RDKit 3D 42 42 0 0 0 0 0 0 0 0999 V2000 -2.4562 -1.0640 1.4362 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9618 -0.4549 0.1555 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.8822 -0.4825 -0.9154 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6843 0.2970 -0.4570 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.0792 1.7017 -0.0624 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2435 2.1696 1.1670 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5885 3.4023 1.3492 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7714 4.1822 0.2308 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4293 3.0712 -1.0193 S 0 0 0 0 0 0 0 0 0 0 0 0 0.3442 0.2744 -1.4557 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0512 0.7963 -2.7917 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6485 -0.2348 -1.2335 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4632 -0.2209 -2.1641 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9810 -0.7565 0.0845 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3635 -1.1893 0.3531 C 0 0 1 0 0 0 0 0 0 0 0 0 3.9350 -2.2414 -0.5267 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3023 -0.0470 0.5434 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4444 1.0463 -0.8339 Cl 0 0 0 0 0 0 0 0 0 0 0 0 3.5996 0.9525 1.8788 Cl 0 0 0 0 0 0 0 0 0 0 0 0 5.9180 -0.6191 1.0639 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -4.0829 -1.3615 -0.3566 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7477 -0.7219 -1.8768 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -3.3582 -2.9681 -0.5932 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -5.3279 -1.4243 0.9147 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -1.9806 -0.3518 2.1232 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7034 -1.8571 1.2062 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3009 -1.5892 1.9671 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3063 0.5791 0.2818 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2724 -0.0963 -1.8729 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5928 -1.5381 -1.0688 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2878 -0.1530 0.4724 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7327 3.8193 2.3771 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0646 5.2486 0.2010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0426 1.8916 -2.7525 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8144 0.2668 -3.2097 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8985 0.5680 -3.4959 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2806 -1.6280 0.2705 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6743 0.0491 0.8207 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3523 -1.6957 1.4115 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8428 -2.6631 -0.0012 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2676 -3.1010 -0.6677 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3448 -1.8568 -1.4950 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 1 0 4 10 1 0 10 11 1 0 10 12 1 0 12 13 2 0 12 14 1 0 14 15 1 0 15 16 1 0 15 17 1 0 17 18 1 0 17 19 1 0 17 20 1 0 4 5 1 0 5 6 2 0 6 7 1 0 7 8 2 0 8 9 1 0 2 21 1 0 21 22 1 0 21 23 1 0 21 24 1 0 9 5 1 0 1 25 1 0 1 26 1 0 1 27 1 0 2 28 1 1 3 29 1 0 3 30 1 0 4 31 1 1 11 34 1 0 11 35 1 0 11 36 1 0 14 37 1 0 14 38 1 0 15 39 1 1 16 40 1 0 16 41 1 0 16 42 1 0 7 32 1 0 8 33 1 0 M END