HMDB0036422 RDKit 3D Fauronyl acetate 48 49 0 0 0 0 0 0 0 0999 V2000 4.2323 2.8827 -0.6189 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8596 2.5358 -0.1721 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1396 3.3729 0.4490 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2807 1.2886 -0.4017 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9734 0.9571 0.0234 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0382 0.7217 -1.1421 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3228 0.5115 -0.5394 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6557 1.6674 0.3641 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3777 0.3911 -1.5912 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7470 0.2298 -1.0506 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8755 -0.5876 0.1773 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6729 -0.6951 1.0038 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7274 -0.7446 2.2110 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3402 -0.7427 0.2850 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4825 -1.9464 -0.6595 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2248 -0.9238 1.2236 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0272 -0.1569 0.9997 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2384 -1.0596 0.7751 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2546 -1.6891 -0.5768 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3282 -2.1214 1.8134 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2558 3.9898 -0.8355 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5431 2.3679 -1.5286 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9587 2.7591 0.2281 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5747 1.8622 0.5349 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0179 1.6576 -1.7381 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3306 -0.0873 -1.7991 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7641 1.7515 0.4696 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2776 1.5047 1.4033 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2756 2.6217 -0.0578 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3501 1.3503 -2.1869 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1184 -0.3992 -2.3442 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3735 -0.2624 -1.8524 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2226 1.2463 -0.9355 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6738 -0.1105 0.8191 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2788 -1.6196 -0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0768 -2.8111 -0.0817 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5209 -2.1651 -0.8990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8425 -1.7750 -1.5440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0621 -2.0202 1.1994 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6381 -0.8140 2.2729 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2762 0.3212 2.0021 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1404 -0.4165 0.8611 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1321 -2.4041 -0.5690 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3875 -2.2969 -0.8275 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5282 -0.9567 -1.3884 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8396 -3.0772 1.5228 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4205 -2.3791 1.9409 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9994 -1.7290 2.7804 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 2 0 2 4 1 0 4 5 1 0 5 6 1 0 6 7 1 0 7 8 1 0 7 9 1 0 9 10 1 0 10 11 1 0 11 12 1 0 12 13 2 0 12 14 1 0 14 15 1 0 14 16 1 0 16 17 1 0 17 18 1 0 18 19 1 0 18 20 1 0 17 5 1 0 14 7 1 0 1 21 1 0 1 22 1 0 1 23 1 0 5 24 1 0 6 25 1 0 6 26 1 0 8 27 1 0 8 28 1 0 8 29 1 0 9 30 1 0 9 31 1 0 10 32 1 0 10 33 1 0 11 34 1 0 11 35 1 0 15 36 1 0 15 37 1 0 15 38 1 0 16 39 1 0 16 40 1 0 17 41 1 0 18 42 1 0 19 43 1 0 19 44 1 0 19 45 1 0 20 46 1 0 20 47 1 0 20 48 1 0 M END