# type topo
# cell     4.077000     4.077000     1.799000    90.000000    90.000000   120.000000
12
  1 s      1.819973    0.499959    0.000000   0                             8/10     11/13     11/12     12/13 
  2 s      2.734036    1.326163    0.599667   0                             7/22     10/12     10/13     11/13 
  3 s      1.561491    1.704663    1.199333   0                             9/13     10/13     12/13     12/14 
  4 s      0.218527    3.030826    0.899500   0                             8/13      8/14      9/13     11/16 
  5 s     -0.695536    2.204623    1.499167   0                             7/14      7/13      8/14      10/4 
  6 s      0.477009    1.826122    0.299833   0                             7/13      9/13      9/12     12/13 
  7 s     -0.477009    1.826122    0.599667   0                              2/4      5/12      5/13      6/13 
  8 s     -0.218527    3.030826    0.000000   0                             1/16      4/13      4/12      5/12 
  9 s      0.695536    2.204623    1.199333   0                             3/13      4/13      6/13      6/14 
 10 s      2.515509    1.704663    1.499167   0                             2/14      2/13      3/13      5/22 
 11 s      2.257027    0.499959    0.899500   0                             1/13      1/14      2/13      4/10 
 12 s      1.342964    1.326163    0.299833   0                             1/13      3/13      3/12      6/13