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lammps/examples/comb/data.m-HfO2
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1500 atoms
0 bonds
0 angles
0 dihedrals
0 impropers
2 atom types
0 bond types
0 angle types
0 dihedral types
0 improper types
0.0000000E+00 25.6420000000000 xlo xhi
0.0000000E+00 25.9570000000000 ylo yhi
0.0000000E+00 26.4845000000000 zlo zhi
0.0000000 -4.4669100 0.0000000 xy xz yz
Atoms
1 1 3.60000000 1.23385 0.22323 1.10705
2 1 3.60000000 -1.68054 2.81893 1.54140
3 1 3.60000000 -1.23385 -0.22323 -1.10705
4 1 3.60000000 0.78716 2.37247 3.75550
5 2 -1.80000000 0.07843 1.77546 1.78506
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7 2 -1.80000000 -0.07843 -1.77546 -1.78506
8 2 -1.80000000 -0.36826 0.82024 4.43351
9 2 -1.80000000 1.86781 3.94027 2.54781
10 2 -1.80000000 -2.31450 1.34457 0.10064
11 2 -1.80000000 -1.86781 -3.94027 -2.54781
12 2 -1.80000000 1.42112 -1.34457 5.19626
13 1 3.60000000 0.34047 0.22323 6.40395
14 1 3.60000000 -2.57392 2.81893 6.83830
15 1 3.60000000 -2.12723 -0.22323 4.18985
16 1 3.60000000 -0.10622 2.37247 9.05240
17 2 -1.80000000 -0.81495 1.77546 7.08196
18 2 -1.80000000 -1.41850 4.37116 6.16029
19 2 -1.80000000 -0.97181 -1.77546 3.51184
20 2 -1.80000000 -1.26164 0.82024 9.73041
21 2 -1.80000000 0.97442 3.94027 7.84471
22 2 -1.80000000 -3.20788 1.34457 5.39754
23 2 -1.80000000 -2.76119 -3.94027 2.74909
24 2 -1.80000000 0.52773 -1.34457 10.49316
25 1 3.60000000 -0.55291 0.22323 11.70085
26 1 3.60000000 -3.46730 2.81893 12.13520
27 1 3.60000000 -3.02061 -0.22323 9.48675
28 1 3.60000000 -0.99961 2.37247 14.34930
29 2 -1.80000000 -1.70833 1.77546 12.37886
30 2 -1.80000000 -2.31189 4.37116 11.45719
31 2 -1.80000000 -1.86520 -1.77546 8.80874
32 2 -1.80000000 -2.15502 0.82024 15.02731
33 2 -1.80000000 0.08104 3.94027 13.14161
34 2 -1.80000000 -4.10126 1.34457 10.69444
35 2 -1.80000000 -3.65457 -3.94027 8.04599
36 2 -1.80000000 -0.36565 -1.34457 15.79006
37 1 3.60000000 -1.44630 0.22323 16.99775
38 1 3.60000000 -4.36069 2.81893 17.43210
39 1 3.60000000 -3.91400 -0.22323 14.78365
40 1 3.60000000 -1.89299 2.37247 19.64620
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43 2 -1.80000000 -2.75858 -1.77546 14.10564
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48 2 -1.80000000 -1.25903 -1.34457 21.08696
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59 2 -1.80000000 -5.44133 -3.94027 18.63979
60 2 -1.80000000 -2.15241 -1.34457 26.38386
61 1 3.60000000 1.23385 5.41463 1.10705
62 1 3.60000000 -1.68054 8.01033 1.54140
63 1 3.60000000 -1.23385 4.96817 -1.10705
64 1 3.60000000 0.78716 7.56387 3.75550
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67 2 -1.80000000 -0.07843 3.41594 -1.78506
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72 2 -1.80000000 1.42112 3.84683 5.19626
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83 2 -1.80000000 -2.76119 1.25113 2.74909
84 2 -1.80000000 0.52773 3.84683 10.49316
85 1 3.60000000 -0.55291 5.41463 11.70085
86 1 3.60000000 -3.46730 8.01033 12.13520
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88 1 3.60000000 -0.99961 7.56387 14.34930
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132 2 -1.80000000 1.42112 9.03823 5.19626
133 1 3.60000000 0.34047 10.60603 6.40395
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135 1 3.60000000 -2.12723 10.15957 4.18985
136 1 3.60000000 -0.10622 12.75527 9.05240
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1499 2 -1.80000000 15.07227 16.82533 18.63979
1500 2 -1.80000000 18.36119 19.42103 26.38386
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