ITEM: TIMESTEP 0 ITEM: NUMBER OF ATOMS 7 ITEM: BOX BOUNDS ff ff ff -2.5000000000000000e+01 2.5000000000000000e+01 -2.5000000000000000e+01 2.5000000000000000e+01 -2.5000000000000000e+01 2.5000000000000000e+01 ITEM: ATOMS id type x y z fx fy fz 1 1 1.9995510 1.6857910 2.4865390 0.8830428 1.4076372 -1.7982046 2 1 2.8064670 1.9433270 4.5583280 -0.7611970 0.0740752 -0.4758351 3 1 1.5271400 3.9220990 3.0021790 -1.4072797 -1.2292956 -0.1600074 4 1 4.3363960 2.0724790 2.0616940 -2.8806674 1.5962385 -0.2048262 5 1 5.0466760 1.8823700 4.0816110 0.6961431 1.4800121 2.8292675 6 1 3.5569350 4.3528850 1.8495630 -0.5935396 -1.8593782 0.8611879 7 1 3.3003350 4.1409910 4.3070930 4.0634979 -1.4692892 -1.0515820 ITEM: TIMESTEP 1 ITEM: NUMBER OF ATOMS 7 ITEM: BOX BOUNDS ff ff ff -2.5000000000000000e+01 2.5000000000000000e+01 -2.5000000000000000e+01 2.5000000000000000e+01 -2.5000000000000000e+01 2.5000000000000000e+01 ITEM: ATOMS id type x y z fx fy fz 1 1 2.0212821 1.7204320 2.4422864 0.0197618 0.9223314 -1.7206908 2 1 2.7877344 1.9451499 4.5466180 -0.8448569 -0.1189348 -0.5776241 3 1 1.4925078 3.8918468 2.9982413 -0.3461200 -0.7118270 0.7091332 4 1 4.2655047 2.1117614 2.0566534 -1.1732415 0.8514742 1.5024560 5 1 5.0638076 1.9187921 4.1512374 0.3786107 1.4384852 1.4150467 6 1 3.5423284 4.3071269 1.8707563 -0.9597343 -0.8503247 0.2111784 7 1 3.4003350 4.1048328 4.2812143 2.9255802 -1.5312042 -1.5394995 ITEM: TIMESTEP 2 ITEM: NUMBER OF ATOMS 7 ITEM: BOX BOUNDS ff ff ff -2.5000000000000000e+01 2.5000000000000000e+01 -2.5000000000000000e+01 2.5000000000000000e+01 -2.5000000000000000e+01 2.5000000000000000e+01 ITEM: ATOMS id type x y z fx fy fz 1 1 2.0219576 1.7519585 2.3834710 -0.6009143 0.4719491 -1.6017959 2 1 2.7588562 1.9410846 4.5268741 -0.8141870 -0.3430241 -0.6075045 3 1 1.4806770 3.8675157 3.0224804 -0.0239779 -0.4131014 1.1187885 4 1 4.2254018 2.1408658 2.1080092 -0.1996958 0.3429208 1.6208386 5 1 5.0767490 1.9679613 4.1996055 0.5189542 0.9657091 1.3418313 6 1 3.5095235 4.2780618 1.8779746 -1.0804189 0.0277286 -0.7112467 7 1 3.5003350 4.0524943 4.2285922 2.2002398 -1.0521821 -1.1609113 ITEM: TIMESTEP 3 ITEM: NUMBER OF ATOMS 7 ITEM: BOX BOUNDS ff ff ff -2.5000000000000000e+01 2.5000000000000000e+01 -2.5000000000000000e+01 2.5000000000000000e+01 -2.5000000000000000e+01 2.5000000000000000e+01 ITEM: ATOMS id type x y z fx fy fz 1 1 1.9946463 1.7734084 2.3106700 -0.4636076 0.3864496 -1.4301623 2 1 2.7218517 1.9254943 4.4992633 -0.4376850 -0.2508517 -0.7798049 3 1 1.4795872 3.8487404 3.0733289 0.2986445 -0.3524721 1.2485930 4 1 4.2163257 2.1564514 2.1816756 -0.1697521 0.2890676 1.2648880 5 1 5.1003353 2.0118524 4.2605912 0.4514833 0.3113564 1.4770060 6 1 3.4604189 4.2793220 1.8456487 -1.1538064 -0.0182796 -0.9368671 7 1 3.6003350 4.0046730 4.1758293 1.4747233 -0.3652703 -0.8436526 ITEM: TIMESTEP 4 ITEM: NUMBER OF ATOMS 7 ITEM: BOX BOUNDS ff ff ff -2.5000000000000000e+01 2.5000000000000000e+01 -2.5000000000000000e+01 2.5000000000000000e+01 -2.5000000000000000e+01 2.5000000000000000e+01 ITEM: ATOMS id type x y z fx fy fz 1 1 1.9632579 1.7995728 2.2138416 -0.3357549 0.4178192 -1.2704991 2 1 2.6922184 1.9085105 4.4464669 0.0436858 -0.1459947 -0.6131636 3 1 1.4998068 3.8248765 3.1578643 0.4416983 -0.3571337 1.0578437 4 1 4.2048327 2.1760226 2.2673143 -0.0496609 0.2441832 0.8028046 5 1 5.1309027 2.0329327 4.3605912 0.0389034 -0.1262467 1.2142448 6 1 3.3823009 4.2780844 1.7822186 -1.0801583 -0.3618201 -0.6766065 7 1 3.7001805 3.9799426 4.1187102 0.9412866 0.3291927 -0.5146241 ITEM: TIMESTEP 5 ITEM: NUMBER OF ATOMS 7 ITEM: BOX BOUNDS ff ff ff -2.5000000000000000e+01 2.5000000000000000e+01 -2.5000000000000000e+01 2.5000000000000000e+01 -2.5000000000000000e+01 2.5000000000000000e+01 ITEM: ATOMS id type x y z fx fy fz 1 1 1.9368309 1.8324590 2.1138416 -0.1482869 0.3797894 -0.9391793 2 1 2.6956569 1.8970194 4.3982053 0.0549101 -0.1421702 -0.4399638 3 1 1.5345725 3.7967667 3.2411263 0.3292411 -0.2195348 0.8421769 4 1 4.2009240 2.1952421 2.3305024 0.0619670 0.0503987 0.3691534 5 1 5.1339648 2.0229959 4.4561634 -0.2223936 0.0654381 0.8577160 6 1 3.2972825 4.2496058 1.7289634 -0.8665633 -0.4141047 -0.5009013 7 1 3.7742684 4.0058531 4.0782045 0.7911256 0.2801836 -0.1890019 ITEM: TIMESTEP 6 ITEM: NUMBER OF ATOMS 7 ITEM: BOX BOUNDS ff ff ff -2.5000000000000000e+01 2.5000000000000000e+01 -2.5000000000000000e+01 2.5000000000000000e+01 -2.5000000000000000e+01 2.5000000000000000e+01 ITEM: ATOMS id type x y z fx fy fz 1 1 1.9210419 1.8728974 2.0138416 -0.0044804 0.4287783 -0.4059821 2 1 2.7015035 1.8818817 4.3513598 -0.0452842 -0.2154020 -0.2913242 3 1 1.5696288 3.7733916 3.3307979 0.4203656 -0.0607678 0.4837205 4 1 4.2075219 2.2006083 2.3698084 0.0920274 0.0655544 0.1113996 5 1 5.1102852 2.0299635 4.5474895 -0.1121661 0.0797935 0.5546300 6 1 3.2050144 4.2055136 1.6756295 -0.5293662 -0.4327956 0.0130638 7 1 3.8585042 4.0356859 4.0580804 0.1789039 0.1348393 -0.4655076 ITEM: TIMESTEP 7 ITEM: NUMBER OF ATOMS 7 ITEM: BOX BOUNDS ff ff ff -2.5000000000000000e+01 2.5000000000000000e+01 -2.5000000000000000e+01 2.5000000000000000e+01 -2.5000000000000000e+01 2.5000000000000000e+01 ITEM: ATOMS id type x y z fx fy fz 1 1 1.9204583 1.9287548 1.9609538 -0.1885042 -0.0900325 -0.2488546 2 1 2.6956043 1.8538210 4.3134086 0.2738126 -0.2608391 -0.0690490 3 1 1.6243902 3.7654753 3.3938127 -0.7611366 0.1258151 0.5784153 4 1 4.2195105 2.2091482 2.3843205 0.4418961 -0.4118412 0.1982051 5 1 5.0956732 2.0403583 4.6197418 -0.4304210 0.2442725 0.0710894 6 1 3.1360533 4.1491329 1.6773313 -0.0638215 0.3979304 -0.9114703 7 1 3.8818102 4.0532515 3.9974382 0.7281746 -0.0053051 0.3816642 ITEM: TIMESTEP 8 ITEM: NUMBER OF ATOMS 7 ITEM: BOX BOUNDS ff ff ff -2.5000000000000000e+01 2.5000000000000000e+01 -2.5000000000000000e+01 2.5000000000000000e+01 -2.5000000000000000e+01 2.5000000000000000e+01 ITEM: ATOMS id type x y z fx fy fz 1 1 1.9120379 1.9571872 1.9197071 0.0816274 0.0192026 0.2692283 2 1 2.7039347 1.8264137 4.2885071 0.0700336 -0.0345687 -0.1996807 3 1 1.6234126 3.7662935 3.4550456 -0.1156558 -0.0203488 0.0552028 4 1 4.2453896 2.1964259 2.4012094 -0.0495150 -0.0700075 -0.0837289 5 1 5.0687694 2.0568420 4.6645614 -0.1184306 0.0988936 0.0763384 6 1 3.0934480 4.1336003 1.6392320 0.0967917 0.1181691 -0.0594193 7 1 3.9265078 4.0631793 3.9787445 0.0351487 -0.1113402 -0.0579406 ITEM: TIMESTEP 9 ITEM: NUMBER OF ATOMS 7 ITEM: BOX BOUNDS ff ff ff -2.5000000000000000e+01 2.5000000000000000e+01 -2.5000000000000000e+01 2.5000000000000000e+01 -2.5000000000000000e+01 2.5000000000000000e+01 ITEM: ATOMS id type x y z fx fy fz 1 1 1.9161525 1.9581552 1.9332781 -0.0147719 0.0196218 0.0226656 2 1 2.7074649 1.8246711 4.2784417 -0.0247653 -0.1062429 0.0384408 3 1 1.6175827 3.7652678 3.4578282 -0.0160804 0.0764295 0.0272847 4 1 4.2428936 2.1928970 2.3969888 0.1013668 -0.0308775 -0.0693062 5 1 5.0627996 2.0618270 4.6684094 -0.0036071 0.0116556 0.0322042 6 1 3.0983271 4.1395569 1.6362369 0.0182688 0.0077507 0.0402714 7 1 3.9282795 4.0575670 3.9758239 -0.0604108 0.0216627 -0.0915605 ITEM: TIMESTEP 10 ITEM: NUMBER OF ATOMS 7 ITEM: BOX BOUNDS ff ff ff -2.5000000000000000e+01 2.5000000000000000e+01 -2.5000000000000000e+01 2.5000000000000000e+01 -2.5000000000000000e+01 2.5000000000000000e+01 ITEM: ATOMS id type x y z fx fy fz 1 1 1.9162027 1.9597761 1.9384169 0.0416139 0.0697927 0.0089026 2 1 2.7066655 1.8168125 4.2784796 0.0232498 0.0423138 -0.0401996 3 1 1.6149333 3.7703233 3.4604589 -0.0172523 -0.0127425 0.0365850 4 1 4.2493008 2.1898202 2.3910534 0.0183955 -0.0043236 0.0723029 5 1 5.0609825 2.0639466 4.6716623 -0.0346603 0.0139986 -0.0507621 6 1 3.1008796 4.1416593 1.6382568 -0.0182455 -0.0564955 -0.0100065 7 1 3.9245356 4.0576040 3.9686791 -0.0131010 -0.0525433 -0.0168223 ITEM: TIMESTEP 11 ITEM: NUMBER OF ATOMS 7 ITEM: BOX BOUNDS ff ff ff -2.5000000000000000e+01 2.5000000000000000e+01 -2.5000000000000000e+01 2.5000000000000000e+01 -2.5000000000000000e+01 2.5000000000000000e+01 ITEM: ATOMS id type x y z fx fy fz 1 1 1.9196963 1.9669629 1.9435941 0.0326945 0.0233437 -0.0406365 2 1 2.7079027 1.8135321 4.2751793 -0.0351714 0.0563128 -0.0048564 3 1 1.6112141 3.7736340 3.4657648 -0.0575908 -0.0112715 0.0412367 4 1 4.2563609 2.1868039 2.3919209 0.0110420 -0.0362844 -0.0267135 5 1 5.0565390 2.0669382 4.6702636 0.0548789 -0.0320099 0.0142280 6 1 3.1015718 4.1387914 1.6391721 -0.0274988 -0.0393486 -0.0461819 7 1 3.9202153 4.0532795 3.9611123 0.0216456 0.0392579 0.0629236 ITEM: TIMESTEP 12 ITEM: NUMBER OF ATOMS 7 ITEM: BOX BOUNDS ff ff ff -2.5000000000000000e+01 2.5000000000000000e+01 -2.5000000000000000e+01 2.5000000000000000e+01 -2.5000000000000000e+01 2.5000000000000000e+01 ITEM: ATOMS id type x y z fx fy fz 1 1 1.9246576 1.9741780 1.9448787 -0.0131337 -0.0306213 -0.0507519 2 1 2.7064755 1.8148000 4.2722654 0.0098455 0.0487254 0.0147401 3 1 1.6043806 3.7754576 3.4727263 -0.0199951 0.0323809 -0.0108757 4 1 4.2626389 2.1819717 2.3907804 0.0187793 -0.0095807 -0.0191041 5 1 5.0567988 2.0670996 4.6701378 0.0354908 -0.0258972 0.0155388 6 1 3.1002406 4.1338666 1.6367430 -0.0219314 -0.0111690 0.0410996 7 1 3.9183080 4.0525686 3.9594754 -0.0090554 -0.0038380 0.0093533 ITEM: TIMESTEP 13 ITEM: NUMBER OF ATOMS 7 ITEM: BOX BOUNDS ff ff ff -2.5000000000000000e+01 2.5000000000000000e+01 -2.5000000000000000e+01 2.5000000000000000e+01 -2.5000000000000000e+01 2.5000000000000000e+01 ITEM: ATOMS id type x y z fx fy fz 1 1 1.9249017 1.9734173 1.9403568 0.0120123 0.0023714 0.0444043 2 1 2.7069928 1.8199054 4.2728024 0.0160362 0.0406566 -0.0511254 3 1 1.6003567 3.7791502 3.4738002 -0.0252522 -0.0131185 -0.0292093 4 1 4.2663754 2.1795676 2.3885821 -0.0064563 0.0055948 0.0377292 5 1 5.0603148 2.0646413 4.6716040 -0.0186082 0.0076004 -0.0364618 6 1 3.0977103 4.1312804 1.6399805 -0.0009193 -0.0097680 0.0250185 7 1 3.9168484 4.0519798 3.9598810 0.0231876 -0.0333367 0.0096445 ITEM: TIMESTEP 14 ITEM: NUMBER OF ATOMS 7 ITEM: BOX BOUNDS ff ff ff -2.5000000000000000e+01 2.5000000000000000e+01 -2.5000000000000000e+01 2.5000000000000000e+01 -2.5000000000000000e+01 2.5000000000000000e+01 ITEM: ATOMS id type x y z fx fy fz 1 1 1.9259388 1.9729384 1.9396060 0.0061239 -0.0050491 0.0473519 2 1 2.7085393 1.8270331 4.2697200 -0.0336672 -0.0290412 -0.0100374 3 1 1.5952086 3.7813641 3.4726875 -0.0250793 0.0041760 -0.0048904 4 1 4.2690872 2.1779225 2.3893337 0.0181257 -0.0076778 -0.0268427 5 1 5.0619996 2.0630890 4.6703213 0.0027548 0.0003777 -0.0157576 6 1 3.0955079 4.1284187 1.6444477 0.0266594 0.0020095 0.0006457 7 1 3.9172186 4.0491761 3.9608909 0.0050827 0.0352049 0.0095306 ITEM: TIMESTEP 15 ITEM: NUMBER OF ATOMS 7 ITEM: BOX BOUNDS ff ff ff -2.5000000000000000e+01 2.5000000000000000e+01 -2.5000000000000000e+01 2.5000000000000000e+01 -2.5000000000000000e+01 2.5000000000000000e+01 ITEM: ATOMS id type x y z fx fy fz 1 1 1.9270560 1.9722589 1.9426107 0.0006958 -0.0058224 0.0002186 2 1 2.7070535 1.8294730 4.2670008 0.0089879 -0.0181517 0.0215622 3 1 1.5900550 3.7830936 3.4716126 0.0093481 0.0260482 0.0180253 4 1 4.2721638 2.1763004 2.3878398 0.0169438 0.0003902 -0.0116427 5 1 5.0632846 2.0621198 4.6683370 -0.0193550 0.0079708 -0.0182193 6 1 3.0960564 4.1267286 1.6473646 0.0235247 -0.0029604 0.0055443 7 1 3.9178306 4.0499677 3.9622415 -0.0401452 -0.0074747 -0.0154884 ITEM: TIMESTEP 16 ITEM: NUMBER OF ATOMS 7 ITEM: BOX BOUNDS ff ff ff -2.5000000000000000e+01 2.5000000000000000e+01 -2.5000000000000000e+01 2.5000000000000000e+01 -2.5000000000000000e+01 2.5000000000000000e+01 ITEM: ATOMS id type x y z fx fy fz 1 1 1.9278680 1.9713093 1.9446550 0.0189952 0.0289397 0.0090194 2 1 2.7068105 1.8295856 4.2669879 0.0065645 0.0133842 -0.0052168 3 1 1.5873696 3.7864589 3.4724097 0.0009057 -0.0102824 0.0094373 4 1 4.2756686 2.1752397 2.3858496 -0.0048040 -0.0089819 0.0032708 5 1 5.0625170 2.0621392 4.6654609 -0.0030831 0.0068737 -0.0012763 6 1 3.0984123 4.1253391 1.6497994 -0.0041559 -0.0068782 -0.0148478 7 1 3.9148540 4.0498703 3.9618444 -0.0144224 -0.0230551 -0.0003866 ITEM: TIMESTEP 17 ITEM: NUMBER OF ATOMS 7 ITEM: BOX BOUNDS ff ff ff -2.5000000000000000e+01 2.5000000000000000e+01 -2.5000000000000000e+01 2.5000000000000000e+01 -2.5000000000000000e+01 2.5000000000000000e+01 ITEM: ATOMS id type x y z fx fy fz 1 1 1.9296257 1.9730303 1.9462155 -0.0003328 0.0127522 -0.0057440 2 1 2.7071888 1.8306230 4.2665971 -0.0099121 -0.0115683 0.0102011 3 1 1.5862613 3.7871723 3.4734552 -0.0222820 0.0031616 0.0030882 4 1 4.2768476 2.1741124 2.3852202 0.0139221 -0.0142981 -0.0071237 5 1 5.0619535 2.0626552 4.6641082 0.0193557 -0.0059146 0.0151031 6 1 3.0991363 4.1242232 1.6497686 -0.0071575 0.0072222 -0.0123531 7 1 3.9124867 4.0481256 3.9616421 0.0064066 0.0086450 -0.0031715 ITEM: TIMESTEP 18 ITEM: NUMBER OF ATOMS 7 ITEM: BOX BOUNDS ff ff ff -2.5000000000000000e+01 2.5000000000000000e+01 -2.5000000000000000e+01 2.5000000000000000e+01 -2.5000000000000000e+01 2.5000000000000000e+01 ITEM: ATOMS id type x y z fx fy fz 1 1 1.9318299 1.9765140 1.9476201 -0.0094088 -0.0067669 -0.0052682 2 1 2.7066660 1.8307714 4.2671334 0.0147341 -0.0018741 -0.0052653 3 1 1.5825922 3.7884010 3.4750994 -0.0106891 0.0134135 -0.0059755 4 1 4.2797596 2.1712281 2.3836969 0.0081192 0.0080402 0.0213729 5 1 5.0631976 2.0627128 4.6639165 -0.0026466 -0.0046050 0.0014908 6 1 3.0993328 4.1235345 1.6484775 -0.0031539 0.0033466 0.0234478 7 1 3.9101219 4.0467803 3.9610632 0.0030451 -0.0115542 -0.0298024 ITEM: TIMESTEP 19 ITEM: NUMBER OF ATOMS 7 ITEM: BOX BOUNDS ff ff ff -2.5000000000000000e+01 2.5000000000000000e+01 -2.5000000000000000e+01 2.5000000000000000e+01 -2.5000000000000000e+01 2.5000000000000000e+01 ITEM: ATOMS id type x y z fx fy fz 1 1 1.9337606 1.9803789 1.9489235 0.0074685 -0.0119300 0.0158039 2 1 2.7074634 1.8307769 4.2673042 -0.0024080 0.0205318 -0.0273718 3 1 1.5767324 3.7913508 3.4766442 0.0051673 -0.0029610 0.0002548 4 1 4.2843736 2.1682728 2.3838558 -0.0038022 0.0061124 -0.0116190 5 1 5.0645548 2.0623255 4.6638161 -0.0075034 -0.0045664 0.0053268 6 1 3.0992725 4.1229720 1.6491476 -0.0019866 -0.0094366 0.0195596 7 1 3.9073427 4.0438651 3.9573155 0.0030645 0.0022498 -0.0019542 ITEM: TIMESTEP 20 ITEM: NUMBER OF ATOMS 7 ITEM: BOX BOUNDS ff ff ff -2.5000000000000000e+01 2.5000000000000000e+01 -2.5000000000000000e+01 2.5000000000000000e+01 -2.5000000000000000e+01 2.5000000000000000e+01 ITEM: ATOMS id type x y z fx fy fz 1 1 1.9351218 1.9814478 1.9505055 -0.0001961 -0.0172109 -0.0030524 2 1 2.7076872 1.8320444 4.2656977 -0.0060710 0.0076847 -0.0035009 3 1 1.5743159 3.7925451 3.4773809 -0.0065692 0.0079036 0.0070585 4 1 4.2862928 2.1672701 2.3832142 0.0139070 -0.0040651 -0.0162569 5 1 5.0647260 2.0618634 4.6640974 -0.0094716 -0.0013418 -0.0045783 6 1 3.0991219 4.1221281 1.6506654 -0.0041764 -0.0057387 -0.0005306 7 1 3.9062344 4.0426432 3.9554459 0.0125772 0.0127682 0.0208606 ITEM: TIMESTEP 21 ITEM: NUMBER OF ATOMS 7 ITEM: BOX BOUNDS ff ff ff -2.5000000000000000e+01 2.5000000000000000e+01 -2.5000000000000000e+01 2.5000000000000000e+01 -2.5000000000000000e+01 2.5000000000000000e+01 ITEM: ATOMS id type x y z fx fy fz 1 1 1.9351097 1.9803886 1.9503176 0.0043271 -0.0038744 0.0020252 2 1 2.7073136 1.8325173 4.2654822 0.0020209 0.0142262 -0.0134539 3 1 1.5739116 3.7930315 3.4778153 0.0066519 0.0031137 -0.0024931 4 1 4.2871486 2.1670199 2.3822138 -0.0009368 0.0082762 0.0056584 5 1 5.0641431 2.0617808 4.6638157 -0.0045426 -0.0025188 -0.0063000 6 1 3.0988649 4.1217749 1.6506327 -0.0041030 -0.0146481 0.0202234 7 1 3.9070084 4.0434289 3.9567297 -0.0034175 -0.0045747 -0.0056601 ITEM: TIMESTEP 22 ITEM: NUMBER OF ATOMS 7 ITEM: BOX BOUNDS ff ff ff -2.5000000000000000e+01 2.5000000000000000e+01 -2.5000000000000000e+01 2.5000000000000000e+01 -2.5000000000000000e+01 2.5000000000000000e+01 ITEM: ATOMS id type x y z fx fy fz 1 1 1.9355108 1.9788561 1.9503055 -0.0052586 -0.0000622 -0.0049100 2 1 2.7070973 1.8343980 4.2639579 -0.0024115 -0.0019327 -0.0002237 3 1 1.5741050 3.7938630 3.4780530 -0.0118138 0.0049867 -0.0016202 4 1 4.2879976 2.1675379 2.3816582 0.0056567 -0.0034105 0.0035471 5 1 5.0630689 2.0614491 4.6629035 0.0130960 -0.0050701 0.0045183 6 1 3.0981902 4.1199852 1.6525330 -0.0003236 0.0013715 0.0046363 7 1 3.9075301 4.0438527 3.9575958 0.0010548 0.0041173 -0.0059478 ITEM: TIMESTEP 23 ITEM: NUMBER OF ATOMS 7 ITEM: BOX BOUNDS ff ff ff -2.5000000000000000e+01 2.5000000000000000e+01 -2.5000000000000000e+01 2.5000000000000000e+01 -2.5000000000000000e+01 2.5000000000000000e+01 ITEM: ATOMS id type x y z fx fy fz 1 1 1.9352853 1.9782483 1.9499429 0.0002672 0.0069921 0.0003666 2 1 2.7068364 1.8349974 4.2633416 0.0061434 0.0045685 -0.0024130 3 1 1.5733201 3.7945538 3.4780285 -0.0092051 -0.0010092 0.0002767 4 1 4.2887440 2.1674932 2.3816981 0.0009495 -0.0066685 0.0022641 5 1 5.0636006 2.0609490 4.6628738 0.0016790 0.0028635 0.0009762 6 1 3.0979011 4.1193807 1.6536190 -0.0002936 0.0009957 -0.0032113 7 1 3.9078124 4.0443196 3.9575032 0.0004596 -0.0077421 0.0017408