RDKit 3D 39 40 0 0 0 0 0 0 0 0999 V2000 4.6187 -1.0723 -1.5183 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2921 -0.6313 -0.9514 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4109 -1.6197 -0.4497 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1709 -1.2869 0.0990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8199 0.0491 0.1353 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6902 1.0309 -0.3573 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9204 0.7319 -0.9280 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8401 1.8073 -1.4327 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1158 2.2873 -0.1879 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1370 2.1963 0.3888 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9437 3.0962 0.5501 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4157 0.6992 0.6850 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.6852 0.2652 0.0060 N 0 0 0 0 0 4 0 0 0 0 0 0 -2.8364 -0.2802 0.8363 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3123 0.8119 1.8027 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3831 -1.5258 1.5997 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9860 -0.6076 -0.1678 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8621 0.2018 -0.4523 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8634 -1.7508 -0.9106 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8122 -2.1301 -1.3106 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4372 -0.5009 -1.0688 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6276 -0.9355 -2.6041 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7104 -2.6685 -0.4768 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5357 -2.0706 0.4984 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2914 2.7115 -1.7129 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3715 1.4844 -2.3334 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5699 2.0674 -0.6598 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5245 3.1651 -0.4858 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4874 0.5598 1.7671 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4719 -0.3815 -0.7649 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0646 1.1031 -0.4713 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5584 1.7403 1.2746 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2183 0.4908 2.3302 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5607 1.0493 2.5623 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2408 -2.0293 2.0606 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8935 -2.2529 0.9433 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6793 -1.2825 2.4024 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6546 -1.9115 -1.5337 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5050 -2.6110 -0.5109 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