2
% molecule specification
7
O [ 0.00000000 0.00000000 0.36937294 ]
8
H [ 0.78397590 0.00000000 -0.18468647 ]
9
H [ -0.78397590 0.00000000 -0.18468647 ]
12
% basis set specification
13
basis<GaussianBasisSet>: (
22
% method for computing the molecule's energy
27
functional<StdDenFunctional>: ( name = "SVWN1" )