---------------- ATOM           1
  SHELL:           1   4.69124700000000     
           6   6.00000000000000     
  SHELL:           2   6.63442513184209     
          12   94.0000000000000     
  SHELL:           3   8.12547815485507     
           8   6.00000000000000     
  SHELL:           4   9.38249400000000     
           6   94.0000000000000     
  SHELL:           5   10.4899471912420     
          24   6.00000000000000     
  SHELL:           6   11.4911614073624     
          24   94.0000000000000     
  SHELL:           7   13.2688502636842     
          12   94.0000000000000     
  SHELL:           8   14.0737410000000     
          30   6.00000000000000     
  SHELL:           9   14.8350255864319     
          24   94.0000000000000     
  SHELL:          10   15.5591060978804     
          24   6.00000000000000     
 ---------------- ATOM           2
  SHELL:           1   4.69124700000000     
           6   94.0000000000000     
  SHELL:           2   6.63442513184209     
          12   6.00000000000000     
  SHELL:           3   8.12547815485507     
           8   94.0000000000000     
  SHELL:           4   9.38249400000000     
           6   6.00000000000000     
  SHELL:           5   10.4899471912420     
          24   94.0000000000000     
  SHELL:           6   11.4911614073624     
          24   6.00000000000000     
  SHELL:           7   13.2688502636842     
          12   6.00000000000000     
  SHELL:           8   14.0737410000000     
          30   94.0000000000000     
  SHELL:           9   14.8350255864319     
          24   6.00000000000000     
  SHELL:          10   15.5591060978804     
          24   94.0000000000000