RDKit 3D 42 44 0 0 0 0 0 0 0 0999 V2000 2.4683 -0.1589 4.0205 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8196 -0.2590 4.3343 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6774 -0.9414 3.4785 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1787 -1.5225 2.2957 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8089 -1.3950 1.9367 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9681 -0.7166 2.8335 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3246 -1.8947 0.6903 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0680 -1.7639 0.1139 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0607 -1.2723 0.6288 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0418 -2.2008 -1.3524 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1212 -0.6830 -2.3742 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.6097 -0.3506 -2.4564 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3231 -1.1765 -3.1590 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6829 -1.0041 -3.2985 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3967 -1.8605 -3.7984 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2825 0.3017 -2.8523 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6182 0.7005 -1.5286 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.1044 0.8855 -1.7366 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.7711 2.0697 -2.5559 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5325 3.0034 -3.2060 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.2865 1.8866 -0.9093 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7089 3.1159 -1.3847 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3445 3.7651 -0.2892 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2652 2.8961 0.7808 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6035 1.7677 0.4156 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1284 -2.2518 1.4393 N 0 0 0 0 0 4 0 0 0 0 0 0 6.3330 -2.1585 1.7174 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6769 -2.9431 0.5059 O 0 0 0 0 0 1 0 0 0 0 0 0 1.7922 0.3692 4.6918 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2016 0.1910 5.2408 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7361 -1.0098 3.7374 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9092 -0.5973 2.6467 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0309 -2.3765 0.1273 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1400 -2.8017 -1.5406 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9074 -2.8291 -1.6034 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1322 1.0510 -3.6417 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3719 0.1631 -2.7318 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7535 -0.1512 -0.8297 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6033 0.9739 -0.7613 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5879 3.5012 -2.3980 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8100 4.7420 -0.2826 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6046 2.9352 1.8139 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 2 3 1 0 3 4 2 0 4 5 1 0 5 6 2 0 5 7 1 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 2 0 14 16 1 0 16 17 1 0 17 18 1 0 18 19 1 0 19 20 3 0 17 21 1 0 21 22 2 0 22 23 1 0 23 24 2 0 24 25 1 0 4 26 1 0 26 27 2 0 26 28 1 0 6 1 1 0 18 12 1 0 25 21 1 0 1 29 1 0 2 30 1 0 3 31 1 0 6 32 1 0 7 33 1 0 10 34 1 0 10 35 1 0 16 36 1 0 16 37 1 0 17 38 1 1 18 39 1 1 22 40 1 0 23 41 1 0 24 42 1 0 M CHG 2 26 1 28 -1 M END