HMDB0031768 RDKit 3D Iprobenfos 39 39 0 0 0 0 0 0 0 0999 V2000 -1.0006 3.1509 0.3358 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8490 1.9959 -0.2311 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0032 2.6377 -0.9461 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2285 1.1455 0.7916 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1715 -0.1812 0.9272 P 0 0 0 0 0 5 0 0 0 0 0 0 -1.6407 -0.8924 2.2139 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1474 -1.1939 -0.3615 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2845 -1.9845 -0.5043 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4955 -3.0034 0.5619 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5666 -1.1903 -0.6629 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7142 0.5955 1.3763 S 0 0 0 0 0 0 0 0 0 0 0 0 2.0070 -0.6354 1.4561 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1081 -0.4801 0.5043 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1251 0.4311 0.8508 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2261 0.6354 0.0773 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3868 -0.0614 -1.1016 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3919 -0.9693 -1.4684 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2585 -1.1669 -0.6524 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4191 4.1343 0.0546 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8756 3.0542 1.4287 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0018 3.0801 -0.1618 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2328 1.4130 -0.9448 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6069 3.5371 -1.4769 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4584 1.9930 -1.7030 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7479 3.0079 -0.1991 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1693 -2.5276 -1.4727 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7626 -3.0150 1.3770 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5263 -2.9143 1.0186 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4904 -4.0659 0.1695 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4360 -0.3398 -1.3326 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0296 -0.9709 0.3005 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3048 -1.8632 -1.2018 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4329 -0.6577 2.5127 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5521 -1.6819 1.3453 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0120 0.9812 1.7799 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9734 1.3479 0.4139 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2501 0.0758 -1.7202 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4870 -1.5351 -2.3763 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5197 -1.8862 -0.9783 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 2 4 1 0 4 5 1 0 5 6 2 0 5 7 1 0 7 8 1 0 8 9 1 0 8 10 1 0 5 11 1 0 11 12 1 0 12 13 1 0 13 14 2 0 14 15 1 0 15 16 2 0 16 17 1 0 17 18 2 0 18 13 1 0 1 19 1 0 1 20 1 0 1 21 1 0 2 22 1 0 3 23 1 0 3 24 1 0 3 25 1 0 8 26 1 0 9 27 1 0 9 28 1 0 9 29 1 0 10 30 1 0 10 31 1 0 10 32 1 0 12 33 1 0 12 34 1 0 14 35 1 0 15 36 1 0 16 37 1 0 17 38 1 0 18 39 1 0 M END