RDKit 3D 89 94 0 0 0 0 0 0 0 0999 V2000 3.1213 3.6592 0.5121 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0316 3.1000 0.9343 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7024 3.1588 2.4132 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0045 2.3804 0.1134 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.3012 3.0678 0.2145 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4455 4.4548 -0.2024 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1381 5.3480 -0.8830 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5493 6.7340 -0.9529 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3596 5.2836 -1.6868 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0009 0.9857 0.6894 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2058 -0.0894 0.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8888 -1.1903 -0.3676 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1929 -2.3138 -0.7683 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1737 -2.4302 -0.6560 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9014 -3.5284 -1.0457 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8372 -1.3275 -0.0996 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1625 -0.2064 0.3097 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1356 0.6735 0.8291 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4081 0.1168 0.7931 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.8532 -0.1581 2.1992 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0160 -0.7267 3.1352 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4390 -0.9855 4.4298 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7272 -0.6821 4.8398 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1438 -0.9411 6.1364 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.5551 -0.1139 3.8929 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1405 0.1464 2.6054 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3130 -1.1894 0.0767 C 0 0 1 0 0 0 0 0 0 0 0 0 -4.0593 -1.2482 -1.1928 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1798 -0.1516 -2.0295 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8919 -0.3179 -3.1987 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0232 0.7839 -4.0654 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.4757 -1.4942 -3.5637 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3638 -2.6103 -2.7288 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9369 -3.8192 -3.0521 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6503 -2.4588 -1.5523 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9012 -3.4542 -1.3373 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2929 -4.3068 -2.0779 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3377 -3.6275 -1.0599 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8975 -2.4636 -0.3124 C 0 0 1 0 0 0 0 0 0 0 0 0 4.2982 -2.5653 0.0195 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7243 -2.8655 1.3150 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0717 -2.8690 1.6802 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0250 -2.5723 0.7516 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4068 -2.5468 1.0259 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6293 -2.2765 -0.5295 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2998 -2.2737 -0.8816 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9537 -1.9849 -2.1703 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9689 -1.7218 -3.1219 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2942 -1.2237 -0.5484 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7592 4.1257 1.2881 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4396 3.6772 -0.4962 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6342 3.1176 2.6281 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1067 4.1034 2.8666 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2278 2.2514 2.8264 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2901 2.3251 -0.9668 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0535 2.5130 -0.4997 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7349 2.9555 1.2519 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4638 4.8832 0.2415 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5944 6.6601 -0.6367 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4170 7.2011 -1.9158 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0067 7.3100 -0.1483 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2355 5.7858 -1.1773 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6750 4.2744 -1.9371 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2666 5.9128 -2.6295 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8175 1.1854 1.8140 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1197 0.7199 0.7279 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7564 -4.3768 -1.4305 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1754 0.7915 0.3572 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9978 -0.9694 2.8036 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7881 -1.4274 5.1465 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5606 -1.8739 6.2608 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5929 0.1396 4.1819 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7816 0.5901 1.8675 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6175 -2.0445 0.7382 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7084 0.7772 -1.7206 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3088 0.8968 -4.7639 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0282 -1.6025 -4.4833 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4782 -4.5576 -3.5858 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6011 -3.3353 -0.9256 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7876 -3.6564 -2.1184 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5384 -4.5843 -0.5460 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3818 -2.7244 0.7670 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0184 -3.1061 2.1088 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3564 -3.1004 2.6816 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7204 -2.7591 1.9787 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4021 -2.0455 -1.2776 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5634 -1.7051 -4.1785 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5882 -0.8550 -2.9509 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6594 -2.6313 -3.1738 H 0 0 0 0 0 0 0 0 0 0 0 0 48 47 1 0 47 46 1 0 46 45 2 0 45 43 1 0 43 44 1 0 43 42 2 0 42 41 1 0 41 40 2 0 40 39 1 0 39 38 1 0 38 36 1 0 36 37 2 0 36 13 1 0 13 14 2 0 14 15 1 0 14 16 1 0 16 17 2 0 17 18 1 0 18 19 1 0 19 27 1 0 27 28 1 0 28 29 2 0 29 30 1 0 30 31 1 0 30 32 2 0 32 33 1 0 33 34 1 0 33 35 2 0 19 20 1 0 20 21 2 0 21 22 1 0 22 23 2 0 23 24 1 0 23 25 1 0 25 26 2 0 17 11 1 0 11 10 1 0 10 4 1 0 4 5 1 0 5 6 1 0 6 7 2 3 7 8 1 0 7 9 1 0 4 2 1 0 2 3 1 0 2 1 2 3 11 12 2 0 12 49 1 0 40 46 1 0 49 39 1 0 12 13 1 0 27 16 1 0 35 28 1 0 26 20 1 0 48 87 1 0 48 88 1 0 48 89 1 0 45 86 1 0 44 85 1 0 42 84 1 0 41 83 1 0 39 82 1 1 38 80 1 0 38 81 1 0 15 67 1 0 19 68 1 6 27 74 1 1 29 75 1 0 31 76 1 0 32 77 1 0 34 78 1 0 35 79 1 0 21 69 1 0 22 70 1 0 24 71 1 0 25 72 1 0 26 73 1 0 10 65 1 0 10 66 1 0 4 55 1 6 5 56 1 0 5 57 1 0 6 58 1 0 8 59 1 0 8 60 1 0 8 61 1 0 9 62 1 0 9 63 1 0 9 64 1 0 3 52 1 0 3 53 1 0 3 54 1 0 1 50 1 0 1 51 1 0 M END