RDKit 3D 45 47 0 0 0 0 0 0 0 0999 V2000 0.3853 -2.4916 2.9860 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1287 -2.2109 1.5629 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6760 -3.0554 0.5695 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1694 -0.6778 1.2450 C 0 0 1 0 0 0 0 0 0 0 0 0 1.2165 -0.0818 1.3180 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8160 0.3381 2.4190 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0658 0.7548 2.0500 N 0 0 0 0 0 0 0 0 0 0 0 0 3.2481 0.6054 0.7488 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0805 0.1307 0.2725 N 0 0 0 0 0 0 0 0 0 0 0 0 1.9685 -0.1822 -1.1326 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6035 1.0164 -2.0065 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6059 2.0318 -2.0704 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7562 1.6677 -2.8189 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9185 -0.3159 0.0060 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.9334 -1.1992 -0.6168 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3313 -0.6013 -0.4246 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9835 0.8180 -0.1682 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6226 0.9234 0.1283 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1007 2.1535 0.5043 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9481 3.2657 0.5598 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3093 3.1437 0.2528 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8401 1.9068 -0.1077 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4535 -2.2757 3.0872 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2399 -3.5472 3.2419 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1604 -1.8956 3.7249 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1597 -2.5842 1.5631 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5835 -4.1196 0.8143 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7420 -2.8083 0.5956 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3192 -2.9301 -0.4558 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7250 -0.2441 2.0918 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9252 -0.6203 -1.4364 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2187 -0.9650 -1.2549 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6997 1.4995 -1.6297 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3765 0.6785 -3.0247 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3239 0.8858 -2.3083 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4771 1.3386 -3.8244 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3976 2.5489 -2.9083 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7083 -1.2267 -1.6926 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9134 -2.2409 -0.2930 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9551 -0.7368 -1.3123 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8252 -1.0335 0.4519 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0498 2.2837 0.7401 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5431 4.2341 0.8449 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9543 4.0172 0.3075 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8988 1.8017 -0.3211 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 2 4 1 0 4 5 1 0 5 6 2 0 6 7 1 0 7 8 2 0 8 9 1 0 9 10 1 0 10 11 1 0 11 12 1 0 12 13 1 0 4 14 1 0 14 15 1 0 15 16 1 0 16 17 1 0 17 18 2 0 18 19 1 0 19 20 2 0 20 21 1 0 21 22 2 0 9 5 1 0 18 14 1 0 22 17 1 0 1 23 1 0 1 24 1 0 1 25 1 0 2 26 1 0 3 27 1 0 3 28 1 0 3 29 1 0 4 30 1 1 10 31 1 0 10 32 1 0 11 33 1 0 11 34 1 0 13 35 1 0 13 36 1 0 13 37 1 0 15 38 1 0 15 39 1 0 16 40 1 0 16 41 1 0 19 42 1 0 20 43 1 0 21 44 1 0 22 45 1 0 M END