@MOLECULE nitrosomethane 6 5 0 0 0 SMALL GASTEIGER @ATOM 1 O -1.0750 0.2374 0.0000 O.2 1 UNL1111111111 -0.1435 2 N -0.1302 -0.4767 0.0000 N.2 1 UNL1111111111 0.0715 3 C 1.1912 0.1650 0.0001 C.3 1 UNL1111111111 -0.4481 4 H 1.7438 -0.1816 -0.8911 H 1 UNL1111111111 0.1805 5 H 1.7489 -0.1914 0.8841 H 1 UNL1111111111 0.1804 6 H 1.1850 1.2635 0.0058 H 1 UNL1111111111 0.1592 @BOND 1 1 2 2 2 2 3 1 3 3 4 1 4 3 5 1 5 3 6 1