RDKit 3D 86 90 0 0 0 0 0 0 0 0999 V2000 2.6397 2.9904 -1.0027 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4007 3.2387 0.2008 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1306 4.3226 0.8773 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0405 4.9927 0.2023 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8317 6.0785 0.7537 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7783 6.7103 -0.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5726 7.6839 0.4869 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4820 8.0861 1.7973 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3365 9.0985 2.2801 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5520 7.4867 2.6191 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7357 6.4794 2.0637 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4524 2.4432 0.8190 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8336 1.3790 0.0615 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.4801 1.2504 0.2809 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0692 0.0585 -0.0055 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.6965 -0.4285 1.3275 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4900 0.5832 1.8480 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0978 0.5763 3.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9597 -0.3944 3.8427 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8939 1.7822 3.4294 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0579 2.7613 2.4913 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7593 3.9318 2.6933 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9116 4.8956 1.7367 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.3331 4.1103 3.9506 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0679 5.2737 4.2526 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1751 3.1260 4.9135 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7383 3.2988 6.1683 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4566 1.9588 4.6568 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2449 -1.0139 -0.6661 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.6628 -1.0106 -2.0458 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4727 -2.0410 -2.5232 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7756 -2.9489 -1.7079 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0005 -2.1453 -3.8697 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8875 -3.1579 -4.1638 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4489 -3.3282 -5.4044 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3373 -4.3654 -5.6586 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1394 -2.4762 -6.4150 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6699 -2.5679 -7.7143 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2375 -1.4410 -6.1409 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9415 -0.5942 -7.2071 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6739 -1.2675 -4.9030 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1743 -1.0139 -0.4471 C 0 0 2 0 0 0 0 0 0 0 0 0 1.7203 -2.0801 0.1733 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3325 -2.9630 0.7271 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6191 -2.5184 0.9118 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1058 -4.2996 1.2397 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0415 -4.8600 2.1308 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8518 -6.1439 2.5700 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8088 -6.6646 3.4732 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8046 -6.9501 2.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6977 -8.2544 2.7076 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8889 -6.4212 1.3425 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1945 -7.1483 0.9210 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0866 -5.1031 0.8953 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4666 0.1361 0.7090 C 0 0 1 0 0 0 0 0 0 0 0 0 2.8206 0.2213 0.8492 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9288 4.5645 1.9055 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1989 4.7172 -0.8284 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8960 6.4041 -1.0573 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2985 8.1541 -0.1575 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0031 10.0434 2.2010 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4251 7.7419 3.6443 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0144 6.0314 2.7446 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1561 1.3989 -1.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9648 0.2942 -0.6386 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4509 -1.2207 0.9604 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0556 -0.9535 1.9864 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6111 2.6354 1.4901 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4840 4.7288 0.8230 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1555 5.9627 3.5126 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2721 4.1191 6.4146 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3369 1.1999 5.4282 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6626 -1.9781 -0.1976 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1719 -3.8885 -3.3925 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6014 -5.0146 -4.9335 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3150 -3.3329 -7.8508 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2265 0.1646 -7.0102 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9748 -0.4769 -4.6656 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8001 -0.4444 -1.1742 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8734 -4.2587 2.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7218 -7.5845 3.8393 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9379 -8.8849 2.4578 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3584 -8.0787 1.2293 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3312 -4.7003 0.2032 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9482 -0.1723 1.5526 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2475 0.0436 -0.0431 H 0 0 0 0 0 0 0 0 0 0 0 0 56 55 1 0 55 13 1 0 13 12 1 0 12 2 1 0 2 1 2 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 8 10 1 0 10 11 2 0 13 14 1 0 14 15 1 0 15 16 1 0 16 17 1 0 17 18 1 0 18 19 2 0 18 20 1 0 20 21 2 0 21 22 1 0 22 23 1 0 22 24 2 0 24 25 1 0 24 26 1 0 26 27 1 0 26 28 2 0 15 29 1 0 29 30 1 0 30 31 1 0 31 32 2 0 31 33 1 0 33 34 2 0 34 35 1 0 35 36 1 0 35 37 2 0 37 38 1 0 37 39 1 0 39 40 1 0 39 41 2 0 29 42 1 0 42 43 1 0 43 44 1 0 44 45 2 0 44 46 1 0 46 47 2 0 47 48 1 0 48 49 1 0 48 50 2 0 50 51 1 0 50 52 1 0 52 53 1 0 52 54 2 0 42 55 1 0 54 46 1 0 11 5 1 0 28 20 1 0 41 33 1 0 56 86 1 0 55 85 1 1 13 64 1 6 3 57 1 0 4 58 1 0 6 59 1 0 7 60 1 0 9 61 1 0 10 62 1 0 11 63 1 0 15 65 1 6 16 66 1 0 16 67 1 0 21 68 1 0 23 69 1 0 25 70 1 0 27 71 1 0 28 72 1 0 29 73 1 1 34 74 1 0 36 75 1 0 38 76 1 0 40 77 1 0 41 78 1 0 42 79 1 6 47 80 1 0 49 81 1 0 51 82 1 0 53 83 1 0 54 84 1 0 M END