HMDB0255983 RDKit 3D Oxibendazole 33 34 0 0 0 0 0 0 0 0999 V2000 5.8444 0.8864 0.6624 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5522 0.1186 0.3721 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0704 0.5409 -0.9756 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9093 -0.0483 -1.4017 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6402 0.0214 -0.9259 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3128 0.8095 0.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0049 0.8218 0.5768 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0021 0.0833 -0.0217 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3192 -0.0949 0.1714 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.8380 -0.9587 -0.7323 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1987 -1.3866 -0.8338 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.1957 -0.9223 0.0523 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3720 -1.3129 -0.0613 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8246 -0.0221 1.0474 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.7902 0.4644 1.9511 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8007 -1.3225 -1.5069 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6628 -0.7108 -1.1085 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6287 -0.7457 -1.5562 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5329 1.8428 1.1307 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5112 0.2934 1.3469 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3390 1.0688 -0.3092 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8976 0.2849 1.2105 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7865 -0.9836 0.3499 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9000 0.3931 -1.7425 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9476 1.6749 -0.9633 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0715 1.4128 0.6156 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2444 1.4461 1.4227 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4608 -2.0557 -1.5779 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7797 0.0227 1.7144 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9225 1.5621 1.9048 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5640 0.1640 3.0005 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8705 -1.9935 -2.3135 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9065 -1.3544 -2.3948 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 1 0 5 6 2 0 6 7 1 0 7 8 2 0 8 9 1 0 9 10 2 0 10 11 1 0 11 12 1 0 12 13 2 0 12 14 1 0 14 15 1 0 10 16 1 0 16 17 1 0 17 18 2 0 18 5 1 0 17 8 1 0 1 19 1 0 1 20 1 0 1 21 1 0 2 22 1 0 2 23 1 0 3 24 1 0 3 25 1 0 6 26 1 0 7 27 1 0 11 28 1 0 15 29 1 0 15 30 1 0 15 31 1 0 16 32 1 0 18 33 1 0 M END