RDKit 3D 46 49 0 0 0 0 0 0 0 0999 V2000 -5.0683 -2.3446 -0.5417 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3939 -2.3716 -0.1254 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9064 -1.3085 0.6127 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0958 -0.2145 0.9358 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7478 -0.1650 0.5229 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2529 -1.2559 -0.2221 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8332 1.0218 0.8562 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.3566 1.8405 -0.3622 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.1265 1.2414 -1.0065 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8691 1.3210 -2.2030 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2231 0.6808 -0.1335 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4332 0.4409 1.1983 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6629 0.5848 1.7305 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9314 0.3413 3.1133 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1639 0.1793 4.2376 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0723 -0.1724 2.0799 S 0 0 0 0 0 0 0 0 0 0 0 0 1.1935 1.0992 1.7913 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0269 0.7253 0.5719 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4927 0.6394 -0.5323 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3522 0.5048 0.8687 N 0 0 0 0 0 0 0 0 0 0 0 0 4.3524 0.1590 -0.0049 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5698 -0.0453 0.4345 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3968 -0.3779 -0.6271 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7731 -0.6713 -0.5460 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4848 -0.9921 -1.7070 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8435 -1.0234 -2.9415 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4792 -0.7357 -3.0488 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7750 -0.4154 -1.8768 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1130 -0.0185 -1.6771 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.4279 2.0927 -1.3339 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3072 2.3206 -2.0566 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.8341 1.0521 1.8524 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -4.6657 -3.1730 -1.1212 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0292 -3.2172 -0.3771 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9458 -1.3360 0.9324 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2235 -1.2897 -0.5722 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3970 1.7441 1.4593 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0182 2.8207 0.0089 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3243 0.4159 -0.5484 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7495 2.0873 1.6335 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8195 1.1608 2.6866 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6816 0.5540 1.8236 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2714 -0.6465 0.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5467 -1.2182 -1.6413 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4092 -1.2746 -3.8366 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9793 -0.7603 -4.0126 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 2 3 1 0 3 4 2 0 4 5 1 0 5 6 2 0 5 7 1 0 7 8 1 0 8 9 1 0 9 10 2 0 9 11 1 0 11 12 1 0 12 13 2 0 13 14 1 0 14 15 3 0 12 16 1 0 16 17 1 0 17 18 1 0 18 19 2 0 18 20 1 0 20 21 1 0 21 22 2 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 28 29 1 0 8 30 1 0 30 31 3 0 4 32 1 0 6 1 1 0 13 7 1 0 29 21 1 0 28 23 1 0 1 33 1 0 2 34 1 0 3 35 1 0 6 36 1 0 7 37 1 1 8 38 1 1 11 39 1 0 17 40 1 0 17 41 1 0 20 42 1 0 24 43 1 0 25 44 1 0 26 45 1 0 27 46 1 0 M END