---------------- ATOM           1
  SHELL:           1   4.44462813467085     
           8   8.00000000000000     
  SHELL:           2   7.25804735090785     
          12   93.0000000000000     
  SHELL:           3   8.51081492006072     
          24   8.00000000000000     
  SHELL:           4   10.2644290000000     
           6   93.0000000000000     
  SHELL:           5   11.1854021810371     
          24   8.00000000000000     
  SHELL:           6   12.5713067755131     
          24   93.0000000000000     
  SHELL:           7   13.3338844040126     
          32   8.00000000000000     
  SHELL:           8   14.5160947018157     
          12   93.0000000000000     
  SHELL:           9   15.1812952229904     
          48   8.00000000000000     
 ---------------- ATOM           2
  SHELL:           1   4.44462813467085     
           4   93.0000000000000     
  SHELL:           2   5.13221450000000     
           6   8.00000000000000     
  SHELL:           3   7.25804735090785     
          12   8.00000000000000     
  SHELL:           4   8.51081492006072     
          12   93.0000000000000     
  SHELL:           5   8.88925626934170     
           8   8.00000000000000     
  SHELL:           6   10.2644290000000     
           6   8.00000000000000     
  SHELL:           7   11.1854021810371     
          12   93.0000000000000     
  SHELL:           8   11.4759804971101     
          24   8.00000000000000     
  SHELL:           9   12.5713067755131     
          24   8.00000000000000     
  SHELL:          10   13.3338844040126     
          16   93.0000000000000     
  SHELL:          11   14.5160947018157     
          12   8.00000000000000     
  SHELL:          12   15.1812952229904     
          24   93.0000000000000     
  SHELL:          13   15.3966435000000     
          30   8.00000000000000     
 ---------------- ATOM           3
  SHELL:           1   4.44462813467085     
           4   93.0000000000000     
  SHELL:           2   5.13221450000000     
           6   8.00000000000000     
  SHELL:           3   7.25804735090785     
          12   8.00000000000000     
  SHELL:           4   8.51081492006072     
          12   93.0000000000000     
  SHELL:           5   8.88925626934170     
           8   8.00000000000000     
  SHELL:           6   10.2644290000000     
           6   8.00000000000000     
  SHELL:           7   11.1854021810371     
          12   93.0000000000000     
  SHELL:           8   11.4759804971101     
          24   8.00000000000000     
  SHELL:           9   12.5713067755131     
          24   8.00000000000000     
  SHELL:          10   13.3338844040126     
          16   93.0000000000000     
  SHELL:          11   14.5160947018157     
          12   8.00000000000000     
  SHELL:          12   15.1812952229904     
          24   93.0000000000000     
  SHELL:          13   15.3966435000000     
          30   8.00000000000000