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lammps/examples/accelerate/data.phosphate
cf33c0e7fba4lammm-master-deprecated

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data.phosphate
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LAMMPS data file from restart file: timestep = 2300000, procs = 1
10950 atoms
3 atom types
3.3020149922683089e+01 8.6979850077318886e+01 xlo xhi
3.3020149922683089e+01 8.6979850077318886e+01 ylo yhi
3.3020149922683089e+01 8.6979850077318886e+01 zlo zhi
Masses
1 6.94
2 30
3 16
Atoms
5463 3 -7.4000000953674316e-01 7.0676406860351562e+01 3.7625564575195312e+01 5.0404411315917969e+01 -1 1 0
402 2 1.8500000238418579e+00 6.8157226562500000e+01 4.6085372924804688e+01 8.4884017944335938e+01 -1 0 -1
8911 3 -7.4000000953674316e-01 5.2260524749755859e+01 8.6196044921875000e+01 4.5918945312500000e+01 0 -1 1
2354 2 1.8500000238418579e+00 4.2486614227294922e+01 4.1867443084716797e+01 4.1373374938964844e+01 0 0 1
9464 3 -7.4000000953674316e-01 8.2748733520507812e+01 4.5790035247802734e+01 5.1023464202880859e+01 -1 0 1
2171 2 1.8500000238418579e+00 8.3124130249023438e+01 7.8775550842285156e+01 4.2085876464843750e+01 -1 -1 1
9378 3 -7.4000000953674316e-01 3.4525768280029297e+01 8.5904006958007812e+01 4.2582099914550781e+01 0 -1 1
3610 3 -7.4000000953674316e-01 5.1174293518066406e+01 4.6978977203369141e+01 8.3476417541503906e+01 0 0 -1
6468 3 -7.4000000953674316e-01 5.7061195373535156e+01 4.6211250305175781e+01 8.2488533020019531e+01 0 0 -1
85 1 3.7000000476837158e-01 5.2763397216796875e+01 6.5038055419921875e+01 5.3075317382812500e+01 1 -1 -1
5303 3 -7.4000000953674316e-01 5.1252948760986328e+01 3.3987667083740234e+01 3.6899776458740234e+01 0 0 0
2312 2 1.8500000238418579e+00 4.0049030303955078e+01 8.0681945800781250e+01 7.6533416748046875e+01 0 -1 0
5617 3 -7.4000000953674316e-01 5.5550880432128906e+01 3.8740242004394531e+01 4.2217643737792969e+01 0 0 0
10463 3 -7.4000000953674316e-01 4.3726249694824219e+01 3.9108455657958984e+01 8.2423873901367188e+01 0 0 0
3648 3 -7.4000000953674316e-01 4.7705844879150391e+01 4.7501720428466797e+01 4.3614498138427734e+01 0 0 0
3571 3 -7.4000000953674316e-01 3.3077461242675781e+01 4.7157432556152344e+01 3.5177570343017578e+01 0 0 0
4413 3 -7.4000000953674316e-01 5.8554069519042969e+01 8.6314773559570312e+01 8.3069923400878906e+01 0 -1 -1
4826 3 -7.4000000953674316e-01 4.6327091217041016e+01 3.6308002471923828e+01 3.5881088256835938e+01 0 0 0
4782 3 -7.4000000953674316e-01 3.5574321746826172e+01 8.5029525756835938e+01 8.3213058471679688e+01 0 -1 -1
5251 3 -7.4000000953674316e-01 5.5072334289550781e+01 4.6350387573242188e+01 3.7371910095214844e+01 0 0 0
1324 2 1.8500000238418579e+00 5.4430198669433594e+01 3.4797378540039062e+01 8.2316390991210938e+01 0 0 -1
4399 3 -7.4000000953674316e-01 7.1526687622070312e+01 3.5970573425292969e+01 3.9819705963134766e+01 0 0 0
8908 3 -7.4000000953674316e-01 3.8285278320312500e+01 3.4389781951904297e+01 8.1078247070312500e+01 0 0 0
5350 3 -7.4000000953674316e-01 4.9121482849121094e+01 7.5971771240234375e+01 7.1196746826171875e+01 0 0 -1
4161 3 -7.4000000953674316e-01 4.9853645324707031e+01 8.1712738037109375e+01 8.3921028137207031e+01 0 -1 -1
5492 3 -7.4000000953674316e-01 5.1287258148193359e+01 3.8848354339599609e+01 8.4772682189941406e+01 0 0 -1
9413 3 -7.4000000953674316e-01 3.9380481719970703e+01 3.8990364074707031e+01 8.2291503906250000e+01 0 0 0
4189 3 -7.4000000953674316e-01 6.3413795471191406e+01 8.1712753295898438e+01 8.0954917907714844e+01 0 -1 -1
2453 2 1.8500000238418579e+00 6.6429306030273438e+01 8.6979605244967829e+01 4.2237339019775391e+01 0 -1 1
2445 2 1.8500000238418579e+00 5.6901329040527344e+01 4.1405838012695312e+01 4.1148876190185547e+01 0 0 1
3897 3 -7.4000000953674316e-01 5.4464019775390625e+01 3.8337657928466797e+01 8.2126327514648438e+01 0 0 -1
5363 3 -7.4000000953674316e-01 7.1433135986328125e+01 4.6809188842773438e+01 8.6308578491210938e+01 0 0 -1
3988 3 -7.4000000953674316e-01 7.4009040832519531e+01 3.6222160339355469e+01 3.8860977172851562e+01 0 0 0
7132 3 -7.4000000953674316e-01 7.1577445983886719e+01 7.1756134033203125e+01 5.2741641998291016e+01 0 -1 0
1460 2 1.8500000238418579e+00 7.2950439453125000e+01 8.4759010314941406e+01 4.1335674285888672e+01 0 -1 0
8231 3 -7.4000000953674316e-01 7.1832977294921875e+01 7.8167129516601562e+01 4.1664703369140625e+01 0 -1 1
9415 3 -7.4000000953674316e-01 7.1584953308105469e+01 8.0696502685546875e+01 3.4151336669921875e+01 0 -1 1
3198 2 1.8500000238418579e+00 6.2591575622558594e+01 7.0954322814941406e+01 4.1823932647705078e+01 0 -1 1
2622 2 1.8500000238418579e+00 7.1352020263671875e+01 4.3797088623046875e+01 4.8986751556396484e+01 0 0 1
10188 3 -7.4000000953674316e-01 5.3369388580322266e+01 6.8009094238281250e+01 3.8717746734619141e+01 0 -1 1
4492 3 -7.4000000953674316e-01 8.1667518615722656e+01 7.9072563171386719e+01 3.8250682830810547e+01 0 -1 0
8569 3 -7.4000000953674316e-01 5.0716682434082031e+01 8.5301872253417969e+01 3.7421688079833984e+01 0 -1 1
9123 3 -7.4000000953674316e-01 7.1235145568847656e+01 4.3041988372802734e+01 4.7761669158935547e+01 0 0 1
9512 3 -7.4000000953674316e-01 8.6578384399414062e+01 6.9725265502929688e+01 4.6443225860595703e+01 0 -1 1
2910 2 1.8500000238418579e+00 7.0983703613281250e+01 8.6165313720703125e+01 7.5909797668457031e+01 0 -1 0
5300 3 -7.4000000953674316e-01 6.8747085571289062e+01 4.6335971832275391e+01 3.9461791992187500e+01 0 0 0
10461 3 -7.4000000953674316e-01 6.7920623779296875e+01 4.3101154327392578e+01 3.5736682891845703e+01 0 1 1
10439 3 -7.4000000953674316e-01 6.8144622802734375e+01 8.0497344970703125e+01 7.3878700256347656e+01 0 -1 0
3843 3 -7.4000000953674316e-01 8.4293930053710938e+01 8.2998336791992188e+01 7.8517097473144531e+01 0 -1 -1
1262 2 1.8500000238418579e+00 6.8669982910156250e+01 8.4241058349609375e+01 8.1192543029785156e+01 0 -1 -1
4947 3 -7.4000000953674316e-01 7.6517913818359375e+01 8.5675514221191406e+01 3.7188529968261719e+01 0 -1 0
7089 3 -7.4000000953674316e-01 7.5723861694335938e+01 3.8905761718750000e+01 4.0621688842773438e+01 0 0 0
6021 3 -7.4000000953674316e-01 7.0778907775878906e+01 3.3195236206054688e+01 8.3002861022949219e+01 0 1 -1
1248 2 1.8500000238418579e+00 8.4850708007812500e+01 4.2950614929199219e+01 8.2565086364746094e+01 0 1 -1
3780 3 -7.4000000953674316e-01 8.1943817138671875e+01 4.5560024261474609e+01 4.6605369567871094e+01 0 0 0
1861 2 1.8500000238418579e+00 8.6100852966308594e+01 3.6289981842041016e+01 7.4119224548339844e+01 0 0 0
3728 3 -7.4000000953674316e-01 3.8203662872314453e+01 8.4142608642578125e+01 4.2084625244140625e+01 0 -1 0
205 1 3.7000000476837158e-01 5.7569557189941406e+01 8.1793701171875000e+01 8.1592666625976562e+01 0 0 0
4912 3 -7.4000000953674316e-01 3.6140735626220703e+01 8.6308609008789062e+01 7.7731369018554688e+01 0 -1 -1
86 1 3.7000000476837158e-01 4.3018844604492188e+01 7.3290351867675781e+01 5.2874591827392578e+01 0 -1 0
9597 3 -7.4000000953674316e-01 8.5385292053222656e+01 3.4950908660888672e+01 3.6740036010742188e+01 -1 0 1
4593 3 -7.4000000953674316e-01 3.7404029846191406e+01 8.6440818786621094e+01 4.1515785217285156e+01 0 -1 0
523 2 1.8500000238418579e+00 5.4115970611572266e+01 5.1361915588378906e+01 4.0914638519287109e+01 0 0 0
558 2 1.8500000238418579e+00 8.6289123535156250e+01 8.4268646240234375e+01 8.2633102416992188e+01 -1 -1 -1
4525 3 -7.4000000953674316e-01 3.3609779357910156e+01 8.3096405029296875e+01 3.6184349060058594e+01 0 -1 0
3614 3 -7.4000000953674316e-01 5.1371582031250000e+01 4.3209854125976562e+01 4.0286846160888672e+01 0 0 0
3451 3 -7.4000000953674316e-01 4.5902477264404297e+01 3.9619667053222656e+01 4.5880470275878906e+01 0 0 0
5042 3 -7.4000000953674316e-01 5.1536266326904297e+01 3.4124309539794922e+01 3.4288570404052734e+01 0 0 0
6781 3 -7.4000000953674316e-01 5.1927684783935547e+01 3.4526062011718750e+01 7.4973892211914062e+01 0 0 0
3421 3 -7.4000000953674316e-01 6.5339218139648438e+01 4.1313529968261719e+01 8.1411163330078125e+01 0 0 -1
1094 2 1.8500000238418579e+00 5.9737983703613281e+01 3.9065383911132812e+01 4.9111972808837891e+01 0 0 0
6860 3 -7.4000000953674316e-01 6.2840648651123047e+01 4.2380672454833984e+01 4.2226528167724609e+01 0 0 0
649 2 1.8500000238418579e+00 5.3653053283691406e+01 7.5272064208984375e+01 4.8747241973876953e+01 0 -1 0
7672 3 -7.4000000953674316e-01 6.3605350494384766e+01 4.7320766448974609e+01 4.6977588653564453e+01 0 0 1
4048 3 -7.4000000953674316e-01 5.5861968994140625e+01 4.0191059112548828e+01 3.7958187103271484e+01 0 0 0
4717 3 -7.4000000953674316e-01 4.4531166076660156e+01 4.5252555847167969e+01 6.5200256347656250e+01 0 0 -1
4245 3 -7.4000000953674316e-01 7.4319694519042969e+01 3.9735046386718750e+01 8.4109802246093750e+01 0 0 -1
1140 2 1.8500000238418579e+00 5.5571949005126953e+01 3.9375045776367188e+01 3.3855060577392578e+01 0 0 0
3477 3 -7.4000000953674316e-01 5.5290439605712891e+01 8.2095352172851562e+01 7.9216621398925781e+01 0 -1 -1
1587 2 1.8500000238418579e+00 5.5225284576416016e+01 7.4478096008300781e+01 8.2224304199218750e+01 0 0 -1
232 1 3.7000000476837158e-01 7.4384353637695312e+01 6.0606765747070312e+01 3.9417255401611328e+01 -1 -1 2
9616 3 -7.4000000953674316e-01 6.3139648437500000e+01 3.6655357360839844e+01 4.9288726806640625e+01 0 0 1
20 1 3.7000000476837158e-01 3.5397449493408203e+01 4.0141777038574219e+01 6.2275676727294922e+01 0 -1 0
1181 2 1.8500000238418579e+00 7.2456634521484375e+01 5.0005775451660156e+01 3.4020057678222656e+01 0 0 0
10085 3 -7.4000000953674316e-01 7.0837165832519531e+01 3.5701801300048828e+01 4.8288875579833984e+01 0 0 1
2008 2 1.8500000238418579e+00 7.7413452148437500e+01 3.9672439575195312e+01 5.0623859405517578e+01 0 0 1
4865 3 -7.4000000953674316e-01 7.3465469360351562e+01 5.7007820129394531e+01 3.9653293609619141e+01 0 0 0
7061 3 -7.4000000953674316e-01 8.0631668090820312e+01 4.1064212799072266e+01 4.6260719299316406e+01 0 0 0
140 1 3.7000000476837158e-01 7.2590423583984375e+01 6.3516986846923828e+01 6.4312004089355469e+01 1 -1 0
3717 3 -7.4000000953674316e-01 7.5006263732910156e+01 5.6057853698730469e+01 8.3998146057128906e+01 0 0 -1
6843 3 -7.4000000953674316e-01 6.0852859497070312e+01 4.6444816589355469e+01 8.3615821838378906e+01 0 0 -1
4501 3 -7.4000000953674316e-01 7.5321281433105469e+01 3.9070827484130859e+01 3.5465671539306641e+01 0 0 0
1168 2 1.8500000238418579e+00 6.6927047729492188e+01 5.4221263885498047e+01 3.3770675659179688e+01 0 0 0
3755 3 -7.4000000953674316e-01 7.4626609802246094e+01 7.2149719238281250e+01 4.3206993103027344e+01 0 -1 0
8902 3 -7.4000000953674316e-01 6.9928108215332031e+01 3.6264030456542969e+01 3.7990962982177734e+01 0 0 1
674 2 1.8500000238418579e+00 6.9780128479003906e+01 3.8679855346679688e+01 4.0912914276123047e+01 0 0 0
6425 3 -7.4000000953674316e-01 6.3475486755371094e+01 3.4267097473144531e+01 8.0492706298828125e+01 0 0 -1
874 2 1.8500000238418579e+00 6.9619842529296875e+01 3.4829307556152344e+01 4.8834911346435547e+01 0 0 0
2924 2 1.8500000238418579e+00 6.5486877441406250e+01 4.0146694183349609e+01 3.7864730834960938e+01 0 0 1
6125 3 -7.4000000953674316e-01 7.2718444824218750e+01 4.6423469543457031e+01 3.7408721923828125e+01 0 0 0
2611 2 1.8500000238418579e+00 6.8972534179687500e+01 4.1973560333251953e+01 5.3494335174560547e+01 0 0 1
1785 2 1.8500000238418579e+00 7.8138298034667969e+01 7.5093643188476562e+01 8.1147712707519531e+01 0 -1 -1
5749 3 -7.4000000953674316e-01 7.4519020080566406e+01 4.2709087371826172e+01 4.3978679656982422e+01 0 0 0
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3873 3 -7.4000000953674316e-01 7.6886215209960938e+01 8.6809646606445312e+01 8.2760337829589844e+01 0 -1 -1
2642 2 1.8500000238418579e+00 6.3329612731933594e+01 7.4527145385742188e+01 4.4436439514160156e+01 0 -1 1
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3363 3 -7.4000000953674316e-01 4.1877204895019531e+01 3.9562225341796875e+01 3.6086875915527344e+01 1 0 0
6832 3 -7.4000000953674316e-01 8.1519889831542969e+01 4.3059585571289062e+01 8.3206192016601562e+01 0 0 -1
5323 3 -7.4000000953674316e-01 8.3924926757812500e+01 4.6806621551513672e+01 7.9943962097167969e+01 0 0 -1
3305 3 -7.4000000953674316e-01 8.4542373657226562e+01 4.0082061767578125e+01 3.6223804473876953e+01 0 0 0
6905 3 -7.4000000953674316e-01 8.6124427795410156e+01 7.9416496276855469e+01 7.4262672424316406e+01 0 -1 -1
4427 3 -7.4000000953674316e-01 3.4216217041015625e+01 8.1493072509765625e+01 3.7955471038818359e+01 0 -1 0
3375 3 -7.4000000953674316e-01 8.1664794921875000e+01 7.5754562377929688e+01 4.0334980010986328e+01 -1 0 0
162 1 3.7000000476837158e-01 4.7618160247802734e+01 4.7390953063964844e+01 6.3284858703613281e+01 0 1 0
1670 2 1.8500000238418579e+00 7.3810150146484375e+01 3.7921028137207031e+01 4.7313976287841797e+01 -1 0 0
1091 2 1.8500000238418579e+00 4.2636451721191406e+01 3.8752769470214844e+01 3.5033245086669922e+01 0 0 0
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4728 3 -7.4000000953674316e-01 3.8418018341064453e+01 4.2150287628173828e+01 6.9308525085449219e+01 0 0 -1
94 1 3.7000000476837158e-01 4.1729995727539062e+01 3.6607765197753906e+01 3.8939899444580078e+01 0 -1 -1
10826 3 -7.4000000953674316e-01 8.5720573425292969e+01 8.0400558471679688e+01 4.4086364746093750e+01 -1 -1 1
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93 1 3.7000000476837158e-01 4.8423873901367188e+01 4.5248580932617188e+01 7.1929595947265625e+01 -1 0 0
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6219 3 -7.4000000953674316e-01 6.4646087646484375e+01 5.2292453765869141e+01 5.3297809600830078e+01 0 0 0
39 1 3.7000000476837158e-01 6.4511413574218750e+01 6.7514495849609375e+01 8.5169776916503906e+01 0 0 -1
525 2 1.8500000238418579e+00 3.4927043914794922e+01 3.4477275848388672e+01 3.8425674438476562e+01 0 0 0
7753 3 -7.4000000953674316e-01 4.2681602478027344e+01 8.4764396667480469e+01 4.7761779785156250e+01 0 -1 1
5005 3 -7.4000000953674316e-01 7.2339248657226562e+01 3.6585094451904297e+01 8.1421089172363281e+01 0 0 -1
5382 3 -7.4000000953674316e-01 6.1105964660644531e+01 4.7462036132812500e+01 4.3682132720947266e+01 0 0 0
1107 2 1.8500000238418579e+00 6.2040771484375000e+01 4.8588188171386719e+01 4.3546291351318359e+01 0 0 0
231 1 3.7000000476837158e-01 3.8476444244384766e+01 4.7803562164306641e+01 7.0279891967773438e+01 -1 1 0
4042 3 -7.4000000953674316e-01 6.6547454833984375e+01 4.6032756805419922e+01 5.1444717407226562e+01 0 0 0
4832 3 -7.4000000953674316e-01 3.7318485260009766e+01 6.2402408599853516e+01 3.4513095855712891e+01 1 0 0
7923 3 -7.4000000953674316e-01 6.8162918090820312e+01 4.0977077484130859e+01 4.2635780334472656e+01 0 0 1
6769 3 -7.4000000953674316e-01 6.5285018920898438e+01 4.8893829345703125e+01 4.0887966156005859e+01 0 0 0
5198 3 -7.4000000953674316e-01 7.3010635375976562e+01 3.8436439514160156e+01 3.4913101196289062e+01 0 0 0
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