RDKit 3D 44 45 0 0 0 0 0 0 0 0999 V2000 4.3542 0.6113 -0.3555 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8517 0.6628 -0.4446 C 0 0 1 0 0 0 0 0 0 0 0 0 2.2531 -0.7221 -0.5533 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1342 -1.2769 0.8618 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0577 -2.2996 0.9788 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4005 -2.6049 -0.3279 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7490 -2.1338 -0.7434 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6440 -1.1984 -0.0090 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.0991 -1.6443 -0.2151 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8516 -0.3349 -0.1901 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9559 0.5531 -1.0212 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.2314 0.3715 -2.3799 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5385 0.1468 -0.6869 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.8328 1.1659 0.1788 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.7694 1.5375 1.1678 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4656 2.3603 -0.6244 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6839 3.0215 -0.4671 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7110 2.6587 0.5005 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1268 3.5816 1.2926 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2716 1.3944 0.6296 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8360 1.4008 -1.0007 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7226 -0.3636 -0.7604 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7455 0.7428 0.6565 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6169 1.1770 -1.4205 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2224 -0.6799 -0.9604 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8974 -1.4050 -1.1437 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0928 -1.7209 1.1929 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9797 -0.3935 1.5158 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2569 -1.9906 1.7160 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4863 -3.2178 1.4298 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9696 -3.2923 -0.9673 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1075 -2.4448 -1.7249 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4858 -1.1658 1.0624 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2376 -2.1532 -1.1719 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4113 -2.2916 0.6516 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8017 -0.4991 -0.7419 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9778 0.0718 0.8147 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1864 1.5968 -0.7864 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8685 1.0441 -2.7207 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9822 0.0915 -1.6517 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0241 0.6953 0.6613 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2023 2.3601 0.8275 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1990 2.6807 -1.3691 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9026 3.9070 -1.0918 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 20 1 0 2 3 1 0 3 4 1 0 4 5 1 0 5 6 1 0 6 7 2 0 7 8 1 0 8 9 1 0 9 10 1 0 10 11 1 0 11 12 1 0 11 13 1 0 13 14 1 0 14 15 1 0 14 16 1 0 16 17 2 0 17 18 1 0 18 19 2 0 18 20 1 0 13 8 1 0 1 21 1 0 1 22 1 0 1 23 1 0 2 24 1 6 3 25 1 0 3 26 1 0 4 27 1 0 4 28 1 0 5 29 1 0 5 30 1 0 6 31 1 0 7 32 1 0 8 33 1 1 9 34 1 0 9 35 1 0 10 36 1 0 10 37 1 0 11 38 1 1 12 39 1 0 13 40 1 6 14 41 1 1 15 42 1 0 16 43 1 0 17 44 1 0 M END