HMDB0250141 RDKit 3D Chlorsulfuron 35 36 0 0 0 0 0 0 0 0999 V2000 6.2725 -0.5880 -1.9651 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9203 -0.6953 -2.3823 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9176 -0.5175 -1.4021 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2329 -0.2571 -0.1310 N 0 0 0 0 0 0 0 0 0 0 0 0 3.2831 -0.0824 0.8262 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6515 0.2043 2.2400 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0148 -0.1893 0.4062 N 0 0 0 0 0 0 0 0 0 0 0 0 1.6100 -0.4443 -0.8294 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2698 -0.5595 -1.2656 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8570 -0.4188 -0.4570 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9972 -0.5752 -1.0494 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8075 -0.1283 0.9075 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2866 0.0174 1.7973 S 0 0 0 0 0 6 0 0 0 0 0 0 -2.1630 1.1377 2.8005 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4912 -1.2894 2.5118 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6458 0.3049 0.7500 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7098 -0.5958 0.6983 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7770 -0.3579 -0.1373 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8451 0.7580 -0.9469 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7845 1.6402 -0.8844 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6862 1.4274 -0.0462 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3606 2.5702 0.0082 Cl 0 0 0 0 0 0 0 0 0 0 0 0 2.6296 -0.6091 -1.7437 N 0 0 0 0 0 0 0 0 0 0 0 0 6.8471 -0.0007 -2.7251 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7775 -1.5483 -1.8463 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3060 0.0067 -1.0058 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1587 1.1705 2.3612 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3692 -0.5831 2.6193 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7487 0.0818 2.8746 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1303 -0.7786 -2.2969 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0561 0.0065 1.4240 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6954 -1.4698 1.3068 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5953 -1.0657 -0.1662 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7035 0.9131 -1.5942 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7903 2.5156 -1.4896 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 2 0 4 5 1 0 5 6 1 0 5 7 2 0 7 8 1 0 8 9 1 0 9 10 1 0 10 11 2 0 10 12 1 0 12 13 1 0 13 14 2 0 13 15 2 0 13 16 1 0 16 17 2 0 17 18 1 0 18 19 2 0 19 20 1 0 20 21 2 0 21 22 1 0 8 23 2 0 23 3 1 0 21 16 1 0 1 24 1 0 1 25 1 0 1 26 1 0 6 27 1 0 6 28 1 0 6 29 1 0 9 30 1 0 12 31 1 0 17 32 1 0 18 33 1 0 19 34 1 0 20 35 1 0 M END