# type topo
# cell     5.564800     2.046100     1.525200    90.000000    90.000000    90.000000
12
  1 s      1.714515    0.000000    0.381300   0                             2/13      2/12      5/13     12/10 
  2 s      1.067885    0.000000    1.143900   0                             1/13      1/14      6/11     11/13 
  3 s      3.850285    1.023050    0.381300   0                             4/13      4/12      7/13     10/13 
  4 s      4.496915    1.023050    1.143900   0                             3/13      3/14      8/13      9/14 
  5 s      2.318852    0.699562    0.762600   1                             1/13     10/13     12/13     12/14 
  6 s      0.463548    1.346538    0.000000   1                             2/15       9/4     11/13     11/12 
  7 s      3.245948    1.722612    0.000000   1                             3/13     10/16     10/15     12/13 
  8 s      5.101252    0.323488    0.762600   1                             4/13      9/11      9/10     11/22 
  9 s      5.101252    1.722612    0.000000   1                             4/12      6/22      8/15      8/16 
 10 s      3.245948    0.323488    0.762600   1                             3/13      5/13      7/10      7/11 
 11 s      0.463548    0.699562    0.762600   1                             2/13      6/13      6/14       8/4 
 12 s      2.318852    1.346538    0.000000   1                             1/16      5/13      5/12      7/13