RDKit 3D 49 51 0 0 0 0 0 0 0 0999 V2000 1.0495 -0.1223 3.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0869 0.0303 2.0703 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3032 0.0504 2.5977 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4817 0.1869 1.7747 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6471 0.2029 2.3387 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3048 0.3005 0.3539 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4135 0.1827 -0.3787 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7404 -0.0504 0.2374 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3578 0.2840 -1.8738 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1197 -0.4557 -2.2603 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8684 0.1236 -1.6585 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9723 0.5582 -0.2171 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.9635 2.1179 -0.3411 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2163 0.1386 0.6214 C 0 0 1 0 0 0 0 0 0 0 0 0 1.3545 1.1408 0.4635 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0954 0.5127 -0.7358 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0179 -0.9206 -0.3057 C 0 0 1 0 0 0 0 0 0 0 0 0 2.3182 -1.9272 -1.4216 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2351 -1.0955 0.6135 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4362 -0.7768 -0.2393 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6949 -1.3651 -1.3102 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3209 0.2253 0.1633 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7968 -1.0748 0.2659 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6963 0.7369 3.1303 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4960 -1.1014 2.8595 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6280 -0.2425 4.1069 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4202 -0.0400 3.6913 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5061 -0.1665 -0.5981 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1279 0.8544 0.7797 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8280 -0.9838 0.8008 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2151 -0.2953 -2.3102 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4549 1.2986 -2.2533 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2477 -1.5171 -1.9382 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9875 -0.4794 -3.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1406 -0.6668 -1.7047 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5603 0.9431 -2.3498 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0206 2.3584 -0.6592 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8408 2.5948 0.6246 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3499 2.4499 -1.1717 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0659 2.1386 0.1787 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0134 1.2052 1.3247 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6494 0.7873 -1.6689 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1638 0.8619 -0.7221 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6352 -1.4741 -2.3505 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9382 -2.7687 -1.0415 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3215 -2.4380 -1.6224 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2552 -2.1361 0.9399 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2593 -0.4056 1.4505 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3011 0.2198 0.0419 H 0 0 0 0 0 0 0 0 0 0 0 0 8 7 1 0 7 6 2 0 6 4 1 0 4 5 2 0 4 3 1 0 3 2 2 0 2 1 1 0 2 14 1 0 14 15 1 0 15 16 1 0 16 17 1 0 17 18 1 6 17 19 1 0 19 20 1 0 20 22 1 0 20 21 2 0 17 23 1 0 14 12 1 0 12 13 1 6 12 11 1 0 11 10 1 0 10 9 1 0 9 7 1 0 12 6 1 0 14 23 1 6 8 28 1 0 8 29 1 0 8 30 1 0 3 27 1 0 1 24 1 0 1 25 1 0 1 26 1 0 15 40 1 0 15 41 1 0 16 42 1 0 16 43 1 0 18 44 1 0 18 45 1 0 18 46 1 0 19 47 1 0 19 48 1 0 22 49 1 0 13 37 1 0 13 38 1 0 13 39 1 0 11 35 1 0 11 36 1 0 10 33 1 0 10 34 1 0 9 31 1 0 9 32 1 0 M END