HMDB0041893 RDKit 3D Fenitrothion 29 29 0 0 0 0 0 0 0 0999 V2000 3.6753 -1.7374 -0.8132 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8658 -0.4886 -0.2270 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4434 0.4141 -0.1904 P 0 0 0 0 0 5 0 0 0 0 0 0 2.7312 1.8664 -1.1132 S 0 0 0 0 0 0 0 0 0 0 0 0 2.0914 0.8255 1.3994 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7911 1.9930 1.6933 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2100 -0.4444 -0.9635 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1400 -0.1988 -0.8393 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8226 0.6623 -1.6619 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1962 0.8828 -1.4994 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8714 0.2123 -0.4839 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2670 0.4546 -0.3405 N 0 0 0 0 0 4 0 0 0 0 0 0 -4.7957 0.4050 0.7842 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.0529 0.7440 -1.4140 O 0 0 0 0 0 1 0 0 0 0 0 0 -2.1943 -0.6552 0.3479 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9180 -1.3779 1.4410 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8376 -0.8432 0.1518 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1090 -2.4836 -0.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5776 -1.9318 -0.9640 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1988 -1.7652 -1.7857 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9640 2.1518 2.7592 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7780 2.0305 1.1654 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1951 2.8407 1.2824 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2765 1.1618 -2.4329 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7094 1.5670 -2.1609 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2030 -2.0534 1.9431 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2927 -0.6779 2.2095 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7044 -2.0112 0.9923 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3489 -1.5432 0.8414 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 2 0 3 5 1 0 5 6 1 0 3 7 1 0 7 8 1 0 8 9 2 0 9 10 1 0 10 11 2 0 11 12 1 0 12 13 2 0 12 14 1 0 11 15 1 0 15 16 1 0 15 17 2 0 17 8 1 0 1 18 1 0 1 19 1 0 1 20 1 0 6 21 1 0 6 22 1 0 6 23 1 0 9 24 1 0 10 25 1 0 16 26 1 0 16 27 1 0 16 28 1 0 17 29 1 0 M CHG 2 12 1 14 -1 M END