RDKit 3D 40 42 0 0 0 0 0 0 0 0999 V2000 -4.6416 0.3985 -1.0526 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4985 -1.0355 -0.6933 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2496 -2.0185 -1.1522 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.7644 -3.1639 -0.5829 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7076 -2.8830 0.2469 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5416 -1.5241 0.1683 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.5743 -0.7551 0.9400 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4993 -0.1132 0.1014 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8338 -0.8077 -0.9138 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1628 -0.1816 -1.6713 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5591 1.1416 -1.4245 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1159 1.8260 -0.4026 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1189 1.2098 0.3546 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5193 1.6928 -2.2074 N 0 0 0 0 0 2 0 0 0 0 0 0 2.7063 2.5648 -1.6234 S 0 0 0 0 0 0 0 0 0 0 0 0 3.9509 2.6286 -2.3753 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4141 3.6912 -0.7391 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4034 1.5653 -0.3028 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8902 0.2905 -0.3501 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3109 -0.0220 0.9527 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0882 1.0339 1.7496 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5547 1.9894 1.0123 N 0 0 0 0 0 4 0 0 0 0 0 0 4.8905 -1.2840 1.3659 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0069 -0.7844 -1.7191 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -5.5711 0.5592 -1.6081 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6743 1.0295 -0.1595 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8117 0.7225 -1.6872 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2053 -4.1283 -0.7981 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0844 -3.5145 0.8634 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1090 -1.4263 1.6715 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1503 -0.0074 1.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0979 -1.8354 -1.1538 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6302 -0.7451 -2.4796 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1062 2.8738 -0.2005 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6148 1.7927 1.1274 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3085 1.0937 2.8076 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2512 2.9315 1.2560 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1777 -2.0909 1.1755 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8146 -1.4593 0.8087 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1186 -1.2547 2.4349 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 2 0 3 4 1 0 4 5 2 0 5 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 11 14 1 0 14 15 1 0 15 16 2 0 15 17 2 0 15 18 1 0 18 19 2 0 19 20 1 0 20 21 1 0 21 22 2 0 20 23 1 0 19 24 1 0 6 2 1 0 13 8 1 0 22 18 1 0 1 25 1 0 1 26 1 0 1 27 1 0 4 28 1 0 5 29 1 0 7 30 1 0 7 31 1 0 9 32 1 0 10 33 1 0 12 34 1 0 13 35 1 0 21 36 1 0 22 37 1 0 23 38 1 0 23 39 1 0 23 40 1 0 M CHG 2 14 -1 22 1 M END