RDKit 3D 83 86 0 0 0 0 0 0 0 0999 V2000 -0.0262 -4.0235 2.1638 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9754 -3.6363 1.0961 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8736 -4.8295 0.6861 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4058 -2.9695 -0.1152 C 0 0 2 0 0 0 0 0 0 0 0 0 0.5303 -3.8469 -0.7213 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8954 -3.4212 -0.9232 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2820 -2.6188 -1.9580 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6498 -2.2345 -2.0757 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6522 -2.6209 -1.2007 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2463 -3.4409 -0.1588 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8910 -3.8094 -0.0576 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0633 -2.1009 -1.3118 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2903 -0.9263 -0.6256 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2080 -0.1374 -0.4219 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0520 0.0546 -0.1510 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2516 0.7906 -1.0632 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2353 -0.3681 1.0600 C 0 0 1 0 0 0 0 0 0 0 0 0 3.5652 0.7998 2.0351 C 0 0 2 0 0 0 0 0 0 0 0 0 2.8855 0.5238 3.2073 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3009 2.1029 1.4395 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3463 2.8673 0.9742 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1547 4.1125 0.3985 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8764 4.6149 0.2833 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8125 3.8721 0.7396 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0327 2.6216 1.3147 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8859 -0.5015 0.8067 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7811 -0.9735 0.9796 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1403 -1.0280 2.2526 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1311 -1.5701 -0.0253 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.4062 -0.8407 0.1236 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.7699 0.1221 -0.6276 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9573 0.5788 -1.6916 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0563 0.8506 -0.4703 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.9046 0.7629 -1.7068 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1937 1.4898 -1.5417 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3528 2.8073 -1.9078 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5508 3.4583 -1.7322 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6459 2.8200 -1.1819 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4701 1.5016 -0.8203 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2848 0.8339 -0.9866 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9413 2.1470 0.0749 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1950 3.1195 -0.6193 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1188 2.2979 1.4710 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3706 -3.6617 3.1796 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9639 -3.5661 2.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0589 -5.1349 2.3013 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7111 -2.9289 1.5446 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1177 -5.4038 1.6171 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3294 -5.4566 -0.0533 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7993 -4.4987 0.2208 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2839 -3.0762 -0.8824 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6357 -2.2094 -2.7959 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6630 -1.5808 -2.9979 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8300 -3.9094 0.7012 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7842 -4.4808 0.8394 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9541 -2.5055 -1.8567 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3240 -0.8131 -0.3445 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4652 0.3728 -1.5169 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7820 -1.2185 1.5290 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6556 0.6578 2.2877 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2727 1.2574 3.4723 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3419 2.4648 1.0667 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9974 4.6764 0.0507 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7189 5.5976 -0.1694 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8315 4.3088 0.6254 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1790 2.0837 1.6547 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5589 -0.3879 2.5402 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2605 -1.2002 -1.0275 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1117 1.1103 -1.4341 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6309 0.2456 0.3050 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3427 1.1998 -2.5457 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1564 -0.2962 -1.9423 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5099 3.3188 -2.3432 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6758 4.5007 -2.0249 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6074 3.3313 -1.0349 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3322 0.9751 -0.3825 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1674 -0.2080 -0.6939 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8386 4.0293 -0.7728 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9396 2.7394 -1.6127 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3069 3.4308 -0.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2202 1.2922 1.9424 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1278 2.7792 1.6392 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3498 2.9133 1.9788 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 2 4 1 0 4 5 1 0 5 6 1 0 6 7 2 0 7 8 1 0 8 9 2 0 9 10 1 0 10 11 2 0 9 12 1 0 12 13 2 0 13 14 1 0 14 15 2 0 15 16 1 0 15 17 1 0 17 26 1 0 26 27 2 0 27 28 1 0 27 29 1 0 29 30 1 0 30 31 2 0 31 32 1 0 31 33 1 0 33 34 1 0 34 35 1 0 35 36 2 0 36 37 1 0 37 38 2 0 38 39 1 0 39 40 2 0 33 41 1 0 41 42 1 0 41 43 1 0 17 18 1 0 18 19 1 0 18 20 1 0 20 21 2 0 21 22 1 0 22 23 2 0 23 24 1 0 24 25 2 0 29 4 1 0 40 35 1 0 25 20 1 0 11 6 1 0 1 44 1 0 1 45 1 0 1 46 1 0 2 47 1 0 3 48 1 0 3 49 1 0 3 50 1 0 4 51 1 6 7 52 1 0 8 53 1 0 10 54 1 0 11 55 1 0 12 56 1 0 13 57 1 0 16 58 1 0 17 59 1 1 28 67 1 0 29 68 1 6 32 69 1 0 33 70 1 1 34 71 1 0 34 72 1 0 36 73 1 0 37 74 1 0 38 75 1 0 39 76 1 0 40 77 1 0 42 78 1 0 42 79 1 0 42 80 1 0 43 81 1 0 43 82 1 0 43 83 1 0 18 60 1 1 19 61 1 0 21 62 1 0 22 63 1 0 23 64 1 0 24 65 1 0 25 66 1 0 M END