Results for H2O, basis VDZ R1 R2 THETA SCF CCSD CCSD(T) 1.6 1.6 100.0 -75.99757338 -76.20140563 -76.20403920 1.7 1.6 100.0 -76.00908379 -76.21474489 -76.21747582 1.7 1.7 100.0 -76.02060127 -76.22812261 -76.23095473 ... 2.0 1.9 110.0 -76.01128923 -76.22745359 -76.23081968 2.0 2.0 110.0 -76.00369171 -76.22185092 -76.22537212