AsO+.mol
  -ISIS-            3D

  2  1  0  0  0  0  0  0  0  0  0
   -0.2908    0.0000    0.0000 AS  0  0  0  0  0
    1.3123    0.0000    0.0000 O   0  0  0  0  0
  1  2  3  0  0  0
<CHARGE>
 1