RDKit 3D 40 42 0 0 0 0 0 0 0 0999 V2000 -4.8576 0.7396 -0.0906 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6754 -0.4259 0.8121 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4143 -0.6983 1.8711 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.8949 -1.8431 2.4109 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8261 -2.2863 1.6724 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6887 -1.3742 0.6577 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.7144 -1.4657 -0.4221 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6736 -0.3762 -0.3968 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0546 0.0408 0.7868 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0767 1.0421 0.7666 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3459 1.6344 -0.4324 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2856 1.2122 -1.6111 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2686 0.2170 -1.5982 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2762 2.6142 -0.3959 N 0 0 0 0 0 2 0 0 0 0 0 0 2.5611 2.6218 -1.3217 S 0 0 0 0 0 0 0 0 0 0 0 0 2.5430 2.0584 -2.6625 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5426 3.6739 -1.0617 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6149 1.3457 -0.6141 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5484 -0.0170 -0.7023 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6361 -0.5152 0.0386 N 0 0 0 0 0 0 0 0 0 0 0 0 5.3491 0.5124 0.5204 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7513 1.6253 0.1413 N 0 0 0 0 0 4 0 0 0 0 0 0 4.9493 -1.9182 0.2261 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4154 -1.0283 -1.5597 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -5.8026 1.2461 0.1304 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8840 0.4284 -1.1391 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0494 1.4640 0.0453 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3215 -2.2884 3.2999 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1771 -3.1433 1.7801 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2888 -1.4516 -1.3559 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2182 -2.4408 -0.3527 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3391 -0.3872 1.7454 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3531 1.3661 1.7138 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0216 1.6637 -2.5681 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7166 -0.0770 -2.5446 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2549 0.4433 1.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0152 2.6017 0.2751 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1035 -2.4193 0.7043 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1593 -2.3763 -0.7441 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8302 -2.0186 0.8663 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