RDKit 3D 81 85 0 0 0 0 0 0 0 0999 V2000 -1.3869 -0.6074 4.1189 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5813 -1.2391 3.0282 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3797 -2.4710 3.0563 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0490 -0.5084 1.9856 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7025 -1.0663 0.9591 C 0 0 2 0 0 0 0 0 0 0 0 0 2.1332 -0.4985 0.9719 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3687 -0.0955 -0.4806 C 0 0 2 0 0 0 0 0 0 0 0 0 3.4818 0.8510 -0.6446 C 0 0 2 0 0 0 0 0 0 0 0 0 3.7793 1.2679 -2.0571 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7801 0.4319 -0.0101 C 0 0 1 0 0 0 0 0 0 0 0 0 5.4491 -0.7130 -0.7098 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9174 -0.7339 -0.4958 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6412 0.2824 -0.0849 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1117 0.2099 0.1142 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9743 1.5450 0.1906 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5876 2.5795 0.5904 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6034 1.5946 -0.0004 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9913 0.3892 -0.8215 C 0 0 1 0 0 0 0 0 0 0 0 0 0.5526 1.5565 0.0157 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6923 0.6996 -2.2268 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7652 1.1306 -2.3277 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5789 0.5470 -1.2314 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2167 -0.5501 -0.5832 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1263 -1.5402 0.0111 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1607 -0.8570 0.8636 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3109 -0.3681 0.0044 C 0 0 2 0 0 0 0 0 0 0 0 0 -4.3177 -1.1671 -1.1645 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9758 0.9927 -0.4565 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7861 1.3259 -0.9806 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7322 2.2487 -0.4907 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7132 2.5862 0.3325 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2457 1.7708 1.4502 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9838 2.3537 2.2896 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.9762 0.4188 1.6168 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.6500 -0.5276 0.6221 C 0 0 2 0 0 0 0 0 0 0 0 0 -5.7874 -1.9459 1.1395 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6769 -0.4145 -0.5131 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1939 -0.8662 -0.4293 C 0 0 2 0 0 0 0 0 0 0 0 0 0.4837 -2.0376 -1.3306 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4528 -0.5875 3.7964 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0101 0.4061 4.3339 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2513 -1.2171 5.0254 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7475 -2.1744 1.1493 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7958 -1.3007 1.2902 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1166 0.3807 1.6113 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5746 -1.0139 -1.0301 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1995 1.7982 -0.0903 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5065 2.3216 -2.2362 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3316 0.5682 -2.8231 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8728 1.2186 -2.2884 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6561 0.1449 1.0542 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2715 -0.7478 -1.7855 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0685 -1.6975 -0.3064 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4354 -1.6597 -0.6936 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5394 -0.7420 -0.1982 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6171 1.0573 -0.4160 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3045 0.3446 1.2095 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3132 1.3590 0.6745 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2092 2.4295 -0.6196 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3307 1.9899 0.6603 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9096 -0.0444 -2.9855 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2654 1.6468 -2.4825 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8901 2.2308 -2.3338 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1850 0.7528 -3.2815 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7047 -2.1067 -0.7658 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6024 -2.3258 0.5850 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5021 -1.5528 1.6535 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7144 0.0209 1.3466 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9562 -1.8997 -1.1148 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7589 2.3893 -1.2631 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4568 2.9406 -1.2445 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1888 3.5535 0.1938 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0048 -2.6209 0.7911 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7796 -2.3705 0.9068 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7422 -1.8576 2.2647 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4360 -1.2209 -0.4636 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2037 -0.3338 -1.4984 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2600 0.5376 -0.3764 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4511 -2.4885 -1.7194 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1386 -1.8599 -2.1689 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9300 -2.8427 -0.6822 H 0 0 0 0 0 0 0 0 0 0 0 0 9 8 1 0 8 7 1 0 7 6 1 0 6 5 1 0 5 4 1 0 4 2 1 0 2 1 1 0 2 3 2 0 5 38 1 0 38 39 1 6 38 23 1 0 23 22 2 0 22 21 1 0 21 20 1 0 20 18 1 0 18 19 1 1 22 29 1 0 29 28 2 0 28 30 1 0 30 31 2 0 31 32 1 0 32 33 2 0 32 34 1 0 34 35 1 0 35 36 1 1 35 37 1 0 35 26 1 0 26 27 1 6 26 25 1 0 25 24 1 0 8 10 1 0 10 11 1 0 11 12 1 0 12 13 2 0 13 14 1 0 13 15 1 0 15 16 2 0 15 17 1 0 18 7 1 0 26 28 1 0 17 10 1 0 18 38 1 0 24 23 1 0 9 48 1 0 9 49 1 0 9 50 1 0 8 47 1 1 7 46 1 6 6 44 1 0 6 45 1 0 5 43 1 1 1 40 1 0 1 41 1 0 1 42 1 0 39 79 1 0 39 80 1 0 39 81 1 0 21 63 1 0 21 64 1 0 20 61 1 0 20 62 1 0 19 58 1 0 19 59 1 0 19 60 1 0 29 70 1 0 30 71 1 0 31 72 1 0 36 73 1 0 36 74 1 0 36 75 1 0 37 76 1 0 37 77 1 0 37 78 1 0 27 69 1 0 25 67 1 0 25 68 1 0 24 65 1 0 24 66 1 0 10 51 1 1 11 52 1 0 11 53 1 0 12 54 1 0 14 55 1 0 14 56 1 0 14 57 1 0 M END