#RHF/Gen Opt H2O 0 1 O 0.0 0.0 0.0 H 0.0 0.0 0.95 H 0.0 0.0 -0.95 H 0 S 3 1.00 3.42525091 0.154328970 0.623913730 0.535328140 0.168855400 0.444634540 **** O 0 S 3 1.00 130.709320 0.154328970 23.8088610 0.535328140 6.44360830 0.444634540 SP 3 1.00 5.03315130 -0.999672300E-01 0.155916270 1.16959610 0.399512830 0.607683720 0.380389000 0.700115470 0.391957390 ****