RDKit 3D 48 50 0 0 0 0 0 0 0 0999 V2000 -4.7098 3.1157 -2.7524 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8046 2.0163 -2.2206 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4112 2.2719 -0.7636 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5209 1.2151 -0.2704 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1417 1.2868 -0.3575 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2718 0.3445 0.0398 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8600 -0.8898 0.6177 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1528 -1.8127 1.0167 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3334 -0.9965 0.6982 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1371 0.0549 0.2471 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4905 -0.0327 0.3044 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.0576 -1.1559 0.8106 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3108 -2.2306 1.2764 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9257 -2.1494 1.2185 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5555 -1.2059 0.8551 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1945 0.6018 -0.1281 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5696 1.6428 -0.6616 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0002 -0.4068 0.3510 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4093 -0.4643 0.3691 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2431 0.5540 -0.0919 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6356 0.4130 -0.0294 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2166 -0.7494 0.4892 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3779 -1.7665 0.9547 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9888 -1.6243 0.8972 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7162 -0.9126 0.5339 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2698 -0.9378 1.9595 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2924 -2.0773 2.5125 O 0 0 0 0 0 0 0 0 0 0 0 0 8.6862 0.1725 2.4011 O 0 0 0 0 0 1 0 0 0 0 0 0 -5.6350 3.1771 -2.1706 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9768 2.9157 -3.7949 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2113 4.0893 -2.7103 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3185 1.0527 -2.3148 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9053 1.9560 -2.8453 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3018 2.3796 -0.1314 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8960 3.2396 -0.6963 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7859 2.2188 -0.7945 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7927 -3.1166 1.6771 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3134 -2.9745 1.5739 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8996 -1.3196 1.8878 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9237 -2.0458 0.2579 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9881 -0.2849 0.4510 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5295 -1.2197 0.7497 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8481 1.4789 -0.4965 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2697 1.2247 -0.3785 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8148 -2.6681 1.3826 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3735 -2.4338 1.2793 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2054 -0.1049 -0.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9900 -1.8413 0.0172 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 2 0 6 7 1 0 7 8 2 0 7 9 1 0 9 10 2 0 10 11 1 0 11 12 2 0 12 13 1 0 13 14 2 0 12 15 1 0 6 16 1 0 16 17 2 0 16 18 1 0 18 19 1 0 19 20 2 0 20 21 1 0 21 22 2 0 22 23 1 0 23 24 2 0 22 25 1 0 25 26 1 0 26 27 2 0 26 28 1 0 10 4 1 0 14 9 1 0 24 19 1 0 1 29 1 0 1 30 1 0 1 31 1 0 2 32 1 0 2 33 1 0 3 34 1 0 3 35 1 0 5 36 1 0 13 37 1 0 14 38 1 0 15 39 1 0 15 40 1 0 15 41 1 0 18 42 1 0 20 43 1 0 21 44 1 0 23 45 1 0 24 46 1 0 25 47 1 0 25 48 1 0 M CHG 1 28 -1 M END