RDKit 3D 48 50 0 0 0 0 0 0 0 0999 V2000 -2.7380 -3.6792 1.1645 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2955 -3.2216 -0.2192 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5206 -1.7837 -0.4134 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.7826 -1.4284 -0.8988 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6657 -2.2441 -1.1657 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0435 0.0094 -1.0840 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2635 0.4633 -1.5926 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4726 1.8355 -1.7457 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4721 2.7600 -1.3961 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2552 2.2702 -0.8874 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0331 0.9011 -0.7304 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8034 0.4680 -0.2265 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6000 -0.7991 -0.0851 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0322 -1.2939 0.5336 S 0 0 0 0 0 0 0 0 0 0 0 0 0.5273 0.2464 1.3673 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.1194 0.3543 2.7454 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0617 0.2057 1.4642 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6569 0.1962 2.5374 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6684 0.2059 0.2142 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0475 0.1736 -0.0992 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0575 0.2556 0.8669 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4070 0.2039 0.4766 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7618 0.0771 -0.8737 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7597 0.0025 -1.8401 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4158 0.0503 -1.4559 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2155 -0.0629 -2.6984 Cl 0 0 0 0 0 0 0 0 0 0 0 0 7.4667 0.2783 1.4923 N 0 0 0 0 0 4 0 0 0 0 0 0 7.1355 0.4912 2.6660 O 0 0 0 0 0 0 0 0 0 0 0 0 8.6362 0.1189 1.1111 O 0 0 0 0 0 1 0 0 0 0 0 0 -4.6925 4.2496 -1.5676 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8156 4.6132 -2.0373 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7360 5.0180 -1.2306 O 0 0 0 0 0 1 0 0 0 0 0 0 -2.5891 -4.7578 1.2736 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1752 -3.1755 1.9532 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7990 -3.4626 1.3313 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2441 -3.4768 -0.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8582 -3.7853 -0.9751 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0482 -0.2375 -1.8691 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4190 2.2022 -2.1415 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4752 2.9808 -0.6146 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2855 1.1390 0.7794 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1465 -0.4908 3.3926 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2108 0.4086 2.6794 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2253 1.2675 3.2499 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0394 0.1458 -0.5851 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8133 0.3632 1.9208 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8043 0.0366 -1.1861 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0283 -0.0926 -2.8895 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 5 2 0 4 6 1 0 6 7 2 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 13 14 1 0 14 15 1 0 15 16 1 0 15 17 1 0 17 18 2 0 17 19 1 0 19 20 1 0 20 21 2 0 21 22 1 0 22 23 2 0 23 24 1 0 24 25 2 0 25 26 1 0 22 27 1 0 27 28 2 0 27 29 1 0 9 30 1 0 30 31 2 0 30 32 1 0 13 3 1 0 11 6 1 0 25 20 1 0 1 33 1 0 1 34 1 0 1 35 1 0 2 36 1 0 2 37 1 0 7 38 1 0 8 39 1 0 10 40 1 0 15 41 1 6 16 42 1 0 16 43 1 0 16 44 1 0 19 45 1 0 21 46 1 0 23 47 1 0 24 48 1 0 M CHG 3 27 1 29 -1 32 -1 M END