Origami 3.5 11/25/2003 2:30:41 PM  
diatomic: AX file=f-o2cat |diatomic: AX|O|O|112 ! M69:50/H/UV =Herzberg.1950.UV  
|label for A = O|label for X = O|distance O-O = 112.0  
  2  1  
16.3161   2.0767    -17.1329   O  
17.0856   2.1747    -17.9408   O  
  1  2  1