RDKit 3D 101105 0 0 0 0 0 0 0 0999 V2000 -2.0212 -5.1751 -2.1658 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1596 -5.7476 -1.1249 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0839 -4.8309 -0.5398 C 0 0 1 0 0 0 0 0 0 0 0 0 0.7883 -4.4430 -1.7519 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6185 -3.6378 0.0355 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9128 -3.5327 -0.0157 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0449 -2.5181 0.6564 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7300 -1.3522 0.8553 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0060 -1.2373 0.6384 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2687 -1.1252 0.4232 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.5911 0.2036 0.0171 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8799 0.2949 -0.4314 C 0 0 2 0 0 0 0 0 0 0 0 0 -5.0323 1.4273 -1.3885 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3569 1.8438 -1.5930 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.8950 2.5668 -0.5159 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1572 2.7839 0.4943 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.2579 3.0630 -0.5390 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0619 3.0015 -1.6494 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.3549 3.4842 -1.6062 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.1826 3.4410 -2.7025 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.8744 4.0462 -0.4292 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.1949 4.5306 -0.4249 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.0535 4.0933 0.6493 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.5297 4.6509 1.8421 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.7701 3.6235 0.6357 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8905 0.0015 0.5863 C 0 0 1 0 0 0 0 0 0 0 0 0 -7.2056 -0.0259 0.0893 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.6109 -1.4976 1.0098 C 0 0 2 0 0 0 0 0 0 0 0 0 -6.5349 -1.9768 1.8544 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2016 -1.4493 1.6175 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.8924 -2.6869 2.1030 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0610 -0.2057 1.3071 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2812 -0.1378 1.5630 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8508 1.0329 2.0055 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0437 -1.2755 1.3664 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5023 -1.0942 1.4776 C 0 0 2 0 0 0 0 0 0 0 0 0 3.8604 -0.5341 0.2006 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0450 0.1725 0.2399 C 0 0 2 0 0 0 0 0 0 0 0 0 5.6603 0.1699 -1.1482 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8454 0.9045 -1.1544 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8836 2.2928 -0.9572 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7787 2.8507 -0.7808 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0988 3.0416 -0.9629 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3504 2.4793 -1.0108 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5015 3.2465 -1.0436 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7338 2.5860 -1.0916 O 0 0 0 0 0 0 0 0 0 0 0 0 10.3916 4.6032 -1.0291 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5517 5.3804 -1.0613 O 0 0 0 0 0 0 0 0 0 0 0 0 9.1688 5.1981 -0.9851 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0535 6.5799 -0.9743 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0237 4.4288 -0.9517 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0506 -0.4711 1.1767 C 0 0 1 0 0 0 0 0 0 0 0 0 6.0072 0.1105 2.4219 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8265 -1.9295 1.2201 C 0 0 2 0 0 0 0 0 0 0 0 0 6.0990 -2.5408 -0.0010 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3908 -2.2492 1.6722 C 0 0 1 0 0 0 0 0 0 0 0 0 4.5434 -2.5350 3.0727 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4045 -2.4207 0.9272 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1752 -3.5338 0.7687 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7384 -5.4746 -3.2122 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0777 -5.5778 -2.0571 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1620 -4.0833 -2.0984 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5900 -6.6039 -1.6131 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7581 -6.2295 -0.3231 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4959 -5.5024 0.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7885 -4.8767 -1.6337 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8824 -3.3278 -1.7034 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2829 -4.7427 -2.6913 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7484 -1.7331 -0.4142 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9323 -0.6614 -1.1362 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6600 1.1441 -2.4232 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3861 2.2921 -1.0475 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6646 2.5662 -2.5878 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.9083 3.0468 -3.6017 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.5131 4.9251 0.4346 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9350 4.6881 2.6508 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1127 3.6517 1.4876 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8053 0.5231 1.5504 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2448 -0.5398 -0.7471 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5094 -1.9996 0.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3686 -2.1567 1.3623 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1096 -0.6869 2.4021 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7559 -3.1531 2.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6536 0.7012 1.4522 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7867 1.1885 2.2016 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7879 -0.3222 2.2032 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8331 1.2195 0.5390 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9237 0.6503 -1.8657 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8614 -0.8321 -1.4826 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4663 1.3960 -1.0282 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7918 1.5784 -1.0978 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4586 4.9692 -1.0970 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8751 7.1386 -1.0269 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0720 4.9265 -0.9291 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0962 -0.3177 0.7788 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5797 0.9096 2.4389 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5442 -2.3607 1.9699 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8705 -3.4833 -0.0485 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1471 -3.1671 1.1522 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2379 -3.2438 3.1001 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2864 -4.4084 0.5714 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 1 0 3 5 1 0 5 6 2 0 5 7 1 0 7 8 2 0 8 9 1 0 9 10 1 0 10 11 1 0 11 12 1 0 12 13 1 0 13 14 1 0 14 15 1 0 15 16 2 0 15 17 1 0 17 18 2 0 18 19 1 0 19 20 1 0 19 21 2 0 21 22 1 0 21 23 1 0 23 24 1 0 23 25 2 0 12 26 1 0 26 27 1 0 26 28 1 0 28 29 1 0 28 30 1 0 30 31 1 0 8 32 1 0 32 33 2 0 33 34 1 0 33 35 1 0 35 36 1 0 36 37 1 0 37 38 1 0 38 39 1 0 39 40 1 0 40 41 1 0 41 42 2 0 41 43 1 0 43 44 2 0 44 45 1 0 45 46 1 0 45 47 2 0 47 48 1 0 47 49 1 0 49 50 1 0 49 51 2 0 38 52 1 0 52 53 1 0 52 54 1 0 54 55 1 0 54 56 1 0 56 57 1 0 35 58 2 0 58 59 1 0 58 7 1 0 30 10 1 0 56 36 1 0 25 17 1 0 51 43 1 0 1 60 1 0 1 61 1 0 1 62 1 0 2 63 1 0 2 64 1 0 3 65 1 1 4 66 1 0 4 67 1 0 4 68 1 0 10 69 1 6 12 70 1 6 13 71 1 0 13 72 1 0 18 73 1 0 20 74 1 0 22 75 1 0 24 76 1 0 25 77 1 0 26 78 1 1 27 79 1 0 28 80 1 6 29 81 1 0 30 82 1 1 31 83 1 0 32 84 1 0 34 85 1 0 36 86 1 1 38 87 1 1 39 88 1 0 39 89 1 0 44 90 1 0 46 91 1 0 48 92 1 0 50 93 1 0 51 94 1 0 52 95 1 6 53 96 1 0 54 97 1 1 55 98 1 0 56 99 1 6 57100 1 0 59101 1 0 M END