HMDB0253405 RDKit 3D Imazapyr 34 35 0 0 0 0 0 0 0 0999 V2000 -3.9052 -0.3508 0.2614 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5607 -0.7455 -0.3023 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3914 -0.2063 -1.6880 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4781 -0.2805 0.6414 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6819 -0.9371 2.0038 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1632 -0.6550 0.1947 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6922 0.4459 0.4449 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1445 0.5066 0.4344 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8006 0.7248 1.6148 N 0 0 0 0 0 0 0 0 0 0 0 0 4.1326 0.7885 1.6782 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8633 0.6302 0.5254 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2729 0.4096 -0.6911 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8582 0.3505 -0.7136 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1880 0.1810 -1.9831 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8741 0.0034 -3.0170 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8250 0.2132 -2.0819 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0257 1.4997 0.7611 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4043 1.1852 0.7452 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3288 2.0360 0.8099 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8628 -0.4608 1.3738 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1603 0.7083 0.0099 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7042 -0.9759 -0.1677 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4990 -1.8515 -0.3468 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9773 -0.9477 -2.3976 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4270 0.0169 -2.0809 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8440 0.7623 -1.7260 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2970 -1.8503 1.8390 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1464 -0.2390 2.7077 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7037 -1.2489 2.4456 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1237 -1.5533 -0.2199 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6465 0.9595 2.6029 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9546 0.6719 0.5179 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7998 0.2798 -1.6183 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3851 -0.5769 -2.5777 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 4 6 1 0 6 7 1 0 7 8 1 0 8 9 2 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 7 17 2 0 17 18 1 0 18 19 2 0 18 4 1 0 13 8 1 0 1 20 1 0 1 21 1 0 1 22 1 0 2 23 1 0 3 24 1 0 3 25 1 0 3 26 1 0 5 27 1 0 5 28 1 0 5 29 1 0 6 30 1 0 10 31 1 0 11 32 1 0 12 33 1 0 16 34 1 0 M END