RDKit 3D 39 40 0 0 0 0 0 0 0 0999 V2000 -4.6557 0.2770 1.4492 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2859 -0.0119 0.8881 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1923 -0.0870 1.7821 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8964 -0.3607 1.3366 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6965 -0.5440 -0.0179 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7856 -0.4935 -0.9007 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0832 -0.2030 -0.4958 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2247 -0.1703 -1.4722 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3555 -0.7903 -2.1894 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0011 -1.0415 -2.2221 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6909 -1.2460 -3.2068 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5543 -0.8831 -0.7754 C 0 0 1 0 0 0 0 0 0 0 0 0 1.6171 0.1745 -0.8018 N 0 0 0 0 0 4 0 0 0 0 0 0 2.7044 0.3223 0.2555 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3107 1.4609 1.1963 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9478 -0.9881 1.0004 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0000 0.7148 -0.5108 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9709 0.7467 -1.7423 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1323 1.0034 0.1771 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.3757 -0.4738 1.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9871 1.2727 1.1386 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6553 0.2499 2.5441 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3617 0.0542 2.8505 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0978 -0.4493 2.0648 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7131 -1.1490 -1.5086 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8860 0.0904 -2.4796 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9639 0.5882 -1.1967 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9434 -0.8254 -3.0135 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9814 -1.8447 -0.4772 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1835 1.0850 -1.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1473 0.0020 -1.6867 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0621 1.6055 1.9808 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2268 2.4110 0.6554 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3572 1.2753 1.6940 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7615 -0.8837 1.7275 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0664 -1.3159 1.5588 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2406 -1.7889 0.3118 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2409 0.9719 1.1836 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9625 1.2443 -0.3584 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 2 0 7 8 1 0 6 9 1 0 9 10 1 0 10 11 2 0 10 12 1 0 12 13 1 0 13 14 1 0 14 15 1 0 14 16 1 0 14 17 1 0 17 18 2 0 17 19 1 0 7 2 1 0 12 5 1 0 1 20 1 0 1 21 1 0 1 22 1 0 3 23 1 0 4 24 1 0 8 25 1 0 8 26 1 0 8 27 1 0 9 28 1 0 12 29 1 1 13 30 1 0 13 31 1 0 15 32 1 0 15 33 1 0 15 34 1 0 16 35 1 0 16 36 1 0 16 37 1 0 19 38 1 0 19 39 1 0 M CHG 1 13 1 M END