RDKit 3D 49 52 0 0 0 0 0 0 0 0999 V2000 5.6748 -0.1525 -1.1804 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5770 -0.7506 -0.3074 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0368 0.1543 0.8161 C 0 0 1 0 0 0 0 0 0 0 0 0 5.1338 0.5630 1.8009 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2449 1.6773 0.1863 S 0 0 0 0 0 0 0 0 0 0 0 0 1.7808 1.0346 -0.5488 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2749 1.7334 -1.5001 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1290 1.3313 -2.1245 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3144 1.9563 -3.0873 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5637 0.0973 -1.6462 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.9909 0.3444 -1.1565 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.5707 -0.9856 -0.6966 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8587 -1.3542 -0.8914 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3629 -2.6960 -0.3661 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5369 -3.2126 0.8060 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0751 -3.2768 0.4233 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5799 -1.9466 -0.1023 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2974 -1.7401 -0.0410 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1840 -0.5679 -0.5565 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2876 -0.1317 -0.0651 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.7912 -0.7263 -1.4615 O 0 0 0 0 0 1 0 0 0 0 0 0 -2.0792 1.4581 -0.0999 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4300 2.7555 -0.5142 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4858 3.8127 0.3970 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1940 3.5836 1.7373 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8510 2.3075 2.1732 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7954 1.2503 1.2601 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2581 4.8838 2.8641 Cl 0 0 0 0 0 0 0 0 0 0 0 0 6.5590 0.1096 -0.5924 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9884 -0.8843 -1.9320 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3331 0.7389 -1.7136 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7542 -1.0741 -0.9561 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9718 -1.6675 0.1497 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2960 -0.4129 1.3916 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8891 1.2119 1.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6467 -0.3232 2.1895 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7104 1.0932 2.6611 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5711 -0.6021 -2.4955 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5660 0.6861 -2.0295 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3432 -3.4325 -1.1810 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4048 -2.6288 -0.0204 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8909 -4.2059 1.1041 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6674 -2.5503 1.6719 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9062 -4.0314 -0.3531 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4779 -3.5612 1.2972 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6712 2.9456 -1.5599 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7647 4.8029 0.0499 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6335 2.1213 3.2204 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5397 0.2624 1.6344 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 3 5 1 0 5 6 1 0 6 7 2 0 7 8 1 0 8 9 2 0 8 10 1 0 10 11 1 0 11 12 1 0 12 13 2 0 13 14 1 0 14 15 1 0 15 16 1 0 16 17 1 0 17 18 2 0 18 19 1 0 19 20 2 0 13 21 1 0 11 22 1 0 22 23 2 0 23 24 1 0 24 25 2 0 25 26 1 0 26 27 2 0 25 28 1 0 20 6 1 0 19 10 1 0 17 12 1 0 27 22 1 0 1 29 1 0 1 30 1 0 1 31 1 0 2 32 1 0 2 33 1 0 3 34 1 1 4 35 1 0 4 36 1 0 4 37 1 0 10 38 1 6 11 39 1 6 14 40 1 0 14 41 1 0 15 42 1 0 15 43 1 0 16 44 1 0 16 45 1 0 23 46 1 0 24 47 1 0 26 48 1 0 27 49 1 0 M CHG 1 21 -1 M END