RDKit 3D 86 92 0 0 0 0 0 0 0 0999 V2000 10.6445 0.8400 -2.5467 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4606 0.2833 -1.9085 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4583 -0.0483 -2.6399 O 0 0 0 0 0 0 0 0 0 0 0 0 9.3683 0.0962 -0.5206 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2000 -0.4347 0.0119 C 0 0 1 0 0 0 0 0 0 0 0 0 8.3868 -1.7000 0.7437 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3178 0.5231 0.7269 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8476 1.7643 1.0761 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3043 2.0186 0.9355 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0166 2.7285 1.5720 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6517 2.5302 1.7441 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8705 3.5227 2.2417 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1395 1.3089 1.3932 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9480 0.2660 0.8761 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3250 -0.9589 0.4254 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9846 -1.9042 -0.0483 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8558 -1.1478 0.4960 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2914 -2.3200 -0.0154 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9079 -2.4285 -0.0062 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0753 -1.4418 0.4817 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3861 -1.5577 0.3519 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1802 -2.4517 0.9724 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5500 -2.4995 0.6956 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1123 -1.6146 -0.2316 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3080 -0.7071 -0.8517 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9827 -0.6759 -0.5738 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0950 0.2152 -1.1759 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9114 0.2370 -1.7901 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.6648 -0.2866 -3.0831 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3751 0.5088 -1.5837 C 0 0 1 0 0 0 0 0 0 0 0 0 -5.1411 -0.2120 -2.5352 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1762 -0.4663 -1.0669 C 0 0 1 0 0 0 0 0 0 0 0 0 -4.5549 -1.6934 -0.5897 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0988 -2.8190 -0.4481 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.5685 -0.1286 -0.6133 C 0 0 1 0 0 0 0 0 0 0 0 0 -7.1011 -1.0784 0.4526 C 0 0 1 0 0 0 0 0 0 0 0 0 -6.2673 -1.0767 1.6815 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4614 -0.6901 0.6612 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.5120 -1.5128 0.2546 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.8848 -1.0389 0.5062 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1835 -2.5857 -0.2877 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.7888 1.3053 -0.2490 C 0 0 1 0 0 0 0 0 0 0 0 0 -7.4535 2.0119 -1.4073 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6406 1.3234 0.8629 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.5073 2.0804 0.0171 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7069 1.9108 -1.2517 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4128 2.8958 -1.8706 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6827 -0.3179 0.9783 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9430 0.7166 1.4928 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0676 -0.1612 0.9899 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7004 1.0671 1.4414 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9316 1.9471 1.8954 O 0 0 0 0 0 0 0 0 0 0 0 0 10.8637 1.8569 -2.1496 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4830 0.8604 -3.6479 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5584 0.2479 -2.3643 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5366 -0.7686 -0.9224 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7930 -1.8342 1.6783 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5113 -1.7529 1.1087 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3483 -2.6476 0.1747 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9386 1.3754 1.5862 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4525 3.0574 1.4481 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6728 2.2267 -0.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4432 3.6960 1.8349 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9805 3.7139 2.4737 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9468 -3.0670 -0.3841 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4361 -3.3424 -0.3985 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7532 -3.1395 1.6816 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2182 -3.1956 1.1658 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4341 0.8621 -1.8505 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3295 1.1836 -1.7648 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2081 -1.1451 -3.0627 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2578 -0.3378 -1.4927 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1384 -2.0651 -0.0176 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2619 -0.6874 1.4837 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7833 -0.5274 2.4998 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1690 -2.1227 2.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.6636 -1.8303 0.3863 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.1443 -0.2199 -0.1911 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.9505 -0.5918 1.5386 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9795 1.2953 -2.0508 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7138 2.5391 -2.0629 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1225 2.7854 -0.9747 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4251 1.9004 0.6358 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7613 3.1256 0.1621 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9411 1.7200 0.8825 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0643 0.6865 1.5274 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 2 0 2 4 1 0 4 5 1 0 5 6 1 0 5 7 1 0 7 8 2 0 8 9 1 0 8 10 1 0 10 11 2 0 11 12 1 0 11 13 1 0 13 14 2 0 14 15 1 0 15 16 2 0 15 17 1 0 17 18 2 0 18 19 1 0 19 20 2 0 20 21 1 0 21 22 2 0 22 23 1 0 23 24 2 0 24 25 1 0 25 26 2 0 26 27 1 0 25 28 1 0 28 29 1 0 28 30 1 0 30 31 1 6 32 31 1 6 32 33 1 0 33 34 2 0 32 35 1 0 35 36 1 0 36 37 1 0 36 38 1 0 38 39 1 0 39 40 1 0 39 41 2 0 35 42 1 0 42 43 1 0 42 44 1 1 42 45 1 0 45 46 1 0 46 47 2 0 20 48 1 0 48 49 1 0 48 50 2 0 50 51 1 0 51 52 2 0 14 7 1 0 50 17 1 0 51 13 1 0 26 21 1 0 32 30 1 0 33 24 1 0 46 30 1 0 1 53 1 0 1 54 1 0 1 55 1 0 5 56 1 6 6 57 1 0 6 58 1 0 6 59 1 0 9 60 1 0 9 61 1 0 9 62 1 0 10 63 1 0 12 64 1 0 18 65 1 0 19 66 1 0 22 67 1 0 23 68 1 0 27 69 1 0 28 70 1 6 29 71 1 0 35 72 1 6 36 73 1 6 37 74 1 0 37 75 1 0 37 76 1 0 40 77 1 0 40 78 1 0 40 79 1 0 43 80 1 0 43 81 1 0 43 82 1 0 44 83 1 0 45 84 1 0 45 85 1 0 49 86 1 0 M END