RDKit 3D 47 50 0 0 0 0 0 0 0 0999 V2000 4.3898 -3.1281 -0.4848 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4332 -2.6664 0.4157 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5781 -1.3816 0.7814 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6269 -0.4132 0.2183 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5646 0.8425 0.4324 N 0 0 0 0 0 4 0 0 0 0 0 0 3.3929 1.3355 -0.3952 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1258 2.5128 -0.3414 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8235 0.1575 -1.1042 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5792 -0.8860 -0.7207 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4968 -2.2866 -1.0322 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6947 0.2071 -1.8901 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8910 1.2771 -2.0998 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2044 1.7054 -1.3099 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7694 2.9432 -1.7067 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7504 3.5979 -0.9569 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1674 3.0343 0.2442 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6277 1.8180 0.6761 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6745 1.1375 -0.1083 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1192 -0.4469 0.4878 S 0 0 0 0 0 0 0 0 0 0 0 0 1.0300 -0.1692 1.3325 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0097 -1.3546 -0.6360 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3217 -1.0353 1.4956 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6499 -1.3096 1.0578 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9298 -2.0069 -0.1171 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2552 -2.2599 -0.4871 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3003 -1.8215 0.3222 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0296 -1.1412 1.5052 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7053 -0.8982 1.8787 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9274 -2.1263 -0.1401 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -3.1716 3.7181 1.0700 N 0 0 0 0 0 4 0 0 0 0 0 0 -3.5440 3.1401 2.1013 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5736 4.8253 0.6901 O 0 0 0 0 0 1 0 0 0 0 0 0 4.3448 -4.1948 -0.6972 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1120 -3.4268 0.8021 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3623 -1.0662 1.4613 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1185 1.4404 1.0293 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7174 -2.6566 -1.6928 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2336 -0.7110 -2.0102 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8306 1.6003 -3.0714 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4194 3.4350 -2.6155 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1502 4.5470 -1.3107 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9474 1.4125 1.6322 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1509 -0.9221 2.4939 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1391 -2.3938 -0.7531 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4644 -2.8095 -1.4023 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8430 -0.8009 2.1434 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5196 -0.3740 2.8122 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 2 0 6 8 1 0 8 9 2 0 9 10 1 0 8 11 1 0 11 12 1 0 12 13 1 0 13 14 2 0 14 15 1 0 15 16 2 0 16 17 1 0 17 18 2 0 18 19 1 0 19 20 2 0 19 21 2 0 19 22 1 0 22 23 1 0 23 24 2 0 24 25 1 0 25 26 2 0 26 27 1 0 27 28 2 0 26 29 1 0 16 30 1 0 30 31 2 0 30 32 1 0 10 1 2 0 9 4 1 0 18 13 1 0 28 23 1 0 1 33 1 0 2 34 1 0 3 35 1 0 5 36 1 0 10 37 1 0 11 38 1 0 12 39 1 0 14 40 1 0 15 41 1 0 17 42 1 0 22 43 1 0 24 44 1 0 25 45 1 0 27 46 1 0 28 47 1 0 M CHG 3 5 1 30 1 32 -1 M END