forked from lijiext/lammps
41 lines
1.3 KiB
Plaintext
41 lines
1.3 KiB
Plaintext
|
Created using cfg2lammps (c) AJB-2009
|
||
|
|
|
||
|
|
22 atoms
|
||
|
|
3 atom types
|
||
|
|
|
||
|
|
-529.177249 529.177249 xlo xhi
|
||
|
|
-529.177249 529.177249 ylo yhi
|
||
|
|
-529.177249 529.177249 zlo zhi
|
||
|
|
|
||
|
|
Masses
|
||
|
|
|
||
|
|
1 28.086589324618736
|
||
|
|
2 1.007940
|
||
|
|
3 0.0005446623093682
|
||
|
|
|
||
|
|
Atoms
|
||
|
|
|
||
|
|
1 1 4.00 3 0.895049 0.000000 0.000000 -0.622509
|
||
|
|
2 1 4.00 3 0.895049 0.000000 0.000000 0.622509
|
||
|
|
3 2 1.00 0 0.000000 -1.206679 0.696677 -1.695415
|
||
|
|
4 2 1.00 0 0.000000 1.206679 0.696677 -1.695415
|
||
|
|
5 2 1.00 0 0.000000 0.000000 -1.393353 -1.695415
|
||
|
|
6 2 1.00 0 0.000000 1.206679 -0.696677 1.695415
|
||
|
|
7 2 1.00 0 0.000000 0.000000 1.393353 1.695415
|
||
|
|
8 2 1.00 0 0.000000 -1.206679 -0.696677 1.695415
|
||
|
|
9 3 0.0 1 1.049888 -0.853122 0.492550 -1.543335
|
||
|
|
10 3 0.0 -1 1.049888 -0.853122 0.492550 -1.543335
|
||
|
|
11 3 0.0 1 1.049888 0.853122 0.492550 -1.543335
|
||
|
|
12 3 0.0 -1 1.049888 0.853122 0.492550 -1.543335
|
||
|
|
13 3 0.0 1 1.049888 0.000000 -0.985100 -1.543335
|
||
|
|
14 3 0.0 -1 1.049888 0.000000 -0.985100 -1.543335
|
||
|
|
15 3 0.0 1 0.957811 0.000000 0.000000 0.000000
|
||
|
|
16 3 0.0 -1 0.957811 0.000000 0.000000 0.000000
|
||
|
|
17 3 0.0 1 1.049888 0.853122 -0.492550 1.543335
|
||
|
|
18 3 0.0 -1 1.049888 0.853122 -0.492550 1.543335
|
||
|
|
19 3 0.0 1 1.049888 0.000000 0.985100 1.543335
|
||
|
|
20 3 0.0 -1 1.049888 0.000000 0.985100 1.543335
|
||
|
|
21 3 0.0 1 1.049888 -0.853122 -0.492550 1.543335
|
||
|
|
22 3 0.0 -1 1.049888 -0.853122 -0.492550 1.543335
|
||
|
|
|