RDKit 3D 79 81 0 0 0 0 0 0 0 0999 V2000 0.7672 4.4729 -3.0839 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1588 3.0309 -2.7810 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0212 2.2475 -2.2725 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3390 2.2281 -0.9122 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5937 1.8490 -0.5897 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6053 1.3779 -1.5844 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.9584 1.1284 -2.8510 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8128 1.7250 -3.2676 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5421 1.7447 -4.4642 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3312 0.1207 -1.1287 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6048 0.2177 -0.5493 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2537 -0.9191 -0.0592 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6484 -2.1807 -0.1329 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3790 -2.2795 -0.7170 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7260 -1.1450 -1.2059 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3318 -3.4279 0.4027 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5419 -3.3440 1.9179 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6529 -3.7042 -0.3203 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1269 2.0126 0.7748 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9070 2.9000 1.0677 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5814 1.0875 1.6022 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1671 1.0325 2.9140 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4828 2.0217 3.8400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6862 2.6241 0.1366 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8560 1.6346 0.2233 N 0 0 0 0 0 4 0 0 0 0 0 0 3.0036 2.2409 0.9853 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1238 1.2681 1.3292 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4866 0.2880 0.2224 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6712 -0.9303 0.2841 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2387 -0.8369 -0.0366 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4464 0.2490 0.7092 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1863 -2.2309 0.4105 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4333 -3.2073 0.3537 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6921 -2.4289 0.6014 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9843 -3.8130 1.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4304 -2.2797 -0.7316 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0398 4.5200 -3.8222 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6275 5.0205 -3.4813 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4240 4.9877 -2.1806 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5398 2.5649 -3.6970 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9943 3.0188 -2.0786 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3351 2.1774 -1.7713 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5453 0.8175 -3.6168 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1039 1.1817 -0.4597 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2413 -0.8099 0.3853 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8876 -3.2481 -0.7971 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7405 -1.2642 -1.6519 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6775 -4.2908 0.2165 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9545 -4.2828 2.3031 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2323 -2.5391 2.1902 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5943 -3.1573 2.4355 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0845 -4.6526 0.0188 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4996 -3.7749 -1.4035 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3920 -2.9156 -0.1383 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2501 1.2019 2.8716 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0175 0.0137 3.2857 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9034 1.9614 4.8471 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5921 3.0493 3.4743 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4100 1.8125 3.8973 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2834 2.7031 1.1513 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1112 3.6054 -0.1046 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1547 1.4993 -0.7487 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3901 3.0521 0.3551 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5977 2.6800 1.9057 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0094 1.8728 1.5711 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8806 0.7264 2.2526 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3738 0.7256 -0.7754 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5435 0.0523 0.3391 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7346 -1.7845 0.1737 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1656 -0.6858 -1.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5659 0.2110 1.7972 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3933 0.1034 0.4669 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0575 -1.6912 1.3243 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0537 -3.9289 1.3966 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4418 -3.9582 2.1339 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6806 -4.6159 0.5081 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1537 -3.0758 -1.4354 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2089 -1.3316 -1.2309 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5157 -2.3263 -0.5742 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 4 5 2 0 5 6 1 0 6 7 1 0 7 8 1 0 8 9 2 0 6 10 1 0 10 11 2 0 11 12 1 0 12 13 2 0 13 14 1 0 14 15 2 0 13 16 1 0 16 17 1 0 16 18 1 0 5 19 1 0 19 20 2 0 19 21 1 0 21 22 1 0 22 23 1 0 4 24 1 0 24 25 1 0 25 26 1 0 26 27 1 0 27 28 1 0 28 29 1 0 29 30 1 0 30 31 1 0 29 32 1 0 32 33 2 0 32 34 1 0 34 35 1 0 34 36 1 0 8 3 1 0 15 10 1 0 31 25 1 0 1 37 1 0 1 38 1 0 1 39 1 0 2 40 1 0 2 41 1 0 6 42 1 6 7 43 1 0 11 44 1 0 12 45 1 0 14 46 1 0 15 47 1 0 16 48 1 0 17 49 1 0 17 50 1 0 17 51 1 0 18 52 1 0 18 53 1 0 18 54 1 0 22 55 1 0 22 56 1 0 23 57 1 0 23 58 1 0 23 59 1 0 24 60 1 0 24 61 1 0 25 62 1 0 26 63 1 0 26 64 1 0 27 65 1 0 27 66 1 0 28 67 1 0 28 68 1 0 30 69 1 0 30 70 1 0 31 71 1 0 31 72 1 0 34 73 1 0 35 74 1 0 35 75 1 0 35 76 1 0 36 77 1 0 36 78 1 0 36 79 1 0 M CHG 1 25 1 M END