RDKit 3D 52 55 0 0 0 0 0 0 0 0999 V2000 7.1196 -0.8252 2.6039 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0131 -1.1285 1.1172 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6334 -0.8455 0.5849 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6478 -1.8381 0.5967 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3633 -1.5642 0.1181 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0375 -0.2959 -0.3741 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0167 0.6961 -0.3815 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3044 0.4248 0.0968 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7253 -0.1124 -0.8383 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1163 1.0470 -1.2878 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6458 2.1541 -1.3665 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3307 0.8069 -1.7504 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.9379 2.0276 -2.4152 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3283 3.0707 -1.3986 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1813 4.2645 -1.6595 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9798 2.6615 -0.2618 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.9380 1.4197 0.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1819 0.3463 -0.6001 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2471 -0.9452 -0.2016 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1912 -1.3606 0.9305 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2966 -0.3383 1.2707 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.6727 1.0525 1.3718 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5396 -0.3402 0.3807 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5704 -0.9288 -0.8910 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7309 -0.8971 -1.6693 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8812 -0.2772 -1.1890 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8724 0.3114 0.0721 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7125 0.2790 0.8497 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6002 -1.9371 -0.6398 O 0 0 0 0 0 1 0 0 0 0 0 0 6.9027 0.2282 2.8111 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1312 -1.0400 2.9624 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4176 -1.4331 3.1847 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2713 -2.1787 0.9341 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7510 -0.5345 0.5641 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8652 -2.8316 0.9797 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6082 -2.3492 0.1382 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8053 1.6929 -0.7538 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0452 1.2203 0.0847 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0867 -0.9235 -0.7570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2773 0.0315 -2.5279 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8461 1.7548 -2.9672 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2383 2.4745 -3.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6642 -2.3320 0.7223 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5786 -1.5074 1.8337 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6596 -0.6155 2.2715 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4269 1.8175 1.5908 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9410 1.0822 2.1894 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6890 -1.4208 -1.3002 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7259 -1.3582 -2.6531 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7794 -0.2516 -1.7982 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7648 0.7998 0.4519 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7239 0.7468 1.8316 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 2 0 4 5 1 0 5 6 2 0 6 7 1 0 7 8 2 0 6 9 1 0 9 10 1 0 10 11 2 0 10 12 1 0 12 13 1 0 13 14 1 0 14 15 2 0 14 16 1 0 16 17 2 0 17 18 1 0 18 19 2 0 19 20 1 0 20 21 1 0 21 22 1 0 21 23 1 0 23 24 2 0 24 25 1 0 25 26 2 0 26 27 1 0 27 28 2 0 19 29 1 0 8 3 1 0 18 12 1 0 22 17 1 0 28 23 1 0 1 30 1 0 1 31 1 0 1 32 1 0 2 33 1 0 2 34 1 0 4 35 1 0 5 36 1 0 7 37 1 0 8 38 1 0 9 39 1 0 12 40 1 6 13 41 1 0 13 42 1 0 20 43 1 0 20 44 1 0 21 45 1 1 22 46 1 0 22 47 1 0 24 48 1 0 25 49 1 0 26 50 1 0 27 51 1 0 28 52 1 0 M CHG 1 29 -1 M END