RDKit 3D 92 96 0 0 0 0 0 0 0 0999 V2000 0.6087 2.7926 1.2629 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9877 1.5165 0.9009 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4247 1.3957 -0.4056 C 0 0 1 0 0 0 0 0 0 0 0 0 2.9039 1.3313 -0.5252 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5714 2.0212 -1.6550 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6476 0.6597 0.3283 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1269 0.6205 0.1796 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8786 -0.0535 1.0227 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3465 -0.1433 0.9526 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0675 0.5766 -0.1165 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0262 -0.8413 1.8197 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4675 -0.9843 1.8278 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1719 -2.1673 2.0752 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4527 -1.8930 2.0114 O 0 0 0 0 0 0 0 0 0 0 0 0 11.6368 -0.6228 1.7410 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9408 0.1156 1.5789 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4274 -0.0523 1.6254 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6193 0.5994 -1.3340 C 0 0 1 0 0 0 0 0 0 0 0 0 1.2099 0.5062 -2.6904 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0150 -0.6793 -0.8244 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.7200 -1.4474 -1.9076 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0126 -0.9575 -2.3723 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.2000 0.3872 -2.2567 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2262 -1.6931 -1.8291 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.2537 -3.1791 -1.7589 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9958 -0.9434 -0.9804 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4621 -1.0152 -2.2882 C 0 0 2 0 0 0 0 0 0 0 0 0 -5.6208 -1.8874 -2.4985 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8508 -1.5758 -2.0659 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0802 -0.2739 -1.3802 C 0 0 1 0 0 0 0 0 0 0 0 0 -8.4360 0.3150 -1.7123 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8803 -0.4042 0.0846 C 0 0 1 0 0 0 0 0 0 0 0 0 -6.1294 0.7586 0.7206 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4455 0.1504 1.9539 C 0 0 2 0 0 0 0 0 0 0 0 0 -6.5691 -0.3388 2.8454 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9022 -0.2604 2.2010 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8920 0.0044 2.9207 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.1096 -0.4669 0.8343 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5440 1.1166 2.6260 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0869 0.7902 2.6138 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.1911 1.8692 2.3751 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3223 0.8368 1.4462 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.1816 -0.1569 1.3841 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7169 -0.4094 2.5576 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7792 -0.6501 0.2552 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4985 3.4547 1.1254 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2863 3.1625 0.7446 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4666 2.7615 2.3845 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2519 2.5140 -0.7774 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8949 1.3926 -2.4716 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9040 2.8874 -1.9702 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4902 2.5901 -1.3033 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2367 0.1188 1.1542 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6048 1.1353 -0.6317 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3864 -0.5833 1.8282 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3650 -0.1175 -0.9480 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4945 1.3914 -0.5980 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0189 1.0533 0.2203 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4323 -1.3534 2.5930 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7375 -3.1431 2.2839 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9064 0.6361 0.5927 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7922 -0.5706 1.5569 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0313 0.8709 2.3914 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3337 1.2611 -1.5069 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4918 0.1099 -3.4584 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0982 -0.1463 -2.7853 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4873 1.4988 -3.0909 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9031 -1.3453 -0.5856 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0530 -1.6915 -2.7610 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8983 -2.4698 -1.4315 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0713 -1.1711 -3.4982 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0034 0.7082 -1.8278 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2979 -3.4940 -1.5556 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0077 -3.6584 -2.7521 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6464 -3.6100 -0.9448 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4246 -0.1526 -2.9666 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5410 -2.8381 -3.0239 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6851 -2.2593 -2.2065 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3216 0.4330 -1.7924 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2134 -0.0322 -0.9793 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7405 0.1496 -2.7485 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3389 1.4165 -1.5490 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3757 -1.3871 0.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8098 1.5479 1.0969 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3932 1.1988 0.0226 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8905 -0.7399 1.5994 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5447 0.2772 3.7542 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4273 -1.4093 3.1251 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9130 1.2631 3.6821 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6826 2.1130 2.1212 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7550 0.2271 3.5324 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7599 1.1742 0.4894 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 1 0 4 6 2 0 6 7 1 0 7 8 2 0 8 9 1 0 9 10 1 0 9 11 2 0 11 12 1 0 12 13 2 0 13 14 1 0 14 15 1 0 15 16 1 0 15 17 2 0 3 18 1 0 18 19 1 0 18 20 1 0 20 21 1 0 21 22 1 0 22 23 1 0 22 24 1 0 24 25 1 1 24 26 1 0 26 27 1 0 27 28 1 0 28 29 2 0 29 30 1 0 30 31 1 0 30 32 1 0 32 33 1 0 33 34 1 0 34 35 1 0 35 36 1 0 36 37 2 0 36 38 1 0 34 39 1 0 39 40 1 0 40 41 1 0 41 42 1 0 42 43 1 0 43 44 2 0 43 45 1 0 17 12 1 0 45 20 1 0 27 24 1 0 38 32 1 0 42 40 1 0 1 46 1 0 1 47 1 0 1 48 1 0 3 49 1 6 5 50 1 0 5 51 1 0 5 52 1 0 6 53 1 0 7 54 1 0 8 55 1 0 10 56 1 0 10 57 1 0 10 58 1 0 11 59 1 0 13 60 1 0 16 61 1 0 16 62 1 0 16 63 1 0 18 64 1 6 19 65 1 0 19 66 1 0 19 67 1 0 20 68 1 1 21 69 1 0 21 70 1 0 22 71 1 6 23 72 1 0 25 73 1 0 25 74 1 0 25 75 1 0 27 76 1 6 28 77 1 0 29 78 1 0 30 79 1 6 31 80 1 0 31 81 1 0 31 82 1 0 32 83 1 6 33 84 1 0 33 85 1 0 34 86 1 6 35 87 1 0 35 88 1 0 39 89 1 0 39 90 1 0 40 91 1 1 42 92 1 6 M END