LAMMPS data file via write_data, version 21 Jan 2015-ICMS, timestep = 100000

1344 atoms
4 atom types

-2.4345617149032606e-002 2.6388343617149062e+001 xlo xhi
-2.1375951528957771e-002 2.3169374951528781e+001 ylo yhi
-1.9777461150086495e-002 2.1437776461149753e+001 zlo zhi

Masses

1 12.011
2 1.008
3 14.007
4 15.999

Atoms # charge

1 1 -1.1248570771531095e-002 2.7484122215919311e+000 4.1003531118996586e+000 4.5535811290064307e+000 0 0 0
2 1 9.8749863934320323e-003 9.4811235674254135e-001 3.1178864322479076e+000 3.0011343684790193e+000 0 0 0
3 1 2.9135502838717811e-004 2.7739551729333178e+000 4.6224166611560227e+000 2.0183572955170983e+000 0 0 0
4 2 2.7738363449229131e-001 3.5145373118581107e+000 3.2740615371394854e+000 4.6926235291518870e+000 0 0 0
5 2 2.3278213125526798e-001 2.7441573223221218e+000 4.6970524925656578e+000 5.5302401325409374e+000 0 0 0
7 2 2.5443843990477649e-001 1.4192289115674019e+000 2.1132584943014616e+000 2.8123764012619192e+000 0 0 0
8 2 2.4902253597622048e-001 3.4774884079081820e+000 3.8313473640367910e+000 1.5949062459144530e+000 0 0 0
9 2 2.5329527082283887e-001 2.9522649034801036e+000 5.4617898213459268e+000 1.3572862718005976e+000 0 0 0
10 3 -1.3459123343452867e-001 3.2577721199058427e+000 4.9535326608404429e+000 3.3977693370546862e+000 0 0 0
11 3 -1.4924687003980133e-001 1.3933553489040440e+000 3.4726531508031986e+000 4.3943476497951437e+000 0 0 0
12 3 -1.9217489938683568e-001 1.4492866682894210e+000 3.9367601373426324e+000 1.8245278344416884e+000 0 0 0
13 3 3.5961506574152047e-001 3.0728348361539553e+000 6.4501080808295832e+000 3.6606131914963957e+000 0 0 0
16 4 -3.1871020384290760e-001 2.8627905354781582e+000 7.3068818764439651e+000 2.7140009600730317e+000 0 0 0
17 4 -3.8127613948097816e-001 3.4467775341481985e+000 6.8811662730023615e+000 4.8308559112091158e+000 0 0 0
81 4 -3.7951148602364021e-001 5.1079988724108967e+000 2.8613326453260863e+000 6.0579324161167669e+000 0 0 0
125 4 -2.7537243379281051e-001 5.6838975375767449e+000 4.8614450065396619e+000 3.3130893402647907e+000 0 0 0
496 3 3.4839741888709025e-001 3.5025706131781544e+000 8.3026855260915189e-001 3.7238740610306240e+000 0 1 0
499 4 -3.8186160540350023e-001 3.8979553983588993e+000 1.5970179384567842e+000 2.7666401523791526e+000 0 1 0
500 4 -3.7016793267661868e-001 2.8443383050193627e+000 1.2921615925147989e+000 4.7565143526440163e+000 0 1 0
712 4 -2.9769191195220607e-001 4.8922706322073024e+000 6.7167078548616610e+000 1.2613857893643201e+000 0 0 1
123 4 -3.2075723012802509e-001 5.4971139433098575e+000 3.7553672382804169e+000 7.9463185251020174e-001 0 0 0
707 3 3.1772425452400038e-001 5.5928371240540269e+000 7.6107507162517605e+000 6.2606306980291693e-001 0 0 1
141 3 3.6928705883525387e-001 6.5562958539266036e-001 1.2216046324386662e-001 6.7949872893896446e+000 0 0 0
21 4 -3.3924642964844476e-001 7.6924653158946932e-001 6.0274498992019439e+000 7.6170805597794178e-001 0 0 0
111 2 2.8550850865530214e-001 6.4983894444808694e+000 2.7302102017585925e+000 2.3868383818492824e+000 0 0 0
15 3 3.5708369060632822e-001 4.0329239699929115e-001 5.0187046262051709e+000 1.4886837843583436e+000 0 0 0
817 4 -2.8792339154049373e-001 2.3611096744261906e-001 1.2564282866113528e+000 7.3586094417642156e-001 0 0 1
30 2 2.3756351154441724e-001 4.9875381644270025e+000 5.4136553718697122e+000 6.9660551697813542e+000 0 0 0
29 2 2.6607662593358294e-001 3.7481444894046918e+000 6.6527158300018892e+000 6.8438198609329195e+000 0 0 0
77 3 3.3723424068336277e-001 6.2392103102816545e+000 2.3385657604608197e+000 5.6950216526906789e+000 0 0 0
270 4 -2.7251964167630149e-001 6.0087840795594594e-001 7.3502312265536727e+000 4.8783329129876982e+000 1 0 0
567 4 -3.0067137667828892e-001 4.9563312689849726e-001 7.0317055865470546e-002 3.7515144410479335e+000 1 1 0
135 2 2.3461434937143305e-001 3.1215161392695356e+000 1.7360690857602151e-001 6.8425299925160399e+000 0 0 0
803 2 2.2673217237792367e-001 2.6436401308023822e+000 1.4789860847059575e+000 3.0288418424325253e-001 0 0 1
19 4 -3.0627452885937068e-001 5.7186223737488062e-001 4.7848691723436119e+000 6.2370081371737713e+000 0 0 0
82 4 -3.1718201371818167e-001 6.2750765435879563e+000 1.6047843392520926e+000 4.6320897981234532e+000 0 0 0
504 4 -3.4559875545050434e-001 6.4520920391995356e+000 6.3318335502708312e-001 1.6100924915378971e+000 0 1 0
138 3 -1.5806946061636196e-001 1.4736475169026650e+000 1.3716592103661458e+000 7.1263146300834928e+000 0 0 0
14 3 3.4500306676332237e-001 2.5177948236347053e-001 4.2031304270380287e+000 5.1339429410096438e+000 0 0 0
119 3 3.5787568870787945e-001 6.6578175301198703e+000 3.9807825729625073e+000 2.6664532253139051e-001 0 0 0
120 3 3.4551621792741583e-001 6.9034990341832092e+000 5.0941761303032900e+000 3.6416840405700688e+000 0 0 0
126 4 -2.9926440883499272e-001 7.2149403425139207e+000 6.2436846916682587e+000 4.1755530638441556e+000 0 0 0
64 1 -1.1084084107767393e-002 8.5529793538003336e+000 1.4809114270575576e+000 6.2109710857937186e+000 0 0 0
67 2 2.3657556151236675e-001 9.1951178450302642e+000 1.7821062462482780e+000 5.3559475229313707e+000 0 0 0
68 2 2.5977925682204683e-001 7.9879095259135831e+000 6.1896247930954362e-001 5.7697170102678594e+000 0 0 0
74 3 -1.7724936253996673e-001 7.5598328470837250e+000 2.5791016223459580e+000 6.4374859644264300e+000 0 0 0
85 1 -1.7668415231091965e-002 1.0686881049701700e+001 7.2721245785452782e+000 6.0578028494015488e+000 0 0 0
89 2 2.2320801475167201e-001 1.0869842629819512e+001 6.6721643555501418e+000 5.1042185538125731e+000 0 0 0
103 4 -3.1656732519411246e-001 1.3058335113867210e+001 6.8840235203517777e+000 4.5393458225269043e+000 0 0 0
106 1 -1.1122135604225456e-002 9.1091279041534303e+000 4.2880217332061585e+000 8.1802442356416039e-001 0 0 0
107 1 -1.9134761401430993e-003 7.5931728160130323e+000 3.0058209763254209e+000 2.4027987240351965e+000 0 0 0
108 1 1.6211858567831937e-003 9.2657698664367221e+000 4.5015775730591789e+000 3.4251392006230708e+000 0 0 0
112 2 2.4987788806921610e-001 8.2623282220250420e+000 2.1044218596130047e+000 2.4512352718448427e+000 0 0 0
113 2 2.4269428531577697e-001 1.0119599787661448e+001 3.7638466742767154e+000 3.6844776886202073e+000 0 0 0
114 2 2.3387095196391530e-001 9.4471916426385381e+000 5.3720443152671002e+000 4.1419952896112200e+000 0 0 0
115 3 -1.6528850270450302e-001 9.6903954084517512e+000 4.9651831072667605e+000 2.0721399622290795e+000 0 0 0
116 3 -1.8922099815219026e-001 7.9194412608873526e+000 3.4176324108191429e+000 9.9766063202834765e-001 0 0 0
117 3 -1.6919730062939234e-001 7.9177175420624897e+000 3.9279928196337637e+000 3.5980980142941941e+000 0 0 0
118 3 3.4645197381643472e-001 9.6050978478859026e+000 6.4913312808398729e+000 1.9639657045741881e+000 0 0 0
186 4 -2.7573634675416647e-001 1.2681211922883463e+001 4.0432948199409395e+000 5.1976784585175944e+000 0 0 0
188 4 -3.0389612762665097e-001 1.2092350156125251e+001 4.1624566577464464e+000 1.5962685177106308e+000 0 0 0
391 3 3.6782491255006411e-001 1.0344494117571454e+001 6.7267377014980478e-001 2.3432162025754675e+000 0 1 0
394 4 -3.6575608097490236e-001 1.0653809904774754e+001 1.3416565923638788e+000 3.3964063518214975e+000 0 1 0
395 4 -3.6735262133321761e-001 9.9963087317775585e+000 1.2924300705374381e+000 1.2780855905455115e+000 0 1 0
98 3 3.5977870822902608e-001 1.3138369999112706e+001 7.6101825722882452e+000 5.5676754049475949e+000 0 0 0
101 4 -3.4088225345360290e-001 1.0323636333958312e+001 4.3069107190571234e+000 5.9190080539444621e+000 0 0 0
122 4 -3.2293534905394955e-001 9.6725336018895938e+000 7.0809425769748522e+000 8.2526903340100322e-001 0 0 0
121 4 -3.8630976136677786e-001 9.5990467810272868e+000 7.2348052375292395e+000 3.0211875348390591e+000 0 0 0
985 4 -3.1415994390536889e-001 1.3073148334323518e+001 9.9888248766554222e-001 1.1239052611720239e+000 0 0 1
109 2 2.5204342359639720e-001 9.8790830868438260e+000 3.5406294342081814e+000 4.9745669309950757e-001 0 0 0
42 4 -3.5137799723312363e-001 7.0618459867522061e+000 5.6514352286510237e+000 6.7284859712904161e+000 0 0 0
309 3 3.5520296037114907e-001 1.2868532219239711e+001 1.2825692807108753e+000 6.8663875037258579e+000 0 0 0
315 4 -3.6129762254715597e-001 1.2847759533482650e+001 2.0799597801548106e-001 6.1533398656753864e+000 0 0 0
97 3 3.4805890271890721e-001 1.0416605635884119e+001 4.8868234240173489e+000 7.0579778568647082e+000 0 0 0
980 3 3.3797692539453628e-001 1.2998470510652435e+001 1.6808477684232457e+000 2.1260429726712000e-002 0 0 1
110 2 2.3474387314936085e-001 9.0731439562866676e+000 5.0049652675478882e+000 -1.6078589024424161e-002 0 0 0
174 2 2.5620725272347500e-001 1.3096566417092454e+001 2.9315908018006391e+000 3.4490076934463780e+000 0 0 0
154 2 2.5216731687270372e-001 5.9423298194069387e+000 8.2112523167878262e+000 3.6331083385910641e+000 0 0 0
148 1 -2.6297553262042798e-003 3.5987159737066707e+000 1.0022770690751704e+001 4.4612896330940410e+000 0 0 0
149 1 2.8261384315091537e-003 6.0143770732529127e+000 9.3039873608808161e+000 3.9379088723833617e+000 0 0 0
150 1 -1.4117727246849461e-002 4.5271968063957049e+000 1.0363283095803030e+001 2.1410455501808352e+000 0 0 0
151 2 2.6084136659608759e-001 3.0961803964641144e+000 9.0325415342043627e+000 4.2038424699017281e+000 0 0 0
152 2 2.3441739312392371e-001 2.8198022222602170e+000 1.0439896493690357e+001 5.1995002859633574e+000 0 0 0
155 2 2.4337894655152895e-001 4.1599244217442086e+000 9.5064014373869341e+000 1.5470005579961041e+000 0 0 0
156 2 2.4431594355478850e-001 4.5929060390685228e+000 1.1111053834531258e+001 1.3025186927889101e+000 0 0 0
157 3 -1.3818935610601768e-001 3.4192105753643931e+000 1.0701813905003162e+001 3.1174151619419552e+000 0 0 0
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160 3 3.7327234657056568e-001 3.2565207384668171e+000 1.2232991085233810e+001 3.2744103349257347e+000 0 0 0
161 3 3.5447368300637094e-001 5.4936862591832156e+000 1.0620774350691736e+001 6.0168653268067738e+000 0 0 0
163 4 -4.2163048157135802e-001 3.2758246867553482e+000 1.2981153093175276e+001 2.2162653825103877e+000 0 0 0
164 4 -3.5284608177939952e-001 2.8333872810452685e+000 1.2695135215484010e+001 4.3852216254063556e+000 0 0 0
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230 4 -3.0685259807525417e-001 1.4993926363004071e+000 9.8655672994707526e+000 2.2042101607641822e+000 1 0 0
338 1 5.0926482123360879e-003 5.3462990403331045e-001 1.4865601307103702e+001 3.0121276977132845e+000 0 0 0
343 2 2.4635590172696437e-001 8.3047511715364541e-001 1.3851280161524674e+001 2.6373839545701467e+000 0 0 0
347 3 -1.5922378573755247e-001 1.0096937451436603e+000 1.4943202058877654e+001 4.4696313339996969e+000 0 0 0
417 4 -3.2408297792675844e-001 5.0763126686286357e+000 1.4423775356382341e+001 6.0771449407768090e+000 0 0 0
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483 4 -3.0878186253308632e-001 4.4287143191035411e-001 1.1414464372666448e+001 6.5154687128535578e+000 0 0 0
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168 4 -3.3625490152173532e-001 6.5245186818583631e+000 1.2159219670241947e+001 1.5834115211629607e+000 0 0 0
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924 4 -3.0311489549513138e-001 1.9981145066492495e+001 2.2959725836578151e+001 2.0203824431373121e+001 0 -1 0
1302 4 -3.6381364943788352e-001 1.9818553025754120e+001 1.7804801572433469e+001 1.4700794312990940e+001 0 0 0
1271 3 -1.9323022998920072e-001 2.5024210800451137e+001 1.9447136357272754e+001 1.6568288771700907e+001 0 0 0
1261 1 -8.1664794374637778e-003 2.3830764145828859e+001 1.8505163856678941e+001 1.6502053867655867e+001 0 0 0
1268 2 2.4678514752171429e-001 2.2854837632000212e+001 1.9017155958725986e+001 1.9366915700646864e+001 0 0 0
1264 2 2.2968322940206454e-001 2.2967234807955570e+001 1.9127419548751092e+001 1.6112919078899480e+001 0 0 0
1276 4 -3.6562342633576983e-001 2.3921423865861449e+001 1.5566806285108797e+001 1.8594355639212822e+001 0 0 0
1279 4 -2.7775028550728353e-001 2.6223016661418740e+001 1.8030090135980672e+001 1.4937163485510865e+001 0 0 0
1275 3 3.3350878245356058e-001 2.5992256103593505e+001 1.8269745329327037e+001 1.9642979255930825e+001 0 0 0
623 3 3.3399097027960689e-001 2.0829195440243893e+001 1.5915973389835633e+001 2.1032738537239283e+001 0 0 -1
1281 4 -3.1814964765678411e-001 2.5677995978983368e+001 1.7197288842191313e+001 2.0285213932758055e+001 0 0 0
1274 3 3.3769515881814904e-001 2.6303500264622933e+001 1.8961357996825704e+001 1.5819617162084434e+001 0 0 0
1329 2 2.5421596002591590e-001 1.9908721310081447e+001 2.0098573671121407e+001 1.5083019504403200e+001 0 0 0
920 4 -4.0346172683056852e-001 2.3021759567702837e+001 2.1423826525703163e+001 1.6638720852116066e+001 0 -1 0
1277 4 -3.9314173069106279e-001 2.3531947666938052e+001 1.5686905413054113e+001 1.6431618404703286e+001 0 0 0
1217 4 -3.4669640190644296e-001 2.0947597025888406e+001 1.8381968578293971e+001 1.7241120585350984e+001 0 0 0
1215 4 -3.3998257890014028e-001 2.1262082982850892e+001 1.9833236059733046e+001 2.1003244822855983e+001 0 0 0
1289 2 2.3806965564342128e-001 2.2793984708775241e+001 1.5578222202152734e+001 1.4461138786012327e+001 0 0 0
565 4 -3.3453506021607643e-001 2.4552539423166714e+001 2.2661893353564913e+001 2.0043175127873191e+001 0 0 -1
1290 2 2.1089290304362612e-001 2.2139000606397566e+001 1.7256509742267355e+001 1.4691737668860050e+001 0 0 0
1270 3 -1.5816283611494264e-001 2.3310188553662030e+001 1.7766215523199527e+001 1.7720498930153461e+001 0 0 0
1263 1 9.4083413352722550e-004 2.3664680194522738e+001 1.8361993453680903e+001 1.9038622127386013e+001 0 0 0
560 3 3.4903921203275856e-001 2.5258075595957671e+001 2.1808277477233652e+001 2.0651239287872777e+001 0 0 -1
628 4 -3.4953514142130448e-001 2.1534871273737799e+001 1.6725396618452081e+001 2.0310140239606994e+001 0 0 -1
919 4 -3.5241385270457015e-001 2.2110205436028458e+001 2.1445522833793099e+001 1.8659105708024917e+001 0 -1 0
1272 3 -1.7889338507318420e-001 2.4910195354704022e+001 1.9225307992257811e+001 1.9147683529843164e+001 0 0 0
1226 2 2.3980437014166608e-001 2.3778473022390585e+001 2.1000839667355343e+001 1.4463125351900874e+001 0 0 0
1273 3 3.6261202063974085e-001 2.3672874317942615e+001 1.6275537918594488e+001 1.7594732109625220e+001 0 0 0
1267 2 2.5142845047813128e-001 2.5079009960182326e+001 2.0995814215757584e+001 1.7996977494903014e+001 0 0 0
1269 2 2.5596976461310678e-001 2.3703707119183491e+001 1.7487507641721031e+001 1.9845381856394383e+001 0 0 0
1262 1 8.1764419665782840e-003 2.5386402461629373e+001 1.9950036423261203e+001 1.7906476280190560e+001 0 0 0
1203 2 2.5714091430237823e-001 2.0304860596595539e+001 2.0207515547025615e+001 1.9002282769834189e+001 0 0 0
1265 2 2.1328427614537099e-001 2.4010423085097536e+001 1.7826520585967614e+001 1.5618169015534765e+001 0 0 0

Velocities

1 -6.2767976475726793e-003 -4.5847741297146670e-004 7.6319147517564107e-003
2 2.0930016583333984e-003 6.7517793406174347e-003 -6.0161841704559635e-004
3 -4.0778271017137468e-003 4.0275029737503925e-003 -3.2310120535703124e-003
4 -1.4256177130977665e-002 5.3324602116330529e-004 -1.8220462491202301e-002
5 -1.0170918589257463e-002 -2.8203000145634307e-003 -5.7413476220447185e-005
7 1.0684547024053685e-002 9.5886012062936024e-003 -3.1255521140101911e-002
8 5.0692423747300533e-003 -3.5031516277071267e-002 1.3096798965978540e-002
9 2.0095163330685888e-002 -9.9800989512215978e-004 1.0507965773571786e-002
10 1.0715764912829861e-002 1.0484214703653130e-003 9.2097145212893762e-004
11 3.1709813301913979e-003 2.5022528972277309e-003 -3.1303966903298685e-003
12 8.0622228408614958e-003 -3.1766406451700126e-003 4.4653857269565606e-003
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109 6.5367216488747002e-003 -1.5805498988812183e-002 -1.9980863018678525e-002
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