HMDB0001355 RDKit 3D Parathion 32 32 0 0 0 0 0 0 0 0999 V2000 -1.7768 3.3478 -0.0593 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8787 2.1067 -0.9234 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4319 1.0364 -0.1647 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4813 -0.4213 -0.9818 P 0 0 0 0 0 5 0 0 0 0 0 0 -2.6422 -0.3241 -2.2824 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.0381 -1.6857 0.0293 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6492 -1.0806 1.1290 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1673 -2.1396 2.0690 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0030 -0.8738 -1.6632 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2261 -0.7242 -1.0884 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4273 -0.1741 0.1469 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6947 -0.0525 0.6688 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7972 -0.4917 -0.0604 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0867 -0.3545 0.4999 N 0 0 0 0 0 4 0 0 0 0 0 0 5.2569 0.1422 1.6128 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1677 -0.7862 -0.2175 O 0 0 0 0 0 1 0 0 0 0 0 0 3.6039 -1.0477 -1.3069 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3339 -1.1588 -1.8064 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4322 4.1277 -0.5208 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7600 3.7566 -0.0369 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1524 3.1859 0.9656 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9310 2.0176 -1.2316 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1906 2.2477 -1.7753 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8425 -0.4677 1.6191 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4722 -0.4082 0.7771 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9118 -3.1738 1.6980 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2646 -2.1064 2.1744 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6460 -2.0516 3.0508 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5606 0.1594 0.6946 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8384 0.3890 1.6565 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4528 -1.3934 -1.8846 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2254 -1.6009 -2.7885 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 1 0 4 5 2 0 4 6 1 0 6 7 1 0 7 8 1 0 4 9 1 0 9 10 1 0 10 11 2 0 11 12 1 0 12 13 2 0 13 14 1 0 14 15 2 0 14 16 1 0 13 17 1 0 17 18 2 0 18 10 1 0 1 19 1 0 1 20 1 0 1 21 1 0 2 22 1 0 2 23 1 0 7 24 1 0 7 25 1 0 8 26 1 0 8 27 1 0 8 28 1 0 11 29 1 0 12 30 1 0 17 31 1 0 18 32 1 0 M CHG 2 14 1 16 -1 M END