RDKit 3D 103108 0 0 0 0 0 0 0 0999 V2000 4.4978 -5.2552 -1.6790 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6535 -4.2972 -1.1209 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5066 -3.2024 -1.9624 C 0 0 1 0 0 0 0 0 0 0 0 0 2.0416 -3.0489 -2.3174 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7529 -1.7299 -2.9522 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3245 -0.5609 -2.2054 C 0 0 1 0 0 0 0 0 0 0 0 0 1.5567 -0.1972 -1.0755 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0988 1.1092 -1.2223 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2736 1.6151 -0.0624 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.1071 3.0130 -0.3906 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0615 3.8432 -0.5712 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9109 5.1897 -0.8821 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2633 5.6261 -0.9922 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0531 6.0717 -1.0754 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3762 5.7099 -0.9846 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1322 6.8472 -1.2396 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2649 7.8671 -1.4780 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0207 7.3811 -1.3748 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1718 1.5456 1.1540 C 0 0 1 0 0 0 0 0 0 0 0 0 2.3474 2.3113 1.0218 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6257 1.7256 0.9951 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8072 2.5926 0.8552 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6703 0.4911 1.0939 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4689 1.8296 2.4393 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6009 0.7824 2.6719 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.3258 1.2219 3.9289 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5371 0.7311 1.4804 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.4241 1.9380 1.6762 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3969 -0.5514 1.5394 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.5275 -1.7847 1.4755 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5549 -2.3911 0.0893 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6887 -2.4649 -0.5797 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7261 -3.0542 -1.9399 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8837 -1.9395 0.1398 C 0 0 1 0 0 0 0 0 0 0 0 0 -4.3840 -2.9904 0.9792 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6906 -3.2211 2.2153 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5893 -2.3206 3.2389 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1764 -4.5830 2.4477 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5548 -5.1353 3.5075 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1446 -5.1959 1.2194 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6995 -4.2960 0.2859 C 0 0 1 0 0 0 0 0 0 0 0 0 -5.6696 -3.9635 -0.6784 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5114 -0.5858 0.5772 C 0 0 1 0 0 0 0 0 0 0 0 0 -4.8140 0.0754 1.0541 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1874 0.1717 -0.7295 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7985 0.5567 -0.9471 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8486 0.6630 0.1759 C 0 0 1 0 0 0 0 0 0 0 0 0 3.6472 -0.8073 -1.8942 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8963 -1.9527 -1.1876 C 0 0 2 0 0 0 0 0 0 0 0 0 5.3944 -1.9921 -0.9131 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5666 -6.0923 -0.9572 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4972 -4.7874 -1.7917 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1052 -5.5980 -2.6706 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0881 -3.3221 -2.8910 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7843 -3.8555 -3.0441 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4394 -3.1671 -1.4122 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6277 -1.6175 -2.9388 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1017 -1.6671 -4.0034 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3357 0.2962 -2.9287 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9827 1.7386 -1.4304 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5065 1.1096 -2.1818 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7024 3.1963 -1.2696 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6087 3.4740 0.4796 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6983 4.7206 -0.7573 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1995 6.8849 -1.2416 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5414 8.8864 -1.7090 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1645 7.9632 -1.5130 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5067 0.4686 1.2209 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6682 2.2417 1.4905 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1839 2.6844 -0.1768 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5998 3.6315 1.2472 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2366 1.6561 3.2509 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1265 2.8588 2.4541 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0794 -0.1348 2.9069 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1955 2.3063 4.1378 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7976 0.7313 4.7961 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3598 0.8853 3.9926 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7424 2.4332 0.7542 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8767 2.6991 2.2722 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2675 1.6882 2.3579 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8028 -0.5004 2.5719 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4796 -1.6525 1.7095 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8928 -2.5844 2.1517 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6652 -2.7795 -0.3938 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0450 -2.4848 -2.6438 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7318 -3.0608 -2.3871 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3373 -4.0922 -1.9812 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6338 -1.7512 -0.7359 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1619 -2.5720 4.1394 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7877 -4.7085 -0.1883 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5456 -4.2012 -0.2589 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8832 1.1372 0.6968 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9646 0.0958 2.1154 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6945 -0.4086 0.5293 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8398 1.0675 -0.8416 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5238 -0.4331 -1.6303 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7591 1.5380 -1.5175 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3057 -0.1259 -1.7118 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2889 -0.3330 0.2047 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2995 -1.9551 -0.2569 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8666 -2.4180 -1.8308 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7696 -0.9305 -0.8621 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6274 -2.5470 -0.0018 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 5 6 1 0 6 7 1 0 7 8 1 0 9 8 1 6 9 10 1 0 10 11 1 0 11 12 1 0 12 13 2 0 12 14 1 0 14 15 2 0 15 16 1 0 16 17 2 0 17 18 1 0 9 19 1 0 19 24 1 0 24 25 1 0 25 26 1 0 25 27 1 0 27 28 1 6 27 47 1 0 47 46 1 0 46 45 1 0 45 43 1 0 43 44 1 1 43 29 1 0 29 30 1 0 30 31 1 0 31 32 2 0 32 33 1 0 32 34 1 0 34 35 1 0 35 36 2 0 36 37 1 0 36 38 1 0 38 39 2 0 38 40 1 0 40 41 1 0 41 42 1 0 19 20 1 0 20 21 1 0 21 22 1 0 21 23 2 0 6 48 1 0 48 49 1 0 49 50 1 0 49 3 1 0 47 9 1 0 34 43 1 0 41 35 1 0 18 14 1 0 29 27 1 0 1 51 1 0 1 52 1 0 1 53 1 0 3 54 1 6 4 55 1 0 4 56 1 0 5 57 1 0 5 58 1 0 6 59 1 6 8 60 1 0 8 61 1 0 10 62 1 0 10 63 1 0 15 64 1 0 16 65 1 0 17 66 1 0 18 67 1 0 19 68 1 1 24 72 1 0 24 73 1 0 25 74 1 1 26 75 1 0 26 76 1 0 26 77 1 0 28 78 1 0 28 79 1 0 28 80 1 0 47 99 1 1 46 97 1 0 46 98 1 0 45 95 1 0 45 96 1 0 44 92 1 0 44 93 1 0 44 94 1 0 29 81 1 1 30 82 1 0 30 83 1 0 31 84 1 0 33 85 1 0 33 86 1 0 33 87 1 0 34 88 1 6 37 89 1 0 41 90 1 6 42 91 1 0 22 69 1 0 22 70 1 0 22 71 1 0 49100 1 1 50101 1 0 50102 1 0 50103 1 0 M END