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LAMMPS data file. CGCMM style. atom_style charge generated by VMD/TopoTools v1.8 on Tue May 26 19:18:49 EDT 2020
64 atoms
0 bonds
0 angles
0 dihedrals
0 impropers
8 atom types
0 bond types
0 angle types
0 dihedral types
0 improper types
-0.668313 10.193687 xlo xhi
-0.635735 10.226265 ylo yhi
-0.627193 10.234807 zlo zhi
# Pair Coeffs
#
# 1 1
# 2 2
# 3 3
# 4 4
# 5 5
# 6 6
# 7 7
# 8 8
Masses
1 28.059999 # 1
2 28.059999 # 2
3 28.059999 # 3
4 28.059999 # 4
5 28.059999 # 5
6 28.059999 # 6
7 28.059999 # 7
8 28.059999 # 8
Atoms # charge
1 1 0.000000 -0.040417 -0.093910 0.052782 # 1
2 2 0.000000 0.126446 2.697387 2.683841 # 2
3 3 0.000000 2.688601 -0.082054 2.829938 # 3
4 4 0.000000 2.832901 2.669074 0.123599 # 4
5 5 0.000000 1.521392 1.292160 1.378964 # 5
6 6 0.000000 1.486042 3.885366 3.915384 # 6
7 7 0.000000 4.141987 1.423188 3.896535 # 7
8 8 0.000000 4.091600 4.085705 1.481833 # 8
9 1 0.000000 5.433249 0.188740 0.146279 # 1
10 2 0.000000 5.436841 2.892483 2.866786 # 2
11 3 0.000000 8.111949 0.107730 2.533645 # 3
12 4 0.000000 8.295543 2.874888 0.038351 # 4
13 5 0.000000 6.732080 1.302710 1.492898 # 5
14 6 0.000000 6.874232 3.965341 4.050681 # 6
15 7 0.000000 9.677904 1.170253 4.007198 # 7
16 8 0.000000 9.454059 4.112198 1.161919 # 8
17 1 0.000000 -0.058295 5.274688 0.061123 # 1
18 2 0.000000 0.147267 8.060120 2.524605 # 2
19 3 0.000000 2.755800 5.561014 2.664618 # 3
20 4 0.000000 2.914474 8.301859 -0.078085 # 4
21 5 0.000000 1.291007 6.641428 1.324350 # 5
22 6 0.000000 1.439327 9.375738 4.173414 # 6
23 7 0.000000 3.874824 6.634559 4.183034 # 7
24 8 0.000000 4.007782 9.576189 1.237397 # 8
25 1 0.000000 5.366907 5.422904 -0.067176 # 1
26 2 0.000000 5.419696 8.156823 2.621794 # 2
27 3 0.000000 8.102629 5.281058 2.634915 # 3
28 4 0.000000 8.126235 7.946796 -0.018325 # 4
29 5 0.000000 6.936181 6.658047 1.432521 # 5
30 6 0.000000 6.923384 9.499134 4.097114 # 6
31 7 0.000000 9.689281 6.609769 3.938340 # 7
32 8 0.000000 9.656274 9.363524 1.381721 # 8
33 1 0.000000 -0.161908 0.018703 5.376475 # 1
34 2 0.000000 -0.163907 2.727545 8.188785 # 2
35 3 0.000000 2.559590 0.028222 8.067060 # 3
36 4 0.000000 2.821442 2.881884 5.442389 # 4
37 5 0.000000 1.372246 1.395237 6.840961 # 5
38 6 0.000000 1.487625 4.082171 9.441023 # 6
39 7 0.000000 3.911081 1.378181 9.685699 # 7
40 8 0.000000 3.944025 4.187971 6.909317 # 8
41 1 0.000000 5.514166 0.176456 5.530650 # 1
42 2 0.000000 5.598578 2.799773 8.114211 # 2
43 3 0.000000 8.068899 0.164819 8.267001 # 3
44 4 0.000000 8.087106 2.882999 5.385541 # 4
45 5 0.000000 6.986481 1.424445 6.933502 # 5
46 6 0.000000 6.718927 4.161727 9.343200 # 6
47 7 0.000000 9.339694 1.259251 9.630836 # 7
48 8 0.000000 9.384451 4.205196 6.807114 # 8
49 1 0.000000 0.172480 5.509466 5.410285 # 1
50 2 0.000000 0.037451 7.980981 8.275100 # 2
51 3 0.000000 2.765533 5.538327 7.993124 # 3
52 4 0.000000 2.515547 8.332568 5.475981 # 4
53 5 0.000000 1.180795 6.710186 6.763820 # 5
54 6 0.000000 1.195947 9.684441 9.564933 # 6
55 7 0.000000 4.109033 6.987749 9.683228 # 7
56 8 0.000000 4.045842 9.656738 6.865099 # 8
57 1 0.000000 5.479769 5.484791 5.503548 # 1
58 2 0.000000 5.279521 8.228603 8.058142 # 2
59 3 0.000000 8.049848 5.393717 8.339936 # 3
60 4 0.000000 8.330429 8.240981 5.380610 # 4
61 5 0.000000 6.933069 6.759815 6.881204 # 5
62 6 0.000000 6.945864 9.325049 9.682657 # 6
63 7 0.000000 9.328381 6.957557 9.441897 # 7
64 8 0.000000 9.428230 9.443384 6.616901 # 8
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