RDKit 3D 48 49 0 0 0 0 0 0 0 0999 V2000 -3.6965 -1.0199 1.5249 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1642 -1.1633 0.0943 C 0 0 1 0 0 0 0 0 0 0 0 0 -4.3055 -1.0534 -0.9257 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9181 0.3458 -0.9988 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9289 1.4766 -0.7149 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4857 1.0909 -1.0165 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0211 -0.1935 -0.3011 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.0895 0.0439 0.8390 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2370 1.2559 1.6558 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3804 -0.7721 0.8792 S 0 0 0 0 0 0 0 0 0 0 0 0 0.9682 -0.6147 2.1924 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2134 -2.0790 0.2838 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3827 0.2012 -0.2489 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7056 -0.5005 -0.6236 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4888 0.3158 -1.6749 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6521 1.0869 -1.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6099 0.1438 -0.4162 N 0 0 0 0 0 4 0 0 0 0 0 0 5.0229 -1.0804 0.2153 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5796 -0.8197 0.6058 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9157 -1.2402 2.2601 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0861 -0.0205 1.7323 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5097 -1.7329 1.7015 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7613 -2.1837 0.0283 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9138 -1.3176 -1.9171 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0916 -1.7868 -0.7087 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7533 0.4234 -0.2918 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3558 0.4820 -1.9954 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0184 1.7839 0.3321 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2082 2.3573 -1.3055 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8171 1.9358 -0.8212 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4179 0.9181 -2.1001 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4421 -0.7191 -1.0746 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6728 2.0847 1.2197 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8796 1.0803 2.6747 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2830 1.5526 1.7487 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5686 1.1706 0.2242 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7849 0.3551 -1.1532 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4429 -1.4554 -1.0997 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8832 -0.3747 -2.4326 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8251 1.0043 -2.2105 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3134 1.7890 -0.3018 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2165 1.6363 -1.8303 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3156 -0.1576 -1.1032 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1409 0.6631 0.2976 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6463 -1.3236 1.0806 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0999 -1.8879 -0.5204 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1892 -1.7073 1.1165 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5428 0.0065 1.3272 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 1 0 5 6 1 0 6 7 1 0 7 8 1 0 8 9 1 0 8 10 1 0 10 11 2 0 10 12 2 0 10 13 1 0 13 14 1 0 14 15 1 0 15 16 1 0 16 17 1 0 17 18 1 0 18 19 1 0 7 2 1 0 19 14 1 0 1 20 1 0 1 21 1 0 1 22 1 0 2 23 1 1 3 24 1 0 3 25 1 0 4 26 1 0 4 27 1 0 5 28 1 0 5 29 1 0 6 30 1 0 6 31 1 0 7 32 1 6 9 33 1 0 9 34 1 0 9 35 1 0 13 36 1 0 13 37 1 0 14 38 1 0 15 39 1 0 15 40 1 0 16 41 1 0 16 42 1 0 17 43 1 0 17 44 1 0 18 45 1 0 18 46 1 0 19 47 1 0 19 48 1 0 M CHG 1 17 1 M END