LAMMPS data file via write_data, version 4 Mar 2014, timestep = 100

1280 atoms
5 atom types
128 bonds
1 bond types

-1.0320000000000000e+01 1.0320000000000000e+01 xlo xhi
-1.7931646038000000e+01 1.7931646038000000e+01 ylo yhi
-9.1966146809999998e+00 9.1966146809999998e+00 zlo zhi
2.2533867499999999e-01 -3.3938777480000000e+00 -3.6365652300000001e-01 xy xz yz

Masses

1 26.9815
2 28.0855
3 15.9994
4 15.9994
5 1.00797

Pair Coeffs

1 1.3297e-06 4.27132
2 1.8402e-06 3.30196
3 0.155416 3.16552
4 0.155416 3.16552
5 0 0

Bond Coeffs

1 553.935 1

Atoms

1 1 1 1.5750000000000000e+00 2.5993596520046260e+00 1.4882900600258182e+00 -1.0812491332750085e-03 0 0 0
2 1 2 2.1000000000000001e+00 3.3881083617607270e+00 8.8638081118868861e+00 2.7520703123178425e+00 0 0 0
3 1 2 2.1000000000000001e+00 3.4139343398345119e+00 2.8526270594973830e+00 2.7596168355590276e+00 0 0 0
4 1 3 -1.0500000000000000e+00 3.1875086232004897e+00 -3.1304936054915800e-02 1.1367387214371441e+00 0 0 0
5 1 3 -1.0500000000000000e+00 3.5527594315534881e+00 2.7568701063549739e+00 1.1381402995392769e+00 0 0 0
6 1 4 -9.4999999999999996e-01 9.1766045315059230e-01 1.5740631280969382e+00 1.0189580159233298e+00 0 0 0
7 1 3 -1.0500000000000000e+00 -4.3978237985006885e-01 3.5528966155392290e+00 3.2377228498225232e+00 0 0 0
8 1 3 -1.0500000000000000e+00 3.2966896305453979e+00 1.3784025867574137e+00 3.2369230385132948e+00 0 0 0
9 1 3 -1.0500000000000000e+00 2.1511854698456094e+00 3.7101624965654629e+00 3.0393623494866819e+00 0 0 0
10 1 5 4.2499999999999999e-01 4.1304115882830850e-01 7.0858429800630063e-01 1.2341413567628692e+00 0 0 0
11 1 1 1.5750000000000000e+00 5.2075289141421628e+00 5.9712273126645208e+00 -1.1003217385940900e-03 0 0 0
12 1 2 2.1000000000000001e+00 7.7992413524051329e-01 4.3808730648448524e+00 2.7520886637176147e+00 0 0 0
13 1 2 2.1000000000000001e+00 8.6212166757941588e-01 7.3355201716095273e+00 2.7596040381917586e+00 0 0 0
14 1 3 -1.0500000000000000e+00 6.3565084014680373e-01 4.4515684498491375e+00 1.1367428409373659e+00 0 0 0
15 1 3 -1.0500000000000000e+00 1.0009642240685892e+00 7.2397556658052480e+00 1.1381282197844147e+00 0 0 0
16 1 4 -9.4999999999999996e-01 3.5258684152099597e+00 6.0570110595805637e+00 1.0189984106767973e+00 0 0 0
17 1 3 -1.0500000000000000e+00 2.1684022966187442e+00 8.0357879734705300e+00 3.2377030337549169e+00 0 0 0
18 1 3 -1.0500000000000000e+00 7.4486198526787106e-01 5.8613648961516880e+00 3.2369050077262393e+00 0 0 0
19 1 3 -1.0500000000000000e+00 -4.0060852713138040e-01 8.1930902338805822e+00 3.0393178026634580e+00 0 0 0
20 1 5 4.2499999999999999e-01 3.0212600858515035e+00 5.1916295129444698e+00 1.2344575067874164e+00 0 0 0
21 1 1 1.5750000000000000e+00 2.6165689354331576e+00 7.4772141627982442e+00 -5.6194863630345537e-03 0 0 0
22 1 2 2.1000000000000001e+00 1.8278876550536935e+00 1.0182971026238974e-01 -2.7586970692677335e+00 0 0 0
23 1 2 2.1000000000000001e+00 1.8021215275304208e+00 6.1129688954300327e+00 -2.7662422357374892e+00 0 0 0
24 1 3 -1.0500000000000000e+00 2.0283728515776911e+00 8.9970577309046504e+00 -1.1432473706049304e+00 0 0 0
25 1 3 -1.0500000000000000e+00 1.6634566967028626e+00 6.2086697842131962e+00 -1.1446560607305951e+00 0 0 0
26 1 4 -9.4999999999999996e-01 4.2986260781470733e+00 7.3920166940321401e+00 -1.0249968856997604e+00 0 0 0
27 1 3 -1.0500000000000000e+00 5.6559330286221403e+00 5.4126307782462391e+00 -3.2442608651498190e+00 0 0 0
28 1 3 -1.0500000000000000e+00 1.9192504670401291e+00 7.5872042145847054e+00 -3.2434320963187044e+00 0 0 0
29 1 3 -1.0500000000000000e+00 3.0650235195062034e+00 5.2556901644357339e+00 -3.0461115502159730e+00 0 0 0
30 1 5 4.2499999999999999e-01 4.8035751889592486e+00 8.2580856040690769e+00 -1.2372390756746245e+00 0 0 0
31 1 1 1.5750000000000000e+00 8.4044409014900623e-03 2.9942788765782851e+00 -5.6005955861042622e-03 0 0 0
32 1 2 2.1000000000000001e+00 4.4360730600385114e+00 4.5847605410689702e+00 -2.7587150701119336e+00 0 0 0
33 1 2 2.1000000000000001e+00 4.3539364181102407e+00 1.6300766548957064e+00 -2.7662298465172128e+00 0 0 0
34 1 3 -1.0500000000000000e+00 4.5802276362029435e+00 4.5141855930315025e+00 -1.1432542885526686e+00 0 0 0
35 1 3 -1.0500000000000000e+00 4.2152561507898412e+00 1.7257911288873942e+00 -1.1446452820482715e+00 0 0 0
36 1 4 -9.4999999999999996e-01 1.6904176280658092e+00 2.9090779966367997e+00 -1.0250300704067090e+00 0 0 0
37 1 3 -1.0500000000000000e+00 3.0477514338401175e+00 9.2973642699415393e-01 -3.2442410144828848e+00 0 0 0
38 1 3 -1.0500000000000000e+00 4.4710788948266256e+00 3.1042503377148130e+00 -3.2434184044029397e+00 0 0 0
39 1 3 -1.0500000000000000e+00 5.6168180411235280e+00 7.7276465358232826e-01 -3.0460654755419396e+00 0 0 0
40 1 5 4.2499999999999999e-01 2.1953543805053659e+00 3.7750625122921733e+00 -1.2375137658443451e+00 0 0 0
41 1 1 1.5750000000000000e+00 7.7593667974341116e+00 1.4882875844411778e+00 -1.0800878431691530e-03 0 0 0
42 1 2 2.1000000000000001e+00 -1.2091892554232100e+01 8.8638068273280304e+00 2.7520729565452449e+00 1 0 0
43 1 2 2.1000000000000001e+00 -1.2066062031288764e+01 2.8526258794028436e+00 2.7596183764589810e+00 1 0 0
44 1 3 -1.0500000000000000e+00 8.3475033984264826e+00 -3.1302525644800738e-02 1.1367403599149970e+00 0 0 0
45 1 3 -1.0500000000000000e+00 -1.1927240183972263e+01 2.7568656415244952e+00 1.1381418614692507e+00 1 0 0
46 1 4 -9.4999999999999996e-01 6.0776532475762153e+00 1.5740572667257275e+00 1.0189511331187227e+00 0 0 0
47 1 3 -1.0500000000000000e+00 4.7202183448957626e+00 3.5528937230222120e+00 3.2377240632977262e+00 0 0 0
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49 1 3 -1.0500000000000000e+00 7.3111869688358517e+00 3.7101650079422015e+00 3.0393575352778353e+00 0 0 0
50 1 5 4.2499999999999999e-01 5.5730238334148332e+00 7.0856858877032991e-01 1.2340767994475854e+00 0 0 0
51 1 1 1.5750000000000000e+00 -1.0272466189276649e+01 5.9712246082248015e+00 -1.0975943967341806e-03 1 0 0
52 1 2 2.1000000000000001e+00 5.9399221186099425e+00 4.3808736732785256e+00 2.7520868822860844e+00 0 0 0
53 1 2 2.1000000000000001e+00 6.0221179373263780e+00 7.3355193588128209e+00 2.7596040009105103e+00 0 0 0
54 1 3 -1.0500000000000000e+00 5.7956494009087649e+00 4.4515669264515516e+00 1.1367431058474011e+00 0 0 0
55 1 3 -1.0500000000000000e+00 6.1609603541139819e+00 7.2397536142585857e+00 1.1381283858110915e+00 0 0 0
56 1 4 -9.4999999999999996e-01 -1.1954127386017726e+01 6.0570238530538951e+00 1.0190134395868142e+00 1 0 0
57 1 3 -1.0500000000000000e+00 7.3284057147376060e+00 8.0357882119204724e+00 3.2377031674562478e+00 0 0 0
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59 1 3 -1.0500000000000000e+00 4.7593918660988059e+00 8.1930867571954415e+00 3.0393208108983529e+00 0 0 0
60 1 5 4.2499999999999999e-01 8.1812915063843654e+00 5.1916541819268076e+00 1.2345712712632348e+00 0 0 0
61 1 1 1.5750000000000000e+00 7.7765744150069196e+00 7.4772110898687600e+00 -5.6168077529363813e-03 0 0 0
62 1 2 2.1000000000000001e+00 6.9878919349463970e+00 1.0183096031471806e-01 -2.7586957459689803e+00 0 0 0
63 1 2 2.1000000000000001e+00 6.9621241616101770e+00 6.1129671620970711e+00 -2.7662418189596103e+00 0 0 0
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65 1 3 -1.0500000000000000e+00 6.8234605148207379e+00 6.2086712878975341e+00 -1.1446560033087021e+00 0 0 0
66 1 4 -9.4999999999999996e-01 -1.1181369923537819e+01 7.3920293161420574e+00 -1.0249827015771427e+00 1 0 0
67 1 3 -1.0500000000000000e+00 -9.8240645767162160e+00 5.4126303979453212e+00 -3.2442605127814081e+00 1 0 0
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70 1 5 4.2499999999999999e-01 -1.0676395334126314e+01 8.2581079751635009e+00 -1.2371320778147110e+00 1 0 0
71 1 1 1.5750000000000000e+00 5.1683976201164832e+00 2.9942809980328420e+00 -5.6020985389082512e-03 0 0 0
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73 1 2 2.1000000000000001e+00 -1.1126060457304307e+01 1.6300761266194748e+00 -2.7662283658262670e+00 1 0 0
74 1 3 -1.0500000000000000e+00 -1.0899777242788575e+01 4.5141879531325131e+00 -1.1432521082081628e+00 1 0 0
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77 1 3 -1.0500000000000000e+00 8.2077473575870670e+00 9.2973693217553688e-01 -3.2442419395420981e+00 0 0 0
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79 1 3 -1.0500000000000000e+00 -9.8631808888372188e+00 7.7276710294123774e-01 -3.0460701921807960e+00 1 0 0
80 1 5 4.2499999999999999e-01 7.3553731471165094e+00 3.7750787575772335e+00 -1.2374424942294322e+00 0 0 0
81 1 1 1.5750000000000000e+00 -7.7206401882061746e+00 1.4882898218945044e+00 -1.0812584217809729e-03 1 0 0
82 1 2 2.1000000000000001e+00 -6.9318913071396580e+00 8.8638081162334181e+00 2.7520702511657547e+00 1 0 0
83 1 2 2.1000000000000001e+00 -6.9060648624012906e+00 2.8526262402975249e+00 2.7596169460676006e+00 1 0 0
84 1 3 -1.0500000000000000e+00 -7.1324913614342149e+00 -3.1305213230350404e-02 1.1367384001582508e+00 1 0 0
85 1 3 -1.0500000000000000e+00 -6.7672404919867226e+00 2.7568702222101642e+00 1.1381405338448083e+00 1 0 0
86 1 4 -9.4999999999999996e-01 -9.4023397012950252e+00 1.5740630961057498e+00 1.0189579178024069e+00 1 0 0
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100 1 5 4.2499999999999999e-01 -7.2987396846922490e+00 5.1916297578326613e+00 1.2344582686008589e+00 1 0 0
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122 1 2 2.1000000000000001e+00 -1.7718921832935095e+00 8.8638064760312680e+00 2.7520727645518317e+00 1 0 0
123 1 2 2.1000000000000001e+00 -1.7460630957075320e+00 2.8526261301782654e+00 2.7596182888033560e+00 1 0 0
124 1 3 -1.0500000000000000e+00 -1.9724962744006582e+00 -3.1302525320935359e-02 1.1367406594669021e+00 1 0 0
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140 1 5 4.2499999999999999e-01 -2.1387086319686546e+00 5.1916539522099150e+00 1.2345711189225028e+00 1 0 0
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1278 0.0000000000000000e+00 0.0000000000000000e+00 0.0000000000000000e+00
1279 0.0000000000000000e+00 0.0000000000000000e+00 0.0000000000000000e+00
1280 0.0000000000000000e+00 0.0000000000000000e+00 0.0000000000000000e+00

Bonds

1 1 6 10
2 1 16 20
3 1 26 30
4 1 36 40
5 1 46 50
6 1 56 60
7 1 66 70
8 1 76 80
9 1 86 90
10 1 96 100
11 1 106 110
12 1 116 120
13 1 126 130
14 1 136 140
15 1 146 150
16 1 156 160
17 1 166 170
18 1 176 180
19 1 186 190
20 1 196 200
21 1 206 210
22 1 216 220
23 1 226 230
24 1 236 240
25 1 246 250
26 1 256 260
27 1 266 270
28 1 276 280
29 1 286 290
30 1 296 300
31 1 306 310
32 1 316 320
33 1 326 330
34 1 336 340
35 1 346 350
36 1 356 360
37 1 366 370
38 1 376 380
39 1 386 390
40 1 396 400
41 1 406 410
42 1 416 420
43 1 426 430
44 1 436 440
45 1 446 450
46 1 456 460
47 1 466 470
48 1 476 480
49 1 486 490
50 1 496 500
51 1 506 510
52 1 516 520
53 1 526 530
54 1 536 540
55 1 546 550
56 1 556 560
57 1 566 570
58 1 576 580
59 1 586 590
60 1 596 600
61 1 606 610
62 1 616 620
63 1 626 630
64 1 636 640
65 1 646 650
66 1 656 660
67 1 666 670
68 1 676 680
69 1 686 690
70 1 696 700
71 1 706 710
72 1 716 720
73 1 726 730
74 1 736 740
75 1 746 750
76 1 756 760
77 1 766 770
78 1 776 780
79 1 786 790
80 1 796 800
81 1 806 810
82 1 816 820
83 1 826 830
84 1 836 840
85 1 846 850
86 1 856 860
87 1 866 870
88 1 876 880
89 1 886 890
90 1 896 900
91 1 906 910
92 1 916 920
93 1 926 930
94 1 936 940
95 1 946 950
96 1 956 960
97 1 966 970
98 1 976 980
99 1 986 990
100 1 996 1000
101 1 1006 1010
102 1 1016 1020
103 1 1026 1030
104 1 1036 1040
105 1 1046 1050
106 1 1056 1060
107 1 1066 1070
108 1 1076 1080
109 1 1086 1090
110 1 1096 1100
111 1 1106 1110
112 1 1116 1120
113 1 1126 1130
114 1 1136 1140
115 1 1146 1150
116 1 1156 1160
117 1 1166 1170
118 1 1176 1180
119 1 1186 1190
120 1 1196 1200
121 1 1206 1210
122 1 1216 1220
123 1 1226 1230
124 1 1236 1240
125 1 1246 1250
126 1 1256 1260
127 1 1266 1270
128 1 1276 1280