test_basis: 6-31G* test_method: mp2 test_symmetry: c2v test_calc: energy opt test_fzc: 0 1 test_fzv: 0 1 restart: no checkpoint: no label: water mp2 test series molecule: O 0.000000000 0 0.369372944 H 0.783975899 0 -0.184686472 H -0.783975899 0 -0.184686472