RDKit 3D 42 45 0 0 0 0 0 0 0 0999 V2000 4.8433 -1.3751 2.3322 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6103 -1.0576 1.7172 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6064 -0.4115 0.4950 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8132 -0.0792 -0.1196 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8645 0.5628 -1.3334 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6886 0.8947 -1.9751 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4694 0.5783 -1.3908 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4513 -0.0683 -0.1679 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0296 -0.2559 0.1705 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4394 -0.8421 1.2705 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1419 -1.3978 2.3297 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9463 -0.8919 1.3467 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7485 -0.3736 0.3570 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1316 0.1959 -0.7108 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2379 0.2777 -0.8479 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1289 0.8269 -1.8766 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7320 1.3769 -2.9221 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0169 0.7565 -1.7764 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.5829 -0.2512 -2.5476 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1756 1.4385 -1.0343 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0005 0.3639 -0.4035 C 0 0 2 0 0 0 0 0 0 0 0 0 -5.1911 0.9418 0.3172 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2268 -0.4868 0.5460 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.4881 -0.0220 1.8493 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7384 -1.9992 3.2181 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4659 -1.9720 1.6029 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4501 -0.4462 2.5079 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7213 -0.3467 0.3971 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7980 0.8215 -1.8120 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7062 1.3984 -2.9277 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6995 -1.8149 3.1121 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4199 -1.3567 2.2188 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5139 1.4647 -2.4317 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2752 -1.1504 -2.2632 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7286 2.1137 -0.2659 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7553 1.9664 -1.7921 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3573 -0.3044 -1.2308 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9229 1.2752 1.3426 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9329 0.1063 0.4544 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6506 1.7869 -0.2095 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5452 -1.5469 0.4917 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0260 0.8514 1.9622 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 2 0 4 5 1 0 5 6 2 0 6 7 1 0 7 8 2 0 8 9 1 0 9 10 2 0 10 11 1 0 10 12 1 0 12 13 2 0 13 14 1 0 14 15 2 0 15 16 1 0 16 17 2 0 14 18 1 0 18 19 1 0 18 20 1 0 20 21 1 0 21 22 1 0 21 23 1 0 23 24 1 0 8 3 1 0 15 9 1 0 16 7 1 0 23 13 1 0 1 25 1 0 1 26 1 0 1 27 1 0 4 28 1 0 5 29 1 0 6 30 1 0 11 31 1 0 12 32 1 0 18 33 1 6 19 34 1 0 20 35 1 0 20 36 1 0 21 37 1 6 22 38 1 0 22 39 1 0 22 40 1 0 23 41 1 1 24 42 1 0 M END