327.86134
455.0000 57 0 -142.46947 2.06885 1.72384 -142.61832 311.47296
460.0000 57 0 -142.59994 2.76227 1.71798 -142.70504 305.61516
465.0000 57 0 -142.53611 2.69345 1.74501 -142.30468 334.99114
470.0000 57 0 -142.90565 2.09821 1.71048 -142.81617 299.03609
475.0000 57 0 -143.05475 1.97079 1.70612 -142.88069 294.69222
480.0000 57 0 -143.20355 2.05989 1.70168 -142.94655 293.53228
485.0000 57 0 -143.09249 1.90978 1.71199 -142.79383 298.48944
490.0000 57 0 -142.37765 2.13452 1.70534 -142.89235 293.35902
495.0000 57 0 -142.34781 2.50815 1.73876 -142.39723 325.99978
500.0000 57 0 -142.02953 2.90610 1.75030 -142.22634 335.87322
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.83806 0.72996 0.72829
force_rgl> df(natom) 0.00000 0.00000 0.00000
505.0000 58 0 -142.58442 3.52740 1.94873 -141.90091 374.84875
510.0000 58 0 -144.60724 2.54448 1.82168 -143.80457 382.95387
515.0000 58 0 -145.47925 2.34320 1.73634 -145.08326 314.91168
520.0000 58 0 -145.47746 1.98726 1.70058 -145.61901 285.39486
525.0000 58 0 -145.37999 1.91453 1.70766 -145.51298 288.59626
530.0000 58 0 -145.71864 1.85175 1.70951 -145.48528 277.90714
535.0000 58 0 -145.52589 1.82769 1.69986 -145.62979 266.44530
540.0000 58 0 -144.61711 2.38837 1.73922 -145.04009 304.16452
545.0000 58 0 -144.95557 2.38379 1.76893 -144.59486 334.63680
550.0000 58 0 -144.69383 2.47204 1.75669 -144.77834 322.61572
555.0000 58 0 -144.48128 2.47710 1.76717 -144.62126 331.85476
560.0000 58 0 -145.13222 2.17028 1.75358 -144.82490 317.85609
565.0000 58 0 -145.36803 2.04023 1.71603 -145.38761 278.81927
570.0000 58 0 -145.09780 2.14829 1.70352 -145.57498 271.96808
575.0000 58 0 -144.80721 2.30994 1.75841 -144.75258 316.28063
580.0000 58 0 -145.86481 1.74217 1.72372 -145.27231 289.28925
585.0000 58 0 -144.70489 2.51933 1.71833 -145.35315 281.72390
590.0000 58 0 -144.69842 2.16207 1.76630 -144.63431 321.77854
595.0000 58 0 -145.12832 2.23535 1.76426 -144.66496 324.10889
600.0000 58 0 -145.72152 1.98713 1.71625 -145.38425 283.59450
605.0000 58 0 -145.40637 2.58137 1.70336 -145.57736 296.38275
610.0000 58 0 -145.83772 1.67948 1.71724 -145.36934 311.14693
615.0000 58 0 -145.66007 2.11407 1.70087 -145.61472 294.62544
620.0000 58 0 -145.03612 2.14643 1.71639 -145.38221 308.39899
625.0000 58 0 -145.69307 2.04631 1.71616 -145.38558 312.95281
630.0000 58 0 -145.62089 2.10917 1.70071 -145.61715 295.33640
635.0000 58 0 -145.43500 2.29104 1.70762 -145.51359 304.84754
640.0000 58 0 -146.07321 1.98267 1.69721 -145.66960 302.87516
645.0000 58 0 -145.57221 2.17120 1.70755 -145.51457 302.90086
650.0000 58 0 -145.53062 2.12945 1.70575 -145.54164 306.01196
655.0000 58 0 -145.74984 2.13757 1.68934 -145.78750 286.03962
660.0000 58 0 -145.52763 2.17895 1.69450 -145.71020 289.28904
665.0000 58 0 -145.98295 1.77035 1.69769 -145.66231 294.00867
670.0000 58 0 -145.48842 2.39298 1.68969 -145.78217 290.27795
675.0000 58 0 -145.31449 2.54268 1.72580 -145.24122 321.54493
680.0000 58 0 -145.13131 2.23894 1.73371 -145.12264 327.43734
685.0000 58 0 -144.74880 2.41665 1.76188 -144.70049 356.15621
690.0000 58 0 -144.26154 3.12457 1.76827 -144.60473 359.56752
695.0000 58 0 -145.22377 2.45368 1.74947 -144.88657 343.19364
700.0000 58 0 -145.27979 2.59061 1.73734 -145.06817 334.45992
705.0000 58 0 -145.24745 2.40097 1.72611 -145.23646 320.80697
710.0000 58 0 -145.89210 2.12193 1.70133 -145.60787 298.76314
715.0000 58 0 -145.58211 2.25246 1.70284 -145.58512 299.96539
720.0000 58 0 -145.76818 2.35233 1.70778 -145.51110 303.43855
725.0000 58 0 -145.61806 2.40859 1.69881 -145.64560 295.20831
730.0000 58 0 -145.09154 2.22094 1.71841 -145.35182 316.04631
735.0000 58 0 -145.57020 2.26954 1.71898 -145.34339 316.79744
740.0000 58 0 -145.64705 1.78426 1.70493 -145.55392 300.67933
745.0000 58 0 -145.39160 2.32766 1.70223 -145.59426 298.56815
750.0000 58 0 -145.26753 2.56714 1.71983 -145.33065 314.02283
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.59982 1.66594 0.28806
force_rgl> df(natom) 0.00000 0.00000 0.00000
755.0000 59 0 -145.49033 3.13964 1.88279 -145.51552 325.75296
760.0000 59 0 -147.24685 2.68380 1.81642 -146.52134 378.21980
765.0000 59 0 -147.61538 2.24540 1.73667 -147.73000 302.95880
770.0000 59 0 -147.76180 1.90256 1.75096 -147.51342 315.86239
775.0000 59 0 -147.64821 2.30977 1.75063 -147.51847 309.73993
780.0000 59 0 -147.08104 2.26377 1.74688 -147.57524 305.10357
785.0000 59 0 -147.27874 2.83556 1.76707 -147.26925 326.19031
790.0000 59 0 -148.16617 2.31564 1.73684 -147.72742 307.06644
795.0000 59 0 -148.30468 1.99132 1.70722 -148.17643 277.15689
800.0000 59 0 -147.51851 2.44825 1.73607 -147.73918 301.79032
805.0000 59 0 -147.27005 2.32909 1.74290 -147.63556 309.18323
810.0000 59 0 -147.56194 2.15149 1.73683 -147.72761 299.82691
815.0000 59 0 -147.48207 2.50901 1.75091 -147.51423 312.84683
820.0000 59 0 -147.22765 2.16000 1.75388 -147.46917 320.18969
825.0000 59 0 -147.99259 2.30285 1.73625 -147.73641 304.77971
830.0000 59 0 -147.73698 2.21333 1.73909 -147.69332 310.04840
835.0000 59 0 -148.11630 2.16517 1.73053 -147.82312 298.56594
840.0000 59 0 -147.70986 2.51021 1.72598 -147.89197 290.77261
845.0000 59 0 -147.01406 2.20237 1.77878 -147.09184 345.15841
850.0000 59 0 -147.56235 2.26528 1.75286 -147.48466 314.89606
855.0000 59 0 -147.41838 2.32992 1.75010 -147.52646 318.03050
860.0000 59 0 -147.53164 2.25682 1.76479 -147.30390 319.71403
865.0000 59 0 -147.24858 2.35793 1.76471 -147.30501 321.34113
870.0000 59 0 -147.14597 2.36966 1.75960 -147.38251 317.72586
875.0000 59 0 -147.53386 2.25687 1.76234 -147.34093 320.53340
880.0000 59 0 -147.37288 2.47947 1.75084 -147.51523 309.90191
885.0000 59 0 -147.66626 2.08617 1.75065 -147.51815 324.47965
890.0000 59 0 -147.62974 2.58027 1.74565 -147.59399 310.92511
895.0000 59 0 -147.76729 2.07649 1.74160 -147.65524 303.16319
900.0000 59 0 -147.82328 2.42331 1.75399 -147.46756 320.77417
905.0000 59 0 -147.46224 2.43480 1.73340 -147.77966 314.30851
910.0000 59 0 -147.99411 2.57098 1.72865 -147.85158 310.58594
915.0000 59 0 -147.74661 2.80867 1.72066 -147.97272 302.47266
920.0000 59 0 -147.17929 2.80914 1.75265 -147.48786 335.13546
925.0000 59 0 -147.63253 2.23597 1.75655 -147.42872 330.79598
930.0000 59 0 -148.17614 2.17663 1.72077 -147.97106 303.03356
935.0000 59 0 -147.64180 2.54067 1.73056 -147.82268 311.31624
940.0000 59 0 -147.64950 2.26460 1.74324 -147.63040 325.60894
945.0000 59 0 -147.34384 2.36763 1.74276 -147.63770 324.06964
950.0000 59 0 -148.49076 2.03174 1.71899 -147.99794 300.27914
955.0000 59 0 -148.61113 1.78417 1.67725 -148.63058 261.54469
960.0000 59 0 -147.92217 2.26994 1.70932 -148.14448 287.92617
965.0000 59 0 -147.70514 2.51141 1.72583 -147.89431 305.54871
970.0000 59 0 -148.02682 2.09262 1.74063 -147.66997 320.46713
975.0000 59 0 -147.73106 2.19148 1.71481 -148.06129 295.39183
980.0000 59 0 -147.73714 2.40510 1.74432 -147.61415 325.07624
985.0000 59 0 -148.55626 2.13445 1.71180 -148.10698 292.66212
990.0000 59 0 -148.03178 2.24438 1.69841 -148.30996 279.82706
995.0000 59 0 -147.91352 2.06472 1.73901 -147.69458 317.63215
1000.0000 59 0 -148.22445 2.25419 1.72960 -147.83711 307.53151
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.24619 -1.37656 -3.31143
force_rgl> df(natom) 0.00000 0.00000 0.00000
1005.0000 60 0 -147.97374 3.20041 1.88243 -148.14946 298.96673
1010.0000 60 0 -149.98832 2.70865 1.83657 -148.85240 390.35963
1015.0000 60 0 -150.17069 2.65960 1.76346 -149.97284 346.54313
1020.0000 60 0 -150.38403 2.24674 1.74909 -150.19316 330.81910
1025.0000 60 0 -150.27896 2.61767 1.73718 -150.37569 320.18132
1030.0000 60 0 -150.81776 2.40271 1.73817 -150.36042 320.62382
1035.0000 60 0 -150.44650 2.78272 1.72353 -150.58484 304.09066
1040.0000 60 0 -150.78135 2.06190 1.70960 -150.79830 297.89996
1045.0000 60 0 -150.53715 2.61187 1.70708 -150.83698 292.73459
1050.0000 60 0 -150.39809 2.44862 1.75793 -150.05764 339.51413
1055.0000 60 0 -150.56103 2.34968 1.73185 -150.45740 316.43686
1060.0000 60 0 -150.62816 2.27901 1.70550 -150.86125 291.06507
1065.0000 60 0 -150.40562 2.70702 1.73448 -150.41706 314.33419
1070.0000 60 0 -151.05014 2.08224 1.71634 -150.69499 297.73616
1075.0000 60 0 -150.62576 2.29345 1.71579 -150.70347 303.26053
1080.0000 60 0 -151.09291 2.16983 1.71582 -150.70303 303.77058
1085.0000 60 0 -150.63735 2.65720 1.70677 -150.84167 291.58607
1090.0000 60 0 -151.08329 2.28028 1.71941 -150.64806 299.12198
1095.0000 60 0 -150.75123 2.66704 1.68618 -151.15736 271.51088
1100.0000 60 0 -151.12688 2.42095 1.70371 -150.88857 291.31264
1105.0000 60 0 -150.66061 2.20994 1.70133 -150.92513 286.59655
1110.0000 60 0 -149.75804 2.61874 1.75423 -150.11432 333.31571
1115.0000 60 0 -150.21875 2.48771 1.74422 -150.26775 327.03639
1120.0000 60 0 -150.07962 2.80992 1.74217 -150.29920 326.66625
1125.0000 60 0 -151.10452 2.30530 1.70338 -150.89373 289.63755
1130.0000 60 0 -151.06499 2.06068 1.69089 -151.08517 277.87627
1135.0000 60 0 -151.31779 1.71038 1.68555 -151.16699 272.79447
1140.0000 60 0 -151.44324 2.05035 1.66232 -151.52293 249.54018
1145.0000 60 0 -150.30586 2.64605 1.69334 -151.04759 276.27334
1150.0000 60 0 -149.54710 2.58544 1.76934 -149.88270 353.23472
1155.0000 60 0 -150.12786 2.34571 1.76206 -149.99428 343.29793
1160.0000 60 0 -149.89906 2.90654 1.76327 -149.97577 344.48476
1165.0000 60 0 -150.51975 2.55960 1.75249 -150.14095 332.32417
1170.0000 60 0 -150.54848 2.61105 1.73241 -150.44875 317.39944
1175.0000 60 0 -150.60258 2.47144 1.71867 -150.65936 303.44133
1180.0000 60 0 -150.09754 2.50916 1.73474 -150.41309 319.98536
1185.0000 60 0 -150.40842 2.51999 1.74842 -150.20338 333.33365
1190.0000 60 0 -150.58279 2.25957 1.70448 -150.87681 285.90065
1195.0000 60 0 -150.47505 2.51073 1.71049 -150.78475 296.30389
1200.0000 60 0 -150.91613 2.31039 1.73400 -150.42441 322.53708
1205.0000 60 0 -150.59016 2.35153 1.70010 -150.94390 284.06117
1210.0000 60 0 -150.71893 2.44765 1.72269 -150.59773 307.48385
1215.0000 60 0 -150.61769 2.22651 1.72922 -150.49772 309.42302
1220.0000 60 0 -150.29615 2.51172 1.73105 -150.46963 313.92864
1225.0000 60 0 -150.97756 2.02071 1.71936 -150.64871 299.40304
1230.0000 60 0 -150.60306 2.08408 1.71213 -150.75961 296.56941
1235.0000 60 0 -150.62892 2.19664 1.72766 -150.52163 310.94860
1240.0000 60 0 -150.43278 2.52075 1.70809 -150.82149 296.05333
1245.0000 60 0 -150.29041 2.40828 1.74683 -150.22770 334.13134
1250.0000 60 0 -150.49001 2.39460 1.73183 -150.45761 318.54803
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.26987 -0.53833 2.95610
force_rgl> df(natom) 0.00000 0.00000 0.00000
1255.0000 61 0 -151.06742 2.92785 1.90483 -150.43271 337.56310
1260.0000 61 0 -153.00948 2.48989 1.79981 -152.06012 368.92856
1265.0000 61 0 -153.17858 2.47140 1.71289 -153.40707 295.16485
1270.0000 61 0 -153.68519 2.23975 1.70749 -153.49079 283.98399
1275.0000 61 0 -153.16237 2.43455 1.72884 -153.15984 305.48108
1280.0000 61 0 -152.88044 2.76536 1.75234 -152.79570 327.69317
1285.0000 61 0 -153.50226 2.19728 1.72382 -153.23764 300.50108
1290.0000 61 0 -153.78941 2.16571 1.70722 -153.49488 284.77980
1295.0000 61 0 -153.27606 2.30337 1.70296 -153.56090 279.23964
1300.0000 61 0 -153.57414 1.94785 1.73587 -153.05089 312.74983
1305.0000 61 0 -153.11043 2.19014 1.72223 -153.26235 303.50726
1310.0000 61 0 -152.88993 2.35106 1.72840 -153.16673 303.43787
1315.0000 61 0 -153.36502 2.22177 1.75524 -152.75073 328.09944
1320.0000 61 0 -152.88302 2.31813 1.72498 -153.21970 302.32202
1325.0000 61 0 -153.28955 2.28251 1.71962 -153.30271 292.82284
1330.0000 61 0 -153.03567 2.22650 1.72823 -153.16931 305.31517
1335.0000 61 0 -153.89650 1.97622 1.71568 -153.36385 288.14188
1340.0000 61 0 -153.22958 2.37352 1.70532 -153.52441 281.73079
1345.0000 61 0 -153.33576 2.29826 1.72739 -153.18237 303.09360
1350.0000 61 0 -153.27566 2.36121 1.71463 -153.38008 292.23458
1355.0000 61 0 -153.85248 2.24146 1.71319 -153.40242 293.25022
1360.0000 61 0 -153.16545 2.54459 1.70474 -153.53341 282.97545
1365.0000 61 0 -153.23196 2.51493 1.73287 -153.09750 301.74862
1370.0000 61 0 -153.24922 2.56372 1.72888 -153.15924 306.25040
1375.0000 61 0 -152.96585 2.49536 1.73994 -152.98781 316.02401
1380.0000 61 0 -153.10064 2.38900 1.72789 -153.17458 304.54183
1385.0000 61 0 -152.79101 2.61219 1.76156 -152.65283 340.06915
1390.0000 61 0 -153.43386 2.24540 1.75445 -152.76297 330.82074
1395.0000 61 0 -153.23864 2.38795 1.71701 -153.34312 294.79149
1400.0000 61 0 -153.89505 1.88198 1.70563 -153.51955 282.76760
1405.0000 61 0 -153.31521 2.40796 1.69110 -153.74467 270.35714
1410.0000 61 0 -153.41614 2.33047 1.73891 -153.00377 314.70487
1415.0000 61 0 -153.62984 2.23173 1.70510 -153.52775 282.26072
1420.0000 61 0 -153.98314 2.25276 1.67159 -154.04703 249.87934
1425.0000 61 0 -153.30258 2.26191 1.71345 -153.39842 292.84723
1430.0000 61 0 -153.52976 2.24872 1.71906 -153.31137 298.61002
1435.0000 61 0 -153.07666 2.46330 1.72351 -153.24242 301.01585
1440.0000 61 0 -153.63202 2.31675 1.72155 -153.27288 301.82244
1445.0000 61 0 -153.51440 2.03838 1.70415 -153.54247 281.05945
1450.0000 61 0 -152.97595 2.46138 1.72202 -153.26551 298.22838
1455.0000 61 0 -152.93945 2.38415 1.74346 -152.93327 321.98429
1460.0000 61 0 -153.23474 2.35603 1.71864 -153.31787 297.06004
1465.0000 61 0 -152.82085 2.70497 1.74311 -152.93871 316.17154
1470.0000 61 0 -152.47859 2.54434 1.75352 -152.77738 327.21779
1475.0000 61 0 -153.16098 2.07480 1.74174 -152.95994 316.90317
1480.0000 61 0 -153.02381 2.28001 1.72935 -153.15198 304.67363
1485.0000 61 0 -152.66708 2.49706 1.74348 -152.93298 324.13327
1490.0000 61 0 -153.38196 2.24508 1.74213 -152.95401 317.07974
1495.0000 61 0 -153.17802 2.39054 1.71066 -153.44155 288.88700
1500.0000 61 0 -153.85666 2.19931 1.70165 -153.58126 278.34012
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.47644 -1.60091 2.68335
force_rgl> df(natom) 0.00000 0.00000 0.00000
1505.0000 62 0 -153.92482 2.57311 1.85214 -153.88646 263.83591
1510.0000 62 0 -155.21859 2.47077 1.80712 -154.59170 348.65621
1515.0000 62 0 -154.99324 2.69316 1.78041 -155.01002 331.85674
1520.0000 62 0 -155.28000 2.43457 1.78853 -154.88292 331.68055
1525.0000 62 0 -155.68799 2.13120 1.75703 -155.37625 304.65177
1530.0000 62 0 -155.37829 2.49411 1.73772 -155.67872 296.50843
1535.0000 62 0 -155.58674 2.55013 1.74346 -155.58886 308.82489
1540.0000 62 0 -155.74864 2.31307 1.74029 -155.63856 299.58056
1545.0000 62 0 -156.61245 1.80178 1.70329 -156.21810 281.34948
1550.0000 62 0 -156.45763 1.93281 1.70528 -156.18692 283.16419
1555.0000 62 0 -155.91038 2.72958 1.70248 -156.23075 282.06427
1560.0000 62 0 -155.88880 2.26497 1.72342 -155.90280 298.50655
1565.0000 62 0 -156.13669 2.35616 1.71417 -156.04767 292.81340
1570.0000 62 0 -155.87055 2.65783 1.72746 -155.83954 300.79855
1575.0000 62 0 -155.80785 2.36657 1.72295 -155.91018 302.50941
1580.0000 62 0 -155.71001 2.33939 1.73519 -155.71849 313.84640
1585.0000 62 0 -155.08172 2.74372 1.77013 -155.17106 345.06397
1590.0000 62 0 -156.27130 2.14196 1.74653 -155.54080 318.24402
1595.0000 62 0 -155.84857 2.48599 1.71897 -155.97256 291.50841
1600.0000 62 0 -156.05631 2.22944 1.72129 -155.93620 299.00589
1605.0000 62 0 -156.25176 1.89557 1.71507 -156.03354 295.04472
1610.0000 62 0 -156.19087 2.37425 1.68547 -156.49721 267.49022
1615.0000 62 0 -155.88997 2.42483 1.73232 -155.76341 311.27954
1620.0000 62 0 -156.11320 2.25866 1.71880 -155.97519 298.41119
1625.0000 62 0 -156.19662 2.33675 1.71359 -156.05681 293.66360
1630.0000 62 0 -156.52739 2.11375 1.69321 -156.37601 273.92710
1635.0000 62 0 -155.42802 2.90275 1.70037 -156.26385 280.05297
1640.0000 62 0 -156.10789 2.17379 1.72139 -155.93456 298.70560
1645.0000 62 0 -156.96918 1.68544 1.68878 -156.44545 268.84415
1650.0000 62 0 -155.95306 2.51335 1.68012 -156.58107 258.42253
1655.0000 62 0 -155.65317 2.39023 1.72259 -155.91585 299.34611
1660.0000 62 0 -156.40627 2.07059 1.72020 -155.95320 299.41579
1665.0000 62 0 -156.54705 1.95314 1.69066 -156.41596 271.44528
1670.0000 62 0 -156.35218 2.15841 1.69651 -156.32436 272.80538
1675.0000 62 0 -155.57711 2.61131 1.71495 -156.03541 291.21271
1680.0000 62 0 -155.79059 2.42592 1.74821 -155.51440 324.17463
1685.0000 62 0 -155.92554 2.42861 1.74257 -155.60288 315.28760
1690.0000 62 0 -156.04740 1.97105 1.71275 -156.06994 290.72449
1695.0000 62 0 -155.90968 2.41601 1.70327 -156.21842 280.49299
1700.0000 62 0 -155.82981 2.71030 1.73104 -155.78341 310.59107
1705.0000 62 0 -156.00052 2.12688 1.73262 -155.75862 305.10816
1710.0000 62 0 -155.58022 2.25518 1.73094 -155.78499 308.14829
1715.0000 62 0 -156.18541 2.63722 1.72391 -155.89506 300.39036
1720.0000 62 0 -156.18665 2.33648 1.70927 -156.12442 287.52069
1725.0000 62 0 -156.14335 2.38290 1.72200 -155.92506 300.47275
1730.0000 62 0 -155.58478 2.80611 1.74031 -155.63815 317.32457
1735.0000 62 0 -156.30785 2.01809 1.71441 -156.04392 292.01654
1740.0000 62 0 -156.63358 1.99748 1.69186 -156.39720 271.86733
1745.0000 62 0 -155.99508 2.28164 1.69942 -156.27875 281.25820
1750.0000 62 0 -155.96408 2.12252 1.71695 -156.00414 294.87124
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.37000 2.69415 0.97100
force_rgl> df(natom) 0.00000 0.00000 0.00000
1755.0000 63 0 -156.60857 3.26747 1.86624 -156.30208 284.48055
1760.0000 63 0 -157.37928 2.84835 1.79686 -157.40057 353.47320
1765.0000 63 0 -158.37697 2.36759 1.76637 -157.88328 326.54705
1770.0000 63 0 -157.81034 2.69602 1.75055 -158.13379 313.23701
1775.0000 63 0 -157.84377 2.84983 1.76996 -157.82648 330.08900
1780.0000 63 0 -157.72570 2.52856 1.74961 -158.14863 306.11318
1785.0000 63 0 -158.27544 2.35466 1.75303 -158.09439 311.88097
1790.0000 63 0 -158.34347 2.66130 1.75047 -158.13501 309.49530
1795.0000 63 0 -157.55067 2.90045 1.79153 -157.48482 346.30410
1800.0000 63 0 -158.12430 2.53014 1.76474 -157.90899 322.26598
1805.0000 63 0 -157.81739 2.17796 1.75176 -158.11456 312.37728
1810.0000 63 0 -157.93520 2.65364 1.76927 -157.83739 333.24859
1815.0000 63 0 -158.51450 2.17901 1.74340 -158.24700 301.66236
1820.0000 63 0 -158.99277 2.05395 1.72347 -158.56252 287.33816
1825.0000 63 0 -159.15569 2.25559 1.69528 -159.00888 256.69374
1830.0000 63 0 -158.01644 2.52876 1.72831 -158.48579 285.90472
1835.0000 63 0 -158.13857 2.43701 1.74766 -158.17941 309.43898
1840.0000 63 0 -157.94234 2.58973 1.75567 -158.05260 314.77437
1845.0000 63 0 -158.76731 1.95686 1.73362 -158.40172 298.81982
1850.0000 63 0 -158.27636 2.29840 1.72071 -158.60624 280.70984
1855.0000 63 0 -158.56336 2.26069 1.73638 -158.35809 293.91188
1860.0000 63 0 -157.95831 2.59656 1.73705 -158.34751 295.94883
1865.0000 63 0 -158.48993 2.14434 1.74807 -158.17307 306.62246
1870.0000 63 0 -158.13547 2.60082 1.73699 -158.34838 297.90137
1875.0000 63 0 -157.93276 2.59730 1.75765 -158.02125 317.68196
1880.0000 63 0 -158.12753 2.71226 1.73605 -158.36333 296.96859
1885.0000 63 0 -158.22883 1.99691 1.75012 -158.14058 311.88416
1890.0000 63 0 -157.41940 2.79214 1.77015 -157.82336 316.39359
1895.0000 63 0 -157.69741 2.59079 1.80702 -157.23970 360.05879
1900.0000 63 0 -158.16152 2.79602 1.76169 -157.95727 337.04246
1905.0000 63 0 -158.14116 2.54613 1.75612 -158.04553 328.17038
1910.0000 63 0 -158.08336 2.66145 1.74595 -158.20655 323.25148
1915.0000 63 0 -158.67133 2.49104 1.73914 -158.31434 314.39034
1920.0000 63 0 -158.29856 2.21309 1.73346 -158.40433 306.01489
1925.0000 63 0 -158.42611 2.38779 1.74091 -158.28638 314.18818
1930.0000 63 0 -158.07244 2.44355 1.75155 -158.11786 316.84717
1935.0000 63 0 -157.36246 3.08967 1.77087 -157.81206 336.68728
1940.0000 63 0 -158.09368 2.37382 1.77655 -157.72212 343.98730
1945.0000 63 0 -158.39172 2.25839 1.73665 -158.35376 306.64894
1950.0000 63 0 -158.40192 2.43801 1.72963 -158.46502 295.58653
1955.0000 63 0 -158.24612 2.68293 1.72146 -158.59423 295.58158
1960.0000 63 0 -158.69147 2.54231 1.72911 -158.47314 302.04265
1965.0000 63 0 -158.83202 2.24483 1.70700 -158.82328 282.00295
1970.0000 63 0 -159.26244 2.42488 1.70846 -158.80006 285.29409
1975.0000 63 0 -158.59900 2.23491 1.71676 -158.66875 290.40828
1980.0000 63 0 -158.67741 2.30227 1.72700 -158.50654 299.94097
1985.0000 63 0 -158.14222 2.95127 1.72870 -158.47961 300.63119
1990.0000 63 0 -158.21529 2.45220 1.75495 -158.06400 324.55747
1995.0000 63 0 -158.34686 2.56737 1.74281 -158.25620 314.52524
2000.0000 63 0 -158.41212 2.39892 1.73287 -158.41359 306.41118
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.91143 -0.51456 -2.06441
force_rgl> df(natom) 0.00000 0.00000 0.00000
2005.0000 64 0 -158.60168 3.24647 1.90212 -158.36611 306.98341
2010.0000 64 0 -160.15797 3.02167 1.84088 -159.34598 369.54662
2015.0000 64 0 -160.19510 2.57434 1.78430 -160.25118 325.48232
2020.0000 64 0 -160.48712 2.74132 1.78660 -160.21446 333.41401
2025.0000 64 0 -160.56888 2.48281 1.76469 -160.56501 307.14176
2030.0000 64 0 -160.20722 2.85319 1.77872 -160.34056 318.96971
2035.0000 64 0 -160.63106 2.65300 1.74950 -160.80798 297.23453
2040.0000 64 0 -161.30083 1.83245 1.75588 -160.70591 301.32294
2045.0000 64 0 -161.02344 2.71634 1.72231 -161.24301 275.74542
2050.0000 64 0 -161.51623 2.26155 1.72746 -161.16056 280.71892
2055.0000 64 0 -160.56078 2.46207 1.74085 -160.94647 306.36218
2060.0000 64 0 -160.93231 3.04504 1.74545 -160.87278 311.24486
2065.0000 64 0 -160.87279 2.60844 1.74478 -160.88352 305.63757
2070.0000 64 0 -160.48092 2.76807 1.77133 -160.45876 327.86319
2075.0000 64 0 -160.63252 2.56071 1.75817 -160.66925 312.62953
2080.0000 64 0 -160.78769 2.32847 1.75323 -160.74826 312.55338
2085.0000 64 0 -160.89984 2.43183 1.75519 -160.71691 317.62822
2090.0000 64 0 -161.24837 2.30546 1.73482 -161.04291 297.96418
2095.0000 64 0 -160.84887 2.49780 1.72464 -161.20569 286.29973
2100.0000 64 0 -160.95169 2.38378 1.75140 -160.77766 310.14613
2105.0000 64 0 -160.47785 2.95167 1.76131 -160.61910 321.24651
2110.0000 64 0 -160.84000 2.36144 1.76378 -160.57951 321.67150
2115.0000 64 0 -161.26216 2.56164 1.74357 -160.90289 298.78539
2120.0000 64 0 -160.61400 2.89510 1.73813 -160.98995 293.75664
2125.0000 64 0 -160.93204 2.34795 1.75349 -160.74410 307.74570
2130.0000 64 0 -160.92417 2.20415 1.74859 -160.82249 307.85551
2135.0000 64 0 -160.90288 2.52465 1.74817 -160.82928 306.59048
2140.0000 64 0 -161.36869 2.16525 1.73724 -161.00411 296.24363
2145.0000 64 0 -161.34175 2.40259 1.72335 -161.22639 285.83130
2150.0000 64 0 -161.28369 2.65521 1.72106 -161.26311 285.56960
2155.0000 64 0 -161.06175 2.67424 1.73449 -161.04815 295.62131
2160.0000 64 0 -161.40617 1.97151 1.72605 -161.18312 285.68408
2165.0000 64 0 -160.97132 2.37313 1.72582 -161.18684 287.24179
2170.0000 64 0 -160.58874 2.54048 1.75743 -160.68109 308.82910
2175.0000 64 0 -161.26964 2.88480 1.73814 -160.98981 297.64061
2180.0000 64 0 -160.88635 2.43100 1.72975 -161.12398 287.05608
2185.0000 64 0 -160.60375 2.42775 1.74091 -160.94541 303.77464
2190.0000 64 0 -161.13403 2.53407 1.74167 -160.93329 305.82944
2195.0000 64 0 -160.92881 2.74698 1.73928 -160.97153 302.50531
2200.0000 64 0 -160.91293 2.28294 1.75299 -160.75211 313.37760
2205.0000 64 0 -160.51722 2.75622 1.73285 -161.07440 292.49166
2210.0000 64 0 -160.93743 2.30810 1.74080 -160.94723 294.49105
2215.0000 64 0 -160.63908 2.80166 1.74086 -160.94627 302.38544
2220.0000 64 0 -160.91318 2.56185 1.75544 -160.71297 314.42448
2225.0000 64 0 -160.88042 2.59745 1.75350 -160.74406 314.51961
2230.0000 64 0 -161.84192 2.06903 1.70941 -161.44942 269.55961
2235.0000 64 0 -161.59399 2.16557 1.69919 -161.61290 264.53323
2240.0000 64 0 -161.05654 2.53754 1.73488 -161.04199 297.07839
2245.0000 64 0 -161.01257 2.14169 1.73254 -161.07932 293.21482
2250.0000 64 0 -160.87580 2.28399 1.76216 -160.60544 317.77009
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.79443 -1.90953 -0.72792
force_rgl> df(natom) 0.00000 0.00000 0.00000
2255.0000 65 0 -160.82725 3.50349 1.92045 -160.70349 329.86189
2260.0000 65 0 -162.71067 2.42299 1.83632 -162.06359 367.29148
2265.0000 65 0 -162.67398 3.06642 1.79530 -162.72670 331.27934
2270.0000 65 0 -163.30650 2.74835 1.76009 -163.29592 304.08539
2275.0000 65 0 -163.12991 2.68119 1.74638 -163.51755 291.15705
2280.0000 65 0 -163.15840 2.51580 1.77278 -163.09081 314.59480
2285.0000 65 0 -163.49416 2.24103 1.74549 -163.53199 283.48995
2290.0000 65 0 -163.28785 2.85894 1.75931 -163.30864 305.64175
2295.0000 65 0 -163.91371 2.05898 1.74178 -163.59190 286.56554
2300.0000 65 0 -163.64021 2.21104 1.74202 -163.58806 280.57376
2305.0000 65 0 -163.65284 2.23174 1.75338 -163.40446 295.57533
2310.0000 65 0 -163.17457 2.49398 1.75223 -163.42307 291.75723
2315.0000 65 0 -163.19950 2.22124 1.78082 -162.96078 319.81808
2320.0000 65 0 -162.46019 2.78252 1.77252 -163.09495 315.54891
2325.0000 65 0 -163.15857 2.53210 1.79906 -162.66596 340.07833
2330.0000 65 0 -163.01923 2.61157 1.78147 -162.95040 321.19168
2335.0000 65 0 -163.24659 2.24900 1.77376 -163.07495 310.36554
2340.0000 65 0 -163.19390 2.61114 1.75133 -163.43758 293.70389
2345.0000 65 0 -163.61557 2.38331 1.75683 -163.34867 300.59783
2350.0000 65 0 -164.00763 2.04137 1.75170 -163.43158 303.34500
2355.0000 65 0 -162.84422 2.67229 1.73603 -163.68486 283.51999
2360.0000 65 0 -162.85488 2.88062 1.78236 -162.93600 327.78763
2365.0000 65 0 -163.91444 2.28330 1.74964 -163.46492 296.54065
2370.0000 65 0 -163.34467 2.04284 1.73949 -163.62893 286.22036
2375.0000 65 0 -163.84561 2.38828 1.71127 -164.08514 260.48699
2380.0000 65 0 -163.26086 2.77401 1.74247 -163.58080 298.20861
2385.0000 65 0 -163.85711 2.38268 1.74279 -163.57570 300.85966
2390.0000 65 0 -163.20300 2.41740 1.75355 -163.40173 311.23077
2395.0000 65 0 -163.19332 2.86379 1.76715 -163.18190 321.40248
2400.0000 65 0 -163.43479 2.41751 1.75972 -163.30195 312.46193
2405.0000 65 0 -163.47798 2.43766 1.71925 -163.95617 275.95485
2410.0000 65 0 -163.04039 2.87035 1.75628 -163.35754 312.94262
2415.0000 65 0 -163.41024 2.47624 1.76496 -163.21731 314.82854
2420.0000 65 0 -163.65381 2.29936 1.75499 -163.37835 312.07978
2425.0000 65 0 -163.62945 2.54479 1.73789 -163.65486 291.53655
2430.0000 65 0 -163.50560 2.74139 1.74255 -163.57959 296.42953
2435.0000 65 0 -163.16122 2.47816 1.74078 -163.60818 294.62694
2440.0000 65 0 -162.97690 2.73637 1.77850 -162.99832 329.53825
2445.0000 65 0 -163.20966 2.24724 1.76423 -163.22898 319.03637
2450.0000 65 0 -163.10377 2.79761 1.75087 -163.44498 305.07321
2455.0000 65 0 -163.24014 2.58599 1.75926 -163.30942 312.79419
2460.0000 65 0 -163.80603 2.28171 1.74643 -163.51681 305.38458
2465.0000 65 0 -163.73406 2.61708 1.72722 -163.82735 289.40565
2470.0000 65 0 -162.69562 3.03358 1.76342 -163.24209 318.11804
2475.0000 65 0 -163.20696 2.46062 1.75447 -163.38679 311.22440
2480.0000 65 0 -163.69974 2.42292 1.73881 -163.63992 299.19103
2485.0000 65 0 -163.19690 2.63043 1.75047 -163.45148 311.96194
2490.0000 65 0 -163.99784 2.45540 1.73004 -163.78184 293.41797
2495.0000 65 0 -164.88079 1.95382 1.68242 -164.55159 251.86458
2500.0000 65 0 -163.93661 2.30127 1.68361 -164.53232 255.80141
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.12943 1.73173 1.74329
force_rgl> df(natom) 0.00000 0.00000 0.00000
2505.0000 66 0 -163.76584 3.61545 1.90433 -163.59915 323.78755
2510.0000 66 0 -164.57649 3.11199 1.87751 -164.03726 400.74906
2515.0000 66 0 -165.36860 2.60593 1.81417 -165.07162 349.30755
2520.0000 66 0 -165.38802 2.78823 1.78290 -165.58233 319.22475
2525.0000 66 0 -165.12683 2.83358 1.79649 -165.36040 344.40518
2530.0000 66 0 -165.64300 2.75256 1.79828 -165.33112 345.77917
2535.0000 66 0 -166.41762 2.18748 1.75651 -166.01332 309.17448
2540.0000 66 0 -166.71629 2.30296 1.73222 -166.41004 285.19551
2545.0000 66 0 -166.83573 2.02216 1.72297 -166.56118 275.53362
2550.0000 66 0 -166.73095 2.42033 1.71437 -166.70157 267.02331
2555.0000 66 0 -166.15907 2.54499 1.72856 -166.46977 286.09165
2560.0000 66 0 -165.84680 2.81004 1.75695 -166.00617 312.84177
2565.0000 66 0 -166.56585 2.27502 1.74726 -166.16435 299.75532
2570.0000 66 0 -165.79319 2.71167 1.74051 -166.27465 294.25258
2575.0000 66 0 -165.67980 2.86606 1.76954 -165.80059 320.06092
2580.0000 66 0 -166.17651 2.67534 1.77697 -165.67914 326.70651
2585.0000 66 0 -166.10884 2.39736 1.75378 -166.05789 305.85435
2590.0000 66 0 -166.13371 2.38120 1.74158 -166.25714 295.37205
2595.0000 66 0 -166.14184 2.73638 1.73893 -166.30049 295.52426
2600.0000 66 0 -166.41794 2.53420 1.74466 -166.20693 299.33436
2605.0000 66 0 -165.96884 2.84520 1.76311 -165.90550 311.95375
2610.0000 66 0 -166.62690 2.22760 1.74180 -166.25364 299.16339
2615.0000 66 0 -165.98312 3.01855 1.73628 -166.34369 289.83396
2620.0000 66 0 -166.22624 2.44041 1.74667 -166.17401 299.09771
2625.0000 66 0 -166.33926 2.65429 1.72624 -166.50767 278.46818
2630.0000 66 0 -166.28065 2.54432 1.73831 -166.31057 292.26097
2635.0000 66 0 -165.65545 2.37160 1.75422 -166.05074 305.38120
2640.0000 66 0 -166.14138 2.17315 1.75362 -166.06052 305.06521
2645.0000 66 0 -166.37174 2.30794 1.74676 -166.17253 300.24188
2650.0000 66 0 -166.52484 2.01092 1.73964 -166.28886 295.60860
2655.0000 66 0 -165.65655 2.89339 1.72792 -166.48030 285.12719
2660.0000 66 0 -166.22717 2.59040 1.74598 -166.18526 300.66218
2665.0000 66 0 -166.33238 2.69720 1.74937 -166.13001 303.25878
2670.0000 66 0 -166.15313 2.69959 1.73933 -166.29384 291.58430
2675.0000 66 0 -166.45319 2.35424 1.74104 -166.26594 295.84416
2680.0000 66 0 -166.12154 2.61312 1.73480 -166.36794 290.93331
2685.0000 66 0 -165.65202 3.09015 1.77088 -165.77870 323.46326
2690.0000 66 0 -165.47882 2.90238 1.75929 -165.96799 308.77610
2695.0000 66 0 -165.57617 2.59004 1.78337 -165.57468 335.56149
2700.0000 66 0 -165.82807 2.57617 1.77267 -165.74942 314.96486
2705.0000 66 0 -166.20220 2.16945 1.75891 -165.97420 300.92104
2710.0000 66 0 -166.23787 2.23555 1.75190 -166.08871 282.62473
2715.0000 66 0 -166.59790 2.25279 1.72702 -166.49504 270.10076
2720.0000 66 0 -166.04467 2.63268 1.73964 -166.28894 282.40970
2725.0000 66 0 -166.09561 2.37347 1.74558 -166.19190 288.09015
2730.0000 66 0 -165.77517 2.81471 1.75571 -166.02633 294.86928
2735.0000 66 0 -165.64176 2.53614 1.77594 -165.69607 316.03568
2740.0000 66 0 -165.59838 2.27969 1.80162 -165.27656 333.67287
2745.0000 66 0 -165.80194 2.57577 1.77868 -165.65134 309.17802
2750.0000 66 0 -165.46702 2.82632 1.77404 -165.72704 306.90593
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.31319 -0.39878 -1.98883
force_rgl> df(natom) 0.00000 0.00000 0.00000
2755.0000 67 0 -165.65214 3.51556 1.95270 -165.43797 331.11296
2760.0000 67 0 -167.81555 2.82270 1.87427 -166.73179 386.24331
2765.0000 67 0 -167.37284 2.90105 1.81893 -167.64463 341.23132
2770.0000 67 0 -167.98131 2.87930 1.80861 -167.81493 337.85851
2775.0000 67 0 -168.50843 2.84553 1.76601 -168.51760 295.68725
2780.0000 67 0 -168.69139 2.35187 1.76571 -168.52247 294.86564
2785.0000 67 0 -168.23669 3.09269 1.77622 -168.34914 308.91981
2790.0000 67 0 -168.39030 3.01348 1.80065 -167.94623 333.73789
2795.0000 67 0 -169.16722 2.31730 1.76201 -168.58353 301.58174
2800.0000 67 0 -169.11134 2.34859 1.72307 -169.22586 266.20321
2805.0000 67 0 -168.52488 2.85984 1.74136 -168.92423 283.61908
2810.0000 67 0 -168.29706 2.81706 1.77585 -168.35520 313.67490
2815.0000 67 0 -168.04926 3.19085 1.79956 -167.96413 338.75519
2820.0000 67 0 -168.58898 2.51331 1.76602 -168.51739 303.63165
2825.0000 67 0 -168.44727 2.79635 1.75992 -168.61808 295.17812
2830.0000 67 0 -167.95331 3.23683 1.77943 -168.29626 317.35097
2835.0000 67 0 -168.40123 2.66223 1.79901 -167.97327 330.05818
2840.0000 67 0 -168.32754 2.60970 1.78503 -168.20385 323.01736
2845.0000 67 0 -168.45484 2.51038 1.78311 -168.23548 318.87274
2850.0000 67 0 -168.51376 2.65118 1.75245 -168.74129 290.41088
2855.0000 67 0 -169.12033 2.26533 1.74420 -168.87735 283.73846
2860.0000 67 0 -169.20396 2.08689 1.73535 -169.02337 272.27002
2865.0000 67 0 -168.62066 2.46472 1.74099 -168.93028 282.60383
2870.0000 67 0 -168.42631 2.66352 1.76781 -168.48784 307.28306
2875.0000 67 0 -168.51032 2.78522 1.77363 -168.39190 310.61442
2880.0000 67 0 -168.44044 2.79717 1.76990 -168.45335 305.69581
2885.0000 67 0 -168.36161 2.74491 1.76897 -168.46884 305.71655
2890.0000 67 0 -168.33969 2.25413 1.77226 -168.41452 307.42715
2895.0000 67 0 -168.49972 2.62191 1.76768 -168.49007 302.85994
2900.0000 67 0 -168.62672 2.50931 1.75989 -168.61853 300.03832
2905.0000 67 0 -168.06007 2.78106 1.78248 -168.24597 314.91792
2910.0000 67 0 -168.41124 2.62529 1.80101 -167.94028 336.40229
2915.0000 67 0 -168.71672 2.17929 1.76044 -168.60948 301.99768
2920.0000 67 0 -168.82651 2.61391 1.74073 -168.93456 283.14401
2925.0000 67 0 -168.66496 2.20729 1.77643 -168.34578 312.30254
2930.0000 67 0 -168.51206 2.87371 1.75843 -168.64256 303.41240
2935.0000 67 0 -168.73140 2.58821 1.76108 -168.59889 305.48426
2940.0000 67 0 -168.91717 2.46628 1.75217 -168.74591 297.33883
2945.0000 67 0 -168.98944 2.25614 1.73584 -169.01529 280.02209
2950.0000 67 0 -168.66027 2.79174 1.78190 -168.25539 324.52666
2955.0000 67 0 -168.41430 2.32298 1.76144 -168.59293 303.25067
2960.0000 67 0 -168.56172 2.88266 1.77534 -168.36365 330.17959
2965.0000 67 0 -168.06558 3.21215 1.76101 -168.60002 320.92926
2970.0000 67 0 -168.50163 2.14571 1.78732 -168.16601 341.00426
2975.0000 67 0 -169.01538 2.66439 1.74894 -168.79914 313.01828
2980.0000 67 0 -169.94337 2.04567 1.71493 -169.36027 282.09153
2985.0000 67 0 -169.79470 1.93849 1.68673 -169.82541 254.02655
2990.0000 67 0 -169.08168 2.48235 1.69614 -169.67011 261.27607
2995.0000 67 0 -169.54429 2.14567 1.73006 -169.11058 295.51399
3000.0000 67 0 -169.11586 2.59484 1.73298 -169.06250 297.72938
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.86071 2.73900 0.16986
force_rgl> df(natom) 0.00000 0.00000 0.00000
3005.0000 68 0 -169.77416 3.05408 1.88193 -169.24724 311.22942
3010.0000 68 0 -170.73055 2.92013 1.81599 -170.34578 347.18465
3015.0000 68 0 -170.41455 3.06474 1.79915 -170.62634 335.03136
3020.0000 68 0 -171.50581 2.32817 1.78777 -170.81584 321.79554
3025.0000 68 0 -171.06144 2.67650 1.77983 -170.94828 314.87629
3030.0000 68 0 -170.87553 2.76635 1.77273 -171.06650 308.60925
3035.0000 68 0 -171.75840 2.18663 1.75381 -171.38165 289.66324
3040.0000 68 0 -172.39012 2.02302 1.71353 -172.05270 254.40566
3045.0000 68 0 -171.81032 2.28268 1.71960 -171.95169 262.32099
3050.0000 68 0 -171.29232 2.74611 1.76047 -171.27080 298.44422
3055.0000 68 0 -171.14867 2.26846 1.76225 -171.24100 298.02961
3060.0000 68 0 -170.90435 2.92013 1.76414 -171.20955 303.51079
3065.0000 68 0 -171.32430 2.30482 1.77919 -170.95884 311.78786
3070.0000 68 0 -171.45072 2.34435 1.75028 -171.44043 287.14739
3075.0000 68 0 -171.75898 2.18805 1.74990 -171.44689 282.58447
3080.0000 68 0 -171.14359 2.30979 1.73727 -171.65721 274.92536
3085.0000 68 0 -171.25334 2.68028 1.77497 -171.02922 306.17173
3090.0000 68 0 -170.86210 2.70427 1.76302 -171.22818 298.57975
3095.0000 68 0 -171.56972 2.54580 1.76939 -171.12207 307.40698
3100.0000 68 0 -171.70643 2.22889 1.73502 -171.69477 275.56159
3105.0000 68 0 -171.78602 2.23172 1.75081 -171.43161 291.55243
3110.0000 68 0 -171.57188 2.39610 1.74685 -171.49770 284.24490
3115.0000 68 0 -170.93429 2.25204 1.77511 -171.02678 300.59012
3120.0000 68 0 -171.27966 2.64973 1.76676 -171.16586 309.06058
3125.0000 68 0 -171.55946 2.60157 1.73928 -171.62382 280.41046
3130.0000 68 0 -171.92291 2.36066 1.72955 -171.78592 270.58864
3135.0000 68 0 -170.33363 3.08338 1.77462 -171.03494 312.94946
3140.0000 68 0 -171.15027 2.51865 1.80652 -170.50355 340.29358
3145.0000 68 0 -171.08552 2.82753 1.77982 -170.94832 316.65629
3150.0000 68 0 -171.07992 2.75985 1.77195 -171.07947 310.09603
3155.0000 68 0 -170.93718 2.49796 1.76841 -171.13837 307.90178
3160.0000 68 0 -171.62922 2.55279 1.75276 -171.39913 291.12098
3165.0000 68 0 -171.62185 2.17697 1.73902 -171.62810 280.63605
3170.0000 68 0 -171.29386 2.22495 1.73901 -171.62833 275.22555
3175.0000 68 0 -171.63012 2.22556 1.72556 -171.85232 266.92876
3180.0000 68 0 -171.70471 2.19070 1.73663 -171.66791 278.25483
3185.0000 68 0 -171.08899 2.83489 1.75467 -171.36729 296.60229
3190.0000 68 0 -170.89842 2.95240 1.79132 -170.75670 325.14434
3195.0000 68 0 -170.78937 2.77486 1.78157 -170.91919 316.72264
3200.0000 68 0 -170.92228 2.83556 1.77736 -170.98939 310.34314
3205.0000 68 0 -171.60295 2.43528 1.75375 -171.38268 291.09406
3210.0000 68 0 -171.08471 2.33167 1.75314 -171.39286 291.81631
3215.0000 68 0 -170.66711 2.79906 1.78779 -170.81555 316.96948
3220.0000 68 0 -170.99987 2.49089 1.78987 -170.78096 318.92876
3225.0000 68 0 -170.56457 2.80752 1.79576 -170.68286 329.44063
3230.0000 68 0 -171.32227 2.60460 1.77451 -171.03676 307.74793
3235.0000 68 0 -171.44683 2.66956 1.76122 -171.25819 297.78692
3240.0000 68 0 -170.77926 2.81909 1.75722 -171.32494 295.11977
3245.0000 68 0 -170.64341 2.92547 1.77522 -171.02503 312.29094
3250.0000 68 0 -171.49113 2.34915 1.76982 -171.11499 305.95338
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -2.29313 -2.14819 -2.30206
force_rgl> df(natom) 0.00000 0.00000 0.00000
3255.0000 69 0 -171.07513 3.23145 1.93411 -171.01285 323.80987
3260.0000 69 0 -172.72921 3.11342 1.87244 -172.05026 392.18376
3265.0000 69 0 -172.62880 3.06794 1.84138 -172.57281 365.81678
3270.0000 69 0 -173.52534 2.47499 1.80781 -173.13747 329.38777
3275.0000 69 0 -173.41163 2.81183 1.78656 -173.49495 305.60656
3280.0000 69 0 -174.64904 2.10985 1.75157 -174.08367 282.69747
3285.0000 69 0 -173.91225 2.56503 1.77479 -173.69292 301.59735
3290.0000 69 0 -173.87479 2.68376 1.77209 -173.73833 297.90557
3295.0000 69 0 -173.28934 2.82392 1.79729 -173.31455 322.93548
3300.0000 69 0 -173.48275 2.83177 1.80310 -173.21678 324.17899
3305.0000 69 0 -173.99095 2.65939 1.76250 -173.89968 293.55165
3310.0000 69 0 -174.59828 2.14612 1.74058 -174.26848 270.86495
3315.0000 69 0 -174.56677 2.48484 1.73110 -174.42797 261.83889
3320.0000 69 0 -174.01532 2.47479 1.74026 -174.27387 273.39509
3325.0000 69 0 -173.53040 2.61893 1.77761 -173.64551 302.44892
3330.0000 69 0 -174.10569 2.40909 1.76001 -173.94167 288.83321
3335.0000 69 0 -174.43028 2.37094 1.76312 -173.88931 290.69171
3340.0000 69 0 -174.20016 2.28145 1.75919 -173.95536 290.31401
3345.0000 69 0 -173.64294 2.99616 1.75039 -174.10348 281.89025
3350.0000 69 0 -173.82409 2.57312 1.76226 -173.90379 285.84543
3355.0000 69 0 -173.98227 2.30978 1.77075 -173.76097 295.01301
3360.0000 69 0 -174.27201 2.49262 1.74350 -174.21937 275.12100
3365.0000 69 0 -174.27455 2.27419 1.74425 -174.20674 271.72026
3370.0000 69 0 -173.88443 2.62861 1.75868 -173.96406 283.50516
3375.0000 69 0 -173.40185 2.94502 1.77156 -173.74741 300.30155
3380.0000 69 0 -173.77979 2.81583 1.76219 -173.90493 292.14984
3385.0000 69 0 -174.28301 2.69703 1.75754 -173.98323 286.76740
3390.0000 69 0 -174.14298 2.48225 1.74997 -174.11054 280.22735
3395.0000 69 0 -173.56989 2.83816 1.77601 -173.67245 307.36242
3400.0000 69 0 -173.43314 2.73535 1.77609 -173.67109 303.24271
3405.0000 69 0 -173.42709 2.79343 1.79311 -173.38474 321.66624
3410.0000 69 0 -173.64072 2.73291 1.78374 -173.54236 318.01787
3415.0000 69 0 -173.31025 3.18788 1.80121 -173.24854 321.17401
3420.0000 69 0 -173.33450 3.02441 1.79145 -173.41275 320.65213
3425.0000 69 0 -173.03583 2.58273 1.80283 -173.22128 327.95443
3430.0000 69 0 -173.39176 2.94254 1.80518 -173.18178 326.30246
3435.0000 69 0 -173.92662 2.58888 1.76796 -173.80785 297.54312
3440.0000 69 0 -173.61030 2.76878 1.74674 -174.16481 279.81510
3445.0000 69 0 -173.04440 3.29088 1.80071 -173.25701 325.87188
3450.0000 69 0 -173.30714 3.06451 1.81870 -172.95429 337.57889
3455.0000 69 0 -174.11652 2.46433 1.78436 -173.53196 310.66144
3460.0000 69 0 -173.68283 3.08639 1.76725 -173.81975 295.62286
3465.0000 69 0 -173.98328 2.09373 1.77603 -173.67206 300.19482
3470.0000 69 0 -174.25238 2.39917 1.75104 -174.09251 281.16648
3475.0000 69 0 -174.22592 2.45858 1.75339 -174.05304 284.23969
3480.0000 69 0 -173.20416 2.76981 1.75190 -174.07798 283.80633
3485.0000 69 0 -173.49679 2.77763 1.78884 -173.45666 309.86002
3490.0000 69 0 -173.36042 2.49707 1.79391 -173.37130 309.74454
3495.0000 69 0 -173.20420 2.95847 1.80087 -173.25420 319.28685
3500.0000 69 0 -173.18428 2.91685 1.81519 -173.01336 322.87393
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.66948 1.30127 -0.03144
force_rgl> df(natom) 0.00000 0.00000 0.00000
3505.0000 70 0 -173.92519 4.03055 1.94246 -173.50735 309.74704
3510.0000 70 0 -174.49229 3.16146 1.88697 -174.44979 385.46430
3515.0000 70 0 -175.40357 2.84841 1.84537 -175.15642 343.18130
3520.0000 70 0 -176.27494 2.32231 1.81753 -175.62929 319.94027
3525.0000 70 0 -175.84036 2.81067 1.80119 -175.90674 304.68972
3530.0000 70 0 -176.95832 2.21858 1.76280 -176.55878 277.10446
3535.0000 70 0 -175.96162 2.77168 1.77249 -176.39425 284.04001
3540.0000 70 0 -175.79389 2.61626 1.79415 -176.02645 307.38588
3545.0000 70 0 -175.91626 2.56277 1.81999 -175.58741 326.03440
3550.0000 70 0 -175.83909 2.85510 1.80731 -175.80288 324.61789
3555.0000 70 0 -176.29718 2.65352 1.80072 -175.91482 319.96189
3560.0000 70 0 -176.27230 3.16690 1.77450 -176.36009 289.75144
3565.0000 70 0 -176.02880 2.61200 1.77647 -176.32664 296.31762
3570.0000 70 0 -176.33000 2.54806 1.79225 -176.05861 305.34785
3575.0000 70 0 -176.30789 2.42072 1.76852 -176.46163 282.25865
3580.0000 70 0 -176.28710 2.95569 1.77017 -176.43364 288.79504
3585.0000 70 0 -176.27669 2.43685 1.77725 -176.31350 292.51083
3590.0000 70 0 -176.11331 2.58796 1.79095 -176.08072 300.74494
3595.0000 70 0 -176.12354 2.63895 1.78169 -176.23804 299.42017
3600.0000 70 0 -175.98713 2.90480 1.78497 -176.18224 304.03448
3605.0000 70 0 -176.26886 2.61009 1.78416 -176.19599 302.96772
3610.0000 70 0 -176.36307 2.88537 1.76377 -176.54231 283.51254
3615.0000 70 0 -175.92913 2.48458 1.79405 -176.02806 308.74533
3620.0000 70 0 -175.91791 2.68752 1.78702 -176.14748 301.71289
3625.0000 70 0 -175.19980 3.24060 1.82711 -175.46663 338.38263
3630.0000 70 0 -175.46574 3.09054 1.83472 -175.33732 345.34335
3635.0000 70 0 -175.14731 2.97289 1.83597 -175.31604 345.95833
3640.0000 70 0 -176.01159 2.72888 1.82095 -175.57115 331.43346
3645.0000 70 0 -176.86310 2.31131 1.74917 -176.79044 267.17232
3650.0000 70 0 -176.48410 2.84207 1.76622 -176.50076 286.18385
3655.0000 70 0 -176.64307 2.33243 1.77977 -176.27067 292.94549
3660.0000 70 0 -176.05311 2.59116 1.76396 -176.53912 283.06841
3665.0000 70 0 -176.00051 2.61064 1.80331 -175.87079 314.39968
3670.0000 70 0 -176.40742 2.59306 1.77656 -176.32520 292.86308
3675.0000 70 0 -176.68269 2.74590 1.74564 -176.85027 265.48691
3680.0000 70 0 -176.86730 2.57157 1.75769 -176.64560 278.08800
3685.0000 70 0 -176.72470 2.43813 1.74447 -176.87016 265.28361
3690.0000 70 0 -176.33149 2.47951 1.78455 -176.18939 300.46594
3695.0000 70 0 -176.39028 2.64153 1.78256 -176.22323 296.77175
3700.0000 70 0 -175.30448 2.94991 1.80518 -175.83895 315.83231
3705.0000 70 0 -175.95392 2.86985 1.80657 -175.81545 329.23090
3710.0000 70 0 -176.21104 2.80607 1.80221 -175.88953 330.17442
3715.0000 70 0 -176.38217 2.55512 1.76829 -176.46559 299.60432
3720.0000 70 0 -176.27524 2.93809 1.76630 -176.49947 297.74243
3725.0000 70 0 -176.36274 2.98904 1.77248 -176.39437 306.17985
3730.0000 70 0 -176.61266 2.88267 1.76693 -176.48879 301.28893
3735.0000 70 0 -177.04075 2.54879 1.75960 -176.61322 294.83789
3740.0000 70 0 -176.26485 2.67736 1.75222 -176.73848 288.68585
3745.0000 70 0 -176.60403 2.67904 1.78153 -176.24074 314.98964
3750.0000 70 0 -177.05916 2.55809 1.74647 -176.83630 282.22075
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.43818 -1.51455 0.11936
force_rgl> df(natom) 0.00000 0.00000 0.00000
3755.0000 71 0 -176.82882 3.36503 1.91921 -176.54253 313.83607
3760.0000 71 0 -178.72072 2.85672 1.82966 -178.07795 339.44219
3765.0000 71 0 -179.21891 2.85576 1.78163 -178.90159 306.65520
3770.0000 71 0 -179.14661 2.67136 1.76859 -179.12515 294.29338
3775.0000 71 0 -179.23662 2.57698 1.76558 -179.17670 289.62342
3780.0000 71 0 -178.71567 2.73860 1.78138 -178.90588 303.61439
3785.0000 71 0 -179.03125 2.66603 1.77679 -178.98455 302.02139
3790.0000 71 0 -179.18024 2.64851 1.76690 -179.15403 290.89788
3795.0000 71 0 -179.45840 2.28312 1.76293 -179.22215 287.57398
3800.0000 71 0 -179.56554 2.40415 1.75992 -179.27382 285.85461
3805.0000 71 0 -179.23644 2.63505 1.73413 -179.71599 261.53580
3810.0000 71 0 -179.35612 2.49267 1.76288 -179.22301 288.72681
3815.0000 71 0 -179.13500 2.58066 1.76483 -179.18956 288.83306
3820.0000 71 0 -178.99201 2.66933 1.78707 -178.80816 311.60344
3825.0000 71 0 -178.87618 2.94364 1.78186 -178.89751 302.11133
3830.0000 71 0 -178.39994 2.59651 1.78877 -178.77908 309.64789
3835.0000 71 0 -178.73862 2.48695 1.79459 -178.67937 316.32732
3840.0000 71 0 -178.59026 2.62163 1.78837 -178.78586 309.44780
3845.0000 71 0 -179.07521 2.86075 1.78507 -178.84258 306.53505
3850.0000 71 0 -178.17822 3.25745 1.78491 -178.84524 309.63370
3855.0000 71 0 -178.04356 3.13676 1.81595 -178.31306 333.93929
3860.0000 71 0 -178.65607 3.24961 1.82087 -178.22874 340.71745
3865.0000 71 0 -178.86001 2.28411 1.77464 -179.02139 298.99166
3870.0000 71 0 -178.52218 2.85590 1.79744 -178.63050 317.69524
3875.0000 71 0 -178.60889 3.39163 1.80254 -178.54297 325.00124
3880.0000 71 0 -178.79955 3.08788 1.79715 -178.63535 317.28136
3885.0000 71 0 -179.61265 2.41038 1.74574 -179.51685 273.63855
3890.0000 71 0 -179.49662 2.24919 1.75100 -179.42662 277.84509
3895.0000 71 0 -179.25549 2.36637 1.75833 -179.30098 286.43911
3900.0000 71 0 -179.21770 2.72828 1.77166 -179.07247 295.91355
3905.0000 71 0 -178.64215 2.99129 1.80907 -178.43106 329.65728
3910.0000 71 0 -179.04334 2.69390 1.77764 -178.96986 298.51701
3915.0000 71 0 -179.30427 3.05826 1.76794 -179.13630 293.05391
3920.0000 71 0 -179.36968 2.57514 1.75752 -179.31498 282.40544
3925.0000 71 0 -178.63747 2.53708 1.76726 -179.14786 292.39750
3930.0000 71 0 -178.36592 2.72441 1.78692 -178.81087 309.62098
3935.0000 71 0 -178.84977 2.67667 1.78584 -178.82933 308.61670
3940.0000 71 0 -178.97014 2.87715 1.77183 -179.06952 295.52258
3945.0000 71 0 -179.64557 2.38403 1.76227 -179.23346 289.00456
3950.0000 71 0 -179.01768 2.52529 1.76138 -179.24866 284.12648
3955.0000 71 0 -178.56987 2.97252 1.78704 -178.80875 309.22259
3960.0000 71 0 -179.21362 2.58499 1.78752 -178.80050 305.25621
3965.0000 71 0 -179.19101 2.54042 1.76428 -179.19898 281.95286
3970.0000 71 0 -179.24984 2.26725 1.75304 -179.39175 270.74001
3975.0000 71 0 -178.75704 3.10438 1.77685 -178.98341 291.36609
3980.0000 71 0 -179.08349 2.73092 1.79730 -178.63286 312.04027
3985.0000 71 0 -179.09822 2.49711 1.78153 -178.90314 310.03490
3990.0000 71 0 -178.96140 2.50358 1.78516 -178.84095 311.40395
3995.0000 71 0 -179.71936 2.56459 1.76606 -179.16852 295.93293
4000.0000 71 0 -179.11377 2.55532 1.76452 -179.19484 298.85370
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.77726 0.40831 1.92192
force_rgl> df(natom) 0.00000 0.00000 0.00000
4005.0000 72 0 -179.49471 3.26757 1.90295 -179.46573 298.24377
4010.0000 72 0 -181.67341 2.75467 1.82206 -180.86564 332.73316
4015.0000 72 0 -181.80742 2.45087 1.77789 -181.63012 296.43040
4020.0000 72 0 -181.86949 2.33236 1.76982 -181.76982 286.27906
4025.0000 72 0 -181.57315 3.02682 1.76540 -181.84626 281.42347
4030.0000 72 0 -181.68117 3.12180 1.77928 -181.60603 304.17054
4035.0000 72 0 -181.97606 2.44576 1.77904 -181.61014 301.06956
4040.0000 72 0 -182.34602 2.34110 1.75631 -182.00363 277.13071
4045.0000 72 0 -182.00139 2.88496 1.75321 -182.05727 276.68207
4050.0000 72 0 -181.76164 2.59687 1.76190 -181.90672 283.00222
4055.0000 72 0 -181.85083 2.54871 1.76574 -181.84028 288.10687
4060.0000 72 0 -181.49478 2.76301 1.78139 -181.56948 313.96881
4065.0000 72 0 -182.68610 2.59751 1.75857 -181.96446 290.73210
4070.0000 72 0 -182.12347 2.45794 1.73560 -182.36194 267.42039
4075.0000 72 0 -182.49162 2.59026 1.73411 -182.38784 265.02082
4080.0000 72 0 -182.04007 2.65326 1.73544 -182.36478 269.51714
4085.0000 72 0 -181.72186 2.83656 1.75829 -181.96922 287.30180
4090.0000 72 0 -182.18165 2.75675 1.76359 -181.87758 290.33486
4095.0000 72 0 -182.68529 2.44815 1.72147 -182.60646 254.01172
4100.0000 72 0 -181.78700 2.80060 1.74658 -182.17194 280.52930
4105.0000 72 0 -181.50759 3.10222 1.77655 -181.65319 301.02167
4110.0000 72 0 -181.00615 2.88412 1.79025 -181.41608 313.84953
4115.0000 72 0 -181.11834 3.10562 1.80128 -181.22520 330.24263
4120.0000 72 0 -181.53750 3.05666 1.80192 -181.21410 326.44959
4125.0000 72 0 -181.46021 2.76060 1.79672 -181.30417 322.68601
4130.0000 72 0 -181.84955 2.47235 1.78502 -181.50666 308.84573
4135.0000 72 0 -181.69779 2.79142 1.78149 -181.56777 305.42478
4140.0000 72 0 -181.63628 2.79426 1.77919 -181.60749 303.07985
4145.0000 72 0 -181.93106 2.53914 1.78314 -181.53913 309.70715
4150.0000 72 0 -181.41728 3.04809 1.76453 -181.86129 290.11868
4155.0000 72 0 -181.44261 2.79016 1.79098 -181.40347 317.54713
4160.0000 72 0 -181.36780 2.78880 1.78120 -181.57274 309.74033
4165.0000 72 0 -181.85804 2.68759 1.78595 -181.49060 314.08904
4170.0000 72 0 -181.59195 2.64942 1.76990 -181.76826 294.82514
4175.0000 72 0 -182.10035 2.60943 1.77089 -181.75129 294.96451
4180.0000 72 0 -181.61091 2.82029 1.75991 -181.94125 286.49080
4185.0000 72 0 -181.64591 2.81335 1.80075 -181.23449 322.60974
4190.0000 72 0 -181.66412 2.54036 1.78496 -181.50774 307.39848
4195.0000 72 0 -181.50943 3.03307 1.77064 -181.75550 294.79847
4200.0000 72 0 -181.24874 3.27311 1.80357 -181.18571 323.85815
4205.0000 72 0 -181.82872 2.95318 1.77360 -181.70435 300.15654
4210.0000 72 0 -182.10796 2.45884 1.75556 -182.01645 289.91801
4215.0000 72 0 -181.08646 2.66351 1.78442 -181.51708 314.14960
4220.0000 72 0 -181.72380 2.67123 1.78198 -181.55921 305.26866
4225.0000 72 0 -180.88985 3.15890 1.78860 -181.44464 315.66918
4230.0000 72 0 -180.63892 3.00118 1.81826 -180.93130 339.20348
4235.0000 72 0 -181.16525 3.27044 1.82601 -180.79728 343.08390
4240.0000 72 0 -182.48038 2.37035 1.75339 -182.05415 280.76756
4245.0000 72 0 -181.70942 2.52703 1.76677 -181.82245 287.02856
4250.0000 72 0 -180.95776 3.27856 1.77295 -181.71562 301.09622
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.37831 4.00386 1.07024
force_rgl> df(natom) 0.00000 0.00000 0.00000
4255.0000 73 0 -180.69118 3.59985 1.98054 -180.75609 348.62346
4260.0000 73 0 -183.16308 3.31331 1.89058 -182.32743 379.08971
4265.0000 73 0 -183.50009 2.88447 1.83902 -183.22810 333.24381
4270.0000 73 0 -184.64446 2.29656 1.80501 -183.82215 318.34174
4275.0000 73 0 -184.05895 2.76829 1.76831 -184.46311 282.61345
4280.0000 73 0 -184.00859 2.91333 1.79532 -183.99143 306.22559
4285.0000 73 0 -184.41658 2.96643 1.78853 -184.10992 304.64177
4290.0000 73 0 -184.68260 2.69890 1.77384 -184.36654 290.74308
4295.0000 73 0 -184.83147 2.69177 1.75273 -184.73531 271.66951
4300.0000 73 0 -184.37934 2.60893 1.76274 -184.56047 282.87203
4305.0000 73 0 -184.10860 2.65749 1.77659 -184.31853 291.53161
4310.0000 73 0 -183.56167 2.94641 1.78588 -184.15618 299.96497
4315.0000 73 0 -183.33496 2.96927 1.81940 -183.57072 323.09599
4320.0000 73 0 -183.77084 3.07842 1.81725 -183.60835 329.14977
4325.0000 73 0 -184.31151 2.87113 1.77819 -184.29054 291.24427
4330.0000 73 0 -183.80473 3.19363 1.80214 -183.87222 312.01020
4335.0000 73 0 -184.37017 2.41358 1.80283 -183.86025 316.53404
4340.0000 73 0 -184.17427 2.63263 1.78188 -184.22620 296.49413
4345.0000 73 0 -184.47863 2.56978 1.78073 -184.24627 296.43855
4350.0000 73 0 -183.91666 2.83504 1.78376 -184.19326 296.48202
4355.0000 73 0 -183.90709 3.03556 1.81751 -183.60377 324.98203
4360.0000 73 0 -184.05089 3.05089 1.80920 -183.74886 320.36766
4365.0000 73 0 -184.32289 2.47911 1.77614 -184.32640 288.38311
4370.0000 73 0 -184.17842 3.28078 1.78240 -184.21711 294.07128
4375.0000 73 0 -184.58033 2.52000 1.78033 -184.25319 296.29179
4380.0000 73 0 -183.23622 3.17437 1.80201 -183.87453 312.49216
4385.0000 73 0 -183.24105 2.82497 1.82356 -183.49809 326.04794
4390.0000 73 0 -183.37448 2.96094 1.83132 -183.36255 331.40470
4395.0000 73 0 -183.52815 2.91260 1.83974 -183.21545 343.09942
4400.0000 73 0 -183.87897 2.95375 1.81361 -183.67188 319.18199
4405.0000 73 0 -184.33692 2.83332 1.79118 -184.06363 300.76813
4410.0000 73 0 -184.47074 2.87027 1.77461 -184.35311 287.55175
4415.0000 73 0 -183.77252 2.69383 1.79708 -183.96066 303.98334
4420.0000 73 0 -184.19035 2.91403 1.78139 -184.23471 299.60260
4425.0000 73 0 -184.29656 2.82830 1.78413 -184.18679 301.54786
4430.0000 73 0 -184.57571 2.32750 1.77511 -184.34435 296.68470
4435.0000 73 0 -184.07777 2.55416 1.78303 -184.20602 300.94547
4440.0000 73 0 -183.99173 2.89166 1.77921 -184.27274 297.03759
4445.0000 73 0 -183.03972 3.52380 1.81753 -183.60348 335.27650
4450.0000 73 0 -183.38713 3.27090 1.85405 -182.96562 366.55320
4455.0000 73 0 -184.13513 2.78234 1.78172 -184.22897 304.05680
4460.0000 73 0 -184.64256 2.61919 1.76761 -184.47541 287.95487
4465.0000 73 0 -184.33973 2.70613 1.76940 -184.44419 289.81237
4470.0000 73 0 -184.41396 2.79357 1.78067 -184.24734 300.33831
4475.0000 73 0 -183.74542 3.05360 1.79443 -184.00698 310.66988
4480.0000 73 0 -184.33019 2.52964 1.78194 -184.22509 302.57519
4485.0000 73 0 -184.40531 3.08030 1.76649 -184.49502 287.71556
4490.0000 73 0 -184.92266 2.44643 1.75129 -184.76048 273.55649
4495.0000 73 0 -185.19924 2.39042 1.73502 -185.04469 259.33914
4500.0000 73 0 -184.18210 2.98807 1.76280 -184.55942 286.28093
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.10231 0.35191 1.36204
force_rgl> df(natom) 0.00000 0.00000 0.00000
4505.0000 74 0 -184.21793 3.59044 1.92460 -184.37692 313.25312
4510.0000 74 0 -185.84242 3.60965 1.86690 -185.39389 357.05694
4515.0000 74 0 -186.65233 3.26625 1.81219 -186.35826 310.97406
4520.0000 74 0 -186.28061 2.65592 1.80674 -186.45441 307.11543
4525.0000 74 0 -186.49676 2.75029 1.82074 -186.20756 317.47026
4530.0000 74 0 -186.96010 2.32962 1.79255 -186.70445 293.83249
4535.0000 74 0 -186.58006 2.78371 1.77837 -186.95435 278.52897
4540.0000 74 0 -186.66936 2.73149 1.77541 -187.00664 280.31600
4545.0000 74 0 -186.21704 2.87416 1.80017 -186.57016 302.80412
4550.0000 74 0 -186.66136 3.07036 1.81025 -186.39243 307.88827
4555.0000 74 0 -185.82902 3.01195 1.82599 -186.11502 323.88984
4560.0000 74 0 -185.97637 3.08398 1.82285 -186.17031 316.77437
4565.0000 74 0 -186.16319 2.64026 1.81704 -186.27280 314.14704
4570.0000 74 0 -186.11660 2.66883 1.84725 -185.74031 339.56612
4575.0000 74 0 -187.09546 2.50590 1.80076 -186.55974 300.79592
4580.0000 74 0 -185.86711 3.33896 1.80353 -186.51085 302.82425
4585.0000 74 0 -186.21638 2.95443 1.82516 -186.12962 326.86896
4590.0000 74 0 -186.27487 2.96774 1.80427 -186.49789 304.38730
4595.0000 74 0 -186.08304 2.79486 1.82958 -186.05175 325.46732
4600.0000 74 0 -186.75548 2.41440 1.82096 -186.20364 321.92080
4605.0000 74 0 -186.71377 2.88933 1.79825 -186.60393 301.61157
4610.0000 74 0 -186.89664 2.56399 1.78417 -186.85215 287.90953
4615.0000 74 0 -186.62070 2.79242 1.78626 -186.81527 289.14980
4620.0000 74 0 -186.00443 2.93766 1.80877 -186.41854 301.44516
4625.0000 74 0 -186.41625 2.90032 1.81904 -186.23758 318.11248
4630.0000 74 0 -186.92359 2.78342 1.79098 -186.73215 294.42353
4635.0000 74 0 -186.74310 2.86452 1.77947 -186.93502 281.01458
4640.0000 74 0 -186.38750 3.13533 1.80274 -186.52493 302.38029
4645.0000 74 0 -186.65433 2.59990 1.82365 -186.15636 319.40256
4650.0000 74 0 -186.68711 3.13728 1.81484 -186.31164 313.31663
4655.0000 74 0 -187.04944 2.62921 1.78586 -186.82236 288.30841
4660.0000 74 0 -186.73803 2.82503 1.78705 -186.80140 286.72906
4665.0000 74 0 -186.05719 3.03837 1.81606 -186.29004 316.23488
4670.0000 74 0 -186.96917 2.62185 1.81884 -186.24105 317.61922
4675.0000 74 0 -187.19933 2.65682 1.77188 -187.06876 277.36668
4680.0000 74 0 -186.05467 3.40530 1.79307 -186.69526 292.12704
4685.0000 74 0 -185.79300 3.40036 1.83862 -185.89241 332.28414
4690.0000 74 0 -185.61274 3.38417 1.83033 -186.03850 322.79781
4695.0000 74 0 -186.20445 3.15715 1.83313 -185.98917 326.24496
4700.0000 74 0 -186.32498 2.78894 1.80858 -186.42187 308.03164
4705.0000 74 0 -185.93390 3.26311 1.81266 -186.34994 311.32910
4710.0000 74 0 -186.61249 2.89277 1.81646 -186.28308 330.57080
4715.0000 74 0 -187.17824 2.62881 1.78690 -186.80402 309.62818
4720.0000 74 0 -187.48030 2.72970 1.79119 -186.72839 312.97021
4725.0000 74 0 -186.90753 2.86258 1.79066 -186.73771 312.15537
4730.0000 74 0 -187.12804 2.77400 1.78441 -186.84794 309.10296
4735.0000 74 0 -187.38225 2.51146 1.75870 -187.30113 284.69055
4740.0000 74 0 -187.16320 2.69860 1.76183 -187.24588 287.23554
4745.0000 74 0 -186.17711 3.45951 1.78318 -186.86970 306.25884
4750.0000 74 0 -187.06861 2.97522 1.80087 -186.55782 322.33549
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.40776 -1.86864 -0.45472
force_rgl> df(natom) 0.00000 0.00000 0.00000
4755.0000 75 0 -187.39575 3.01659 1.93310 -186.87086 317.33721
4760.0000 75 0 -189.06328 2.88344 1.83058 -188.69416 323.84959
4765.0000 75 0 -189.09150 3.02445 1.79944 -189.24786 314.10929
4770.0000 75 0 -188.65223 3.49874 1.81912 -188.89795 325.12507
4775.0000 75 0 -189.48347 2.98357 1.80366 -189.17285 320.84688
4780.0000 75 0 -189.74910 3.13976 1.79699 -189.29148 317.70469
4785.0000 75 0 -189.10730 3.01394 1.78580 -189.49045 306.91738
4790.0000 75 0 -189.83773 2.74636 1.79206 -189.37916 307.20775
4795.0000 75 0 -190.01712 2.66374 1.75539 -190.03137 274.56800
4800.0000 75 0 -190.33665 2.67151 1.73863 -190.32939 260.39623
4805.0000 75 0 -189.35398 2.92613 1.75724 -189.99848 277.25254
4810.0000 75 0 -188.57667 3.22282 1.81421 -188.98523 328.83504
4815.0000 75 0 -189.13400 2.88206 1.81775 -188.92232 326.79764
4820.0000 75 0 -189.60658 2.85966 1.77829 -189.62411 297.96040
4825.0000 75 0 -189.42159 3.21129 1.78872 -189.43861 302.74914
4830.0000 75 0 -189.28475 3.00012 1.78931 -189.42801 304.81499
4835.0000 75 0 -189.36429 3.09919 1.78463 -189.51132 300.58040
4840.0000 75 0 -188.65451 3.31889 1.81337 -189.00016 323.99409
4845.0000 75 0 -189.35874 3.04643 1.80847 -189.08728 321.83333
4850.0000 75 0 -189.66135 2.64045 1.77058 -189.76126 291.87612
4855.0000 75 0 -189.77809 2.63473 1.76816 -189.80420 288.99554
4860.0000 75 0 -189.28019 3.38761 1.78367 -189.52831 299.37952
4865.0000 75 0 -189.43031 2.64522 1.78929 -189.42849 303.88384
4870.0000 75 0 -189.02648 3.41672 1.80245 -189.19433 311.64676
4875.0000 75 0 -189.68019 2.68672 1.78473 -189.50951 299.41141
4880.0000 75 0 -189.90517 2.85250 1.76167 -189.91971 279.72610
4885.0000 75 0 -189.62567 2.92317 1.76225 -189.90940 283.41445
4890.0000 75 0 -190.07392 2.38891 1.76319 -189.89256 281.91606
4895.0000 75 0 -188.90134 3.13379 1.78128 -189.57082 295.95023
4900.0000 75 0 -189.56060 2.84470 1.79462 -189.33367 308.95858
4905.0000 75 0 -189.58083 2.57893 1.78910 -189.43181 303.01599
4910.0000 75 0 -189.90553 2.85250 1.78935 -189.42730 303.18034
4915.0000 75 0 -189.93826 2.59003 1.77742 -189.63960 297.69078
4920.0000 75 0 -189.71725 2.70988 1.77357 -189.70802 288.92316
4925.0000 75 0 -189.27978 2.97033 1.79197 -189.38069 309.95624
4930.0000 75 0 -189.54416 2.87021 1.78775 -189.45588 303.34411
4935.0000 75 0 -188.86411 2.71389 1.79527 -189.32201 313.56051
4940.0000 75 0 -189.94688 2.66813 1.78555 -189.49497 304.29711
4945.0000 75 0 -189.96687 2.66127 1.75556 -190.02826 276.88179
4950.0000 75 0 -189.23767 2.52835 1.76806 -189.80595 284.68969
4955.0000 75 0 -189.54813 2.99411 1.79431 -189.33921 308.68655
4960.0000 75 0 -188.80399 3.12624 1.79183 -189.38321 304.45064
4965.0000 75 0 -189.37215 3.07807 1.80946 -189.06975 324.58810
4970.0000 75 0 -189.47275 2.88566 1.79353 -189.35306 312.54759
4975.0000 75 0 -190.36378 2.62405 1.77155 -189.74395 293.02652
4980.0000 75 0 -189.37110 3.03632 1.76132 -189.92595 286.28791
4985.0000 75 0 -189.10158 2.93920 1.78923 -189.42947 306.55308
4990.0000 75 0 -189.57444 2.61210 1.80874 -189.08244 317.68575
4995.0000 75 0 -189.27130 3.22571 1.78750 -189.46029 306.49616
5000.0000 75 0 -189.75446 3.00912 1.79304 -189.36175 309.96174
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.63448 -0.62862 -0.75962
force_rgl> df(natom) 0.00000 0.00000 0.00000
5005.0000 76 0 -189.39757 4.17092 1.93694 -189.44696 323.76317
5010.0000 76 0 -190.56684 3.64640 1.90307 -190.05475 391.78787
5015.0000 76 0 -191.50601 3.06819 1.85187 -190.97340 360.17476
5020.0000 76 0 -192.20044 3.04837 1.80348 -191.84153 319.01524
5025.0000 76 0 -191.83693 3.16929 1.80411 -191.83033 309.65698
5030.0000 76 0 -192.83760 2.62194 1.78542 -192.16563 296.80743
5035.0000 76 0 -192.87057 2.66022 1.75031 -192.79558 270.09901
5040.0000 76 0 -192.36929 2.90466 1.76511 -192.52999 285.03228
5045.0000 76 0 -192.16320 2.86900 1.77273 -192.39334 292.68702
5050.0000 76 0 -191.29213 3.32329 1.80393 -191.83350 323.68921
5055.0000 76 0 -192.03619 2.97149 1.80527 -191.80952 322.67548
5060.0000 76 0 -192.76185 2.88849 1.74874 -192.82384 272.35098
5065.0000 76 0 -192.47206 2.64971 1.74601 -192.87267 268.65600
5070.0000 76 0 -192.04616 3.08627 1.78422 -192.18711 300.11080
5075.0000 76 0 -192.20146 3.19534 1.78923 -192.09723 306.18520
5080.0000 76 0 -191.97075 3.05748 1.78384 -192.19402 302.62958
5085.0000 76 0 -192.03745 3.05601 1.80059 -191.89337 317.57988
5090.0000 76 0 -191.76389 3.27419 1.80869 -191.74810 320.97964
5095.0000 76 0 -191.89462 3.42242 1.80913 -191.74019 323.45190
5100.0000 76 0 -192.82286 2.28989 1.76669 -192.50168 284.26845
5105.0000 76 0 -192.17401 2.80341 1.77043 -192.43466 291.69156
5110.0000 76 0 -192.06937 3.39248 1.79611 -191.97388 312.49143
5115.0000 76 0 -191.85880 3.49437 1.78965 -192.08975 304.73730
5120.0000 76 0 -192.03972 3.09578 1.78898 -192.10175 306.40873
5125.0000 76 0 -192.15634 2.87245 1.77313 -192.38620 291.18518
5130.0000 76 0 -192.71957 2.65063 1.76727 -192.49126 286.18559
5135.0000 76 0 -192.44575 2.74509 1.76096 -192.60455 284.06517
5140.0000 76 0 -192.67631 2.85786 1.76314 -192.56547 283.62616
5145.0000 76 0 -192.56948 2.78348 1.76196 -192.58656 284.84343
5150.0000 76 0 -192.78873 2.63819 1.74199 -192.94491 268.77807
5155.0000 76 0 -192.95843 2.53072 1.74759 -192.84431 271.69558
5160.0000 76 0 -192.76440 2.59027 1.74874 -192.82384 274.47524
5165.0000 76 0 -192.59516 2.40378 1.75916 -192.63673 281.68980
5170.0000 76 0 -192.72282 2.87756 1.75873 -192.64456 279.36348
5175.0000 76 0 -192.16684 2.86112 1.76108 -192.60232 283.67482
5180.0000 76 0 -192.40644 2.58901 1.78100 -192.24500 300.04077
5185.0000 76 0 -192.00975 3.06228 1.78640 -192.14801 304.19409
5190.0000 76 0 -191.91236 2.96339 1.79555 -191.98393 310.55566
5195.0000 76 0 -191.91899 3.06327 1.80009 -191.90248 314.63735
5200.0000 76 0 -191.93145 3.18426 1.80940 -191.73541 321.27326
5205.0000 76 0 -192.24242 2.72329 1.78587 -192.15752 299.35175
5210.0000 76 0 -192.73832 2.56308 1.76869 -192.46575 287.50773
5215.0000 76 0 -192.51451 2.60918 1.77738 -192.30998 298.37884
5220.0000 76 0 -192.51113 2.80759 1.75612 -192.69138 279.37432
5225.0000 76 0 -192.68023 3.09710 1.76133 -192.59788 283.77536
5230.0000 76 0 -192.72434 2.81350 1.76653 -192.50455 288.56764
5235.0000 76 0 -192.27330 2.79999 1.76109 -192.60216 283.02066
5240.0000 76 0 -192.53556 2.68614 1.77541 -192.34528 292.08700
5245.0000 76 0 -192.17718 3.04527 1.78872 -192.10647 308.88074
5250.0000 76 0 -192.20704 2.92092 1.79519 -191.99039 314.20659
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.82825 0.19767 -1.37307
force_rgl> df(natom) 0.00000 0.00000 0.00000
5255.0000 77 0 -193.00516 3.16064 1.91943 -192.40969 299.17414
5260.0000 77 0 -193.93238 2.78212 1.84754 -193.71093 338.22460
5265.0000 77 0 -194.08470 3.18047 1.82578 -194.10469 323.59953
5270.0000 77 0 -194.42001 3.09938 1.82412 -194.13483 324.59004
5275.0000 77 0 -194.78755 2.63880 1.79489 -194.66393 295.37249
5280.0000 77 0 -194.73340 2.93940 1.80701 -194.44448 308.91673
5285.0000 77 0 -194.91031 3.18881 1.79279 -194.70192 296.77888
5290.0000 77 0 -194.83917 3.05077 1.79045 -194.74425 292.28567
5295.0000 77 0 -194.49230 2.88047 1.78425 -194.85638 288.73863
5300.0000 77 0 -194.81084 2.66798 1.78539 -194.83582 287.92344
5305.0000 77 0 -194.76357 2.49425 1.78552 -194.83343 286.32568
5310.0000 77 0 -193.86178 3.63161 1.81784 -194.24838 318.48532
5315.0000 77 0 -194.11719 2.99635 1.83724 -193.89730 322.90068
5320.0000 77 0 -194.31834 3.14781 1.81637 -194.27502 314.39954
5325.0000 77 0 -194.79048 3.07748 1.81171 -194.35937 320.73621
5330.0000 77 0 -194.65865 3.00887 1.78922 -194.76649 304.54195
5335.0000 77 0 -194.38998 3.13563 1.79995 -194.57228 310.77286
5340.0000 77 0 -194.24101 3.15073 1.81018 -194.38711 323.08502
5345.0000 77 0 -194.53203 3.12865 1.80115 -194.55060 310.24073
5350.0000 77 0 -194.58348 3.04914 1.80223 -194.53101 309.45593
5355.0000 77 0 -194.87124 3.21041 1.78772 -194.79368 298.63220
5360.0000 77 0 -194.59156 3.11395 1.79244 -194.70820 307.28813
5365.0000 77 0 -195.37435 2.81354 1.79196 -194.71694 302.39997
5370.0000 77 0 -195.98050 2.24340 1.74039 -195.65024 258.86884
5375.0000 77 0 -195.24891 2.88444 1.74622 -195.54472 263.36558
5380.0000 77 0 -194.57531 2.97242 1.78558 -194.83235 296.62286
5385.0000 77 0 -194.79631 2.92351 1.78871 -194.77564 300.47286
5390.0000 77 0 -194.95822 2.71829 1.76219 -195.25567 274.85052
5395.0000 77 0 -194.92399 2.87611 1.78328 -194.87396 294.34265
5400.0000 77 0 -194.55267 2.92427 1.78777 -194.79264 297.21298
5405.0000 77 0 -194.32109 3.02314 1.81520 -194.29620 321.38377
5410.0000 77 0 -195.08228 2.75628 1.80150 -194.54423 310.64926
5415.0000 77 0 -194.41177 3.35577 1.78662 -194.81358 297.34043
5420.0000 77 0 -193.99008 3.07404 1.80983 -194.39353 318.93978
5425.0000 77 0 -194.32754 3.00839 1.81774 -194.25025 321.58014
5430.0000 77 0 -194.85026 2.76789 1.80149 -194.54441 307.41845
5435.0000 77 0 -194.50547 2.64937 1.79955 -194.57958 310.48857
5440.0000 77 0 -195.17149 2.51559 1.79017 -194.74924 300.66871
5445.0000 77 0 -195.08517 3.01340 1.78009 -194.93178 296.25612
5450.0000 77 0 -194.62087 2.89630 1.79117 -194.73120 306.66170
5455.0000 77 0 -195.13139 2.87672 1.78650 -194.81567 298.12353
5460.0000 77 0 -195.24465 2.81250 1.76502 -195.20453 283.48231
5465.0000 77 0 -194.70127 3.10321 1.78733 -194.80060 299.52419
5470.0000 77 0 -194.86382 3.03258 1.77627 -195.00093 287.17126
5475.0000 77 0 -194.36481 3.09616 1.79953 -194.57995 308.80644
5480.0000 77 0 -195.02236 2.89644 1.79184 -194.71910 302.21894
5485.0000 77 0 -194.73059 2.93973 1.78827 -194.78359 294.35711
5490.0000 77 0 -194.33368 3.26347 1.79948 -194.58075 316.96415
5495.0000 77 0 -195.06101 2.94234 1.79720 -194.62195 315.71909
5500.0000 77 0 -195.28872 2.96572 1.76297 -195.24158 283.17453
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.00691 1.29290 -2.61002
force_rgl> df(natom) 0.00000 0.00000 0.00000
5505.0000 78 0 -194.91250 4.05693 1.91898 -195.06791 306.23329
5510.0000 78 0 -195.16515 3.87300 1.93324 -194.80761 402.53996
5515.0000 78 0 -196.06191 3.40157 1.89833 -195.44489 378.88992
5520.0000 78 0 -196.34855 3.65097 1.85808 -196.17969 349.23312
5525.0000 78 0 -196.93370 3.02291 1.83668 -196.57025 327.79795
5530.0000 78 0 -196.28260 3.37474 1.83481 -196.60433 328.07902
5535.0000 78 0 -197.27338 2.80188 1.83572 -196.58780 326.59623
5540.0000 78 0 -195.97358 3.46277 1.81403 -196.98383 308.91562
5545.0000 78 0 -197.52601 2.69631 1.82121 -196.85278 317.28223
5550.0000 78 0 -197.07195 2.83697 1.80628 -197.12525 295.16481
5555.0000 78 0 -197.95240 3.13029 1.79483 -197.33426 291.53542
5560.0000 78 0 -197.68650 2.50617 1.77518 -197.69302 276.59990
5565.0000 78 0 -197.58014 2.82592 1.79079 -197.40803 283.98209
5570.0000 78 0 -197.28116 2.92749 1.79421 -197.34558 292.91358
5575.0000 78 0 -197.79367 2.88838 1.78987 -197.42488 291.45571
5580.0000 78 0 -197.88147 2.35945 1.77085 -197.77201 270.88170
5585.0000 78 0 -196.82510 2.94652 1.79293 -197.36889 291.38207
5590.0000 78 0 -196.76161 3.03828 1.81902 -196.89263 315.89940
5595.0000 78 0 -197.10020 3.27128 1.83770 -196.55172 331.39165
5600.0000 78 0 -197.26007 2.80346 1.80233 -197.19730 299.53806
5605.0000 78 0 -196.60777 3.32461 1.81347 -196.99399 307.46648
5610.0000 78 0 -196.85522 3.34401 1.82400 -196.80180 323.27346
5615.0000 78 0 -197.23578 3.17786 1.80150 -197.21244 300.09614
5620.0000 78 0 -197.64891 2.51012 1.78896 -197.44149 290.69048
5625.0000 78 0 -196.88529 2.91237 1.79324 -197.36327 290.79342
5630.0000 78 0 -197.35582 3.20766 1.79472 -197.33621 292.39860
5635.0000 78 0 -196.90810 2.94686 1.80717 -197.10894 301.49194
5640.0000 78 0 -196.51079 3.25011 1.80765 -197.10015 303.51772
5645.0000 78 0 -197.56264 3.08879 1.82858 -196.71823 321.60833
5650.0000 78 0 -197.24564 2.95568 1.79019 -197.41902 290.31128
5655.0000 78 0 -197.51196 3.05745 1.79928 -197.25312 296.63564
5660.0000 78 0 -197.09049 2.94398 1.80759 -197.10126 303.25325
5665.0000 78 0 -197.11471 3.13074 1.82062 -196.86355 310.25027
5670.0000 78 0 -197.22740 2.79606 1.80713 -197.10973 300.28948
5675.0000 78 0 -197.25509 3.20354 1.81259 -197.01001 307.04699
5680.0000 78 0 -196.65041 3.50677 1.81698 -196.92992 312.21286
5685.0000 78 0 -197.59949 2.87678 1.80422 -197.16280 299.98069
5690.0000 78 0 -197.05574 3.23846 1.78714 -197.47458 287.99147
5695.0000 78 0 -196.99110 3.01411 1.81365 -196.99065 310.16327
5700.0000 78 0 -197.68280 2.74225 1.79312 -197.36557 288.95714
5705.0000 78 0 -197.20940 2.93653 1.77650 -197.66885 279.74327
5710.0000 78 0 -196.95743 3.05009 1.80751 -197.10271 302.92002
5715.0000 78 0 -197.15315 3.42234 1.81661 -196.93671 308.76886
5720.0000 78 0 -196.86357 3.16302 1.82566 -196.77150 318.99882
5725.0000 78 0 -197.24204 2.92081 1.80876 -197.07994 304.84646
5730.0000 78 0 -197.04474 3.36174 1.81080 -197.04278 304.50840
5735.0000 78 0 -196.71799 3.40197 1.82562 -196.77220 318.21438
5740.0000 78 0 -196.79342 2.94639 1.82876 -196.71478 318.63451
5745.0000 78 0 -196.63776 3.21043 1.82531 -196.77779 321.27210
5750.0000 78 0 -196.80460 3.34716 1.83905 -196.52709 327.37909
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -3.37721 0.94224 2.44423
force_rgl> df(natom) 0.00000 0.00000 0.00000
5755.0000 79 0 -197.43242 3.39189 1.98153 -196.56738 346.52432
5760.0000 79 0 -199.48031 2.98275 1.87876 -198.45960 344.73380
5765.0000 79 0 -200.10323 2.27426 1.82202 -199.50418 299.18551
5770.0000 79 0 -199.61870 2.68895 1.81044 -199.71739 290.03055
5775.0000 79 0 -199.85163 2.57989 1.82377 -199.47207 299.85107
5780.0000 79 0 -199.74906 3.04258 1.80343 -199.84648 285.22686
5785.0000 79 0 -200.25364 2.67370 1.79950 -199.91886 278.56704
5790.0000 79 0 -199.97539 2.71735 1.81532 -199.62755 293.99885
5795.0000 79 0 -199.18391 3.58012 1.81243 -199.68073 291.20463
5800.0000 79 0 -199.19269 3.26451 1.82961 -199.36441 312.09417
5805.0000 79 0 -198.05795 3.51886 1.86553 -198.70311 336.71530
5810.0000 79 0 -199.30049 3.10527 1.86126 -198.78169 330.77185
5815.0000 79 0 -199.15013 3.39553 1.83154 -199.32888 308.25404
5820.0000 79 0 -198.27950 3.50437 1.87257 -198.57347 343.07617
5825.0000 79 0 -199.27234 2.94840 1.86046 -198.79657 331.90956
5830.0000 79 0 -198.87456 3.26175 1.85519 -198.89358 327.22673
5835.0000 79 0 -199.20459 2.95101 1.84813 -199.02349 325.01881
5840.0000 79 0 -199.01047 3.27973 1.85945 -198.81516 328.56337
5845.0000 79 0 -198.92967 3.19444 1.85373 -198.92049 329.42977
5850.0000 79 0 -199.21108 3.07044 1.84458 -199.08891 320.53317
5855.0000 79 0 -199.26676 2.93432 1.84460 -199.08848 322.71664
5860.0000 79 0 -200.33364 2.70518 1.81783 -199.58130 295.61748
5865.0000 79 0 -199.68224 3.10632 1.79559 -199.99090 279.27219
5870.0000 79 0 -199.40321 3.01382 1.82199 -199.50485 298.62917
5875.0000 79 0 -199.86081 3.00595 1.80970 -199.73107 287.62216
5880.0000 79 0 -199.53694 2.73546 1.79201 -200.05667 274.06770
5885.0000 79 0 -198.98039 3.40582 1.82499 -199.44955 305.08881
5890.0000 79 0 -198.99951 3.38316 1.83767 -199.21611 313.07084
5895.0000 79 0 -198.45834 3.79290 1.86170 -198.77361 333.05816
5900.0000 79 0 -199.11426 3.43768 1.86787 -198.66007 339.23073
5905.0000 79 0 -199.71186 3.00573 1.81250 -199.67942 293.14270
5910.0000 79 0 -198.84288 3.31012 1.84968 -198.99500 321.50862
5915.0000 79 0 -198.94482 3.27253 1.85619 -198.87512 326.17115
5920.0000 79 0 -199.68027 2.95439 1.82319 -199.48261 301.30716
5925.0000 79 0 -199.92251 2.89578 1.81257 -199.67815 290.16756
5930.0000 79 0 -199.73403 2.72881 1.79924 -199.92367 279.98848
5935.0000 79 0 -199.57934 3.08474 1.82595 -199.43191 299.22891
5940.0000 79 0 -199.01907 3.79264 1.82087 -199.52536 306.62187
5945.0000 79 0 -199.57790 2.96911 1.83470 -199.27069 310.82765
5950.0000 79 0 -199.47835 3.30436 1.82187 -199.50706 313.80854
5955.0000 79 0 -199.54249 3.38588 1.81823 -199.57402 312.36058
5960.0000 79 0 -200.73836 2.76558 1.79566 -199.98948 290.96077
5965.0000 79 0 -200.05923 3.09880 1.77837 -200.30792 277.07088
5970.0000 79 0 -199.76725 3.02284 1.78898 -200.11256 288.81101
5975.0000 79 0 -200.46924 2.74112 1.78692 -200.15053 283.67737
5980.0000 79 0 -199.91311 3.13203 1.78357 -200.21218 281.88507
5985.0000 79 0 -200.16533 3.02451 1.77267 -200.41274 272.53758
5990.0000 79 0 -199.58411 2.91192 1.80100 -199.89131 292.47142
5995.0000 79 0 -199.72870 3.05083 1.79802 -199.94614 292.45024
6000.0000 79 0 -199.56760 3.30241 1.81741 -199.58914 307.57453
main_MD> EXECUTION TIME: 0 [day], 0 [hour], 5 [min], 45.2066086 [s].
main_MD> Deallocating global variables
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