HMDB0031770 RDKit 3D Carbofuran 31 32 0 0 0 0 0 0 0 0999 V2000 5.0997 0.4325 0.0817 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6829 0.5621 -0.0599 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9036 0.5839 0.9573 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4205 0.4814 2.2334 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5586 0.7107 0.7506 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8418 -0.0029 -0.1731 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4205 -0.9427 -0.9849 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6380 -1.6256 -1.8978 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7026 -1.3654 -1.9896 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2552 -0.4288 -1.1738 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5313 0.2836 -0.2461 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3773 1.1662 0.4362 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6643 0.5652 0.3725 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7728 1.5560 0.6020 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7093 -0.5347 1.3875 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6578 0.0613 -1.0506 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5834 0.3829 -0.9249 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3583 -0.5040 0.5998 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4919 1.3382 0.6297 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7918 -0.3561 2.6373 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4876 -1.1833 -0.9363 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1090 -2.3824 -2.5505 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2741 -1.9330 -2.7273 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6259 2.4486 -0.0334 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8727 1.7780 1.6691 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7151 1.0767 0.2617 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2215 -0.1493 2.3272 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1247 -1.4148 1.0835 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7411 -0.8300 1.6665 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4009 -0.7197 -1.2402 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7408 0.9454 -1.7076 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 2 3 3 4 1 0 3 5 1 0 5 6 1 0 6 7 2 0 7 8 1 0 8 9 2 0 9 10 1 0 10 11 2 0 11 12 1 0 12 13 1 0 13 14 1 0 13 15 1 0 13 16 1 0 11 6 1 0 16 10 1 0 1 17 1 0 1 18 1 0 1 19 1 0 4 20 1 0 7 21 1 0 8 22 1 0 9 23 1 0 14 24 1 0 14 25 1 0 14 26 1 0 15 27 1 0 15 28 1 0 15 29 1 0 16 30 1 0 16 31 1 0 M END