RDKit 3D 46 50 0 0 0 0 0 0 0 0999 V2000 -4.0539 0.5157 -2.3889 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2952 1.3632 -1.5100 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6511 0.8544 -0.4442 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7398 -0.5103 -0.1605 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.4812 -1.3885 -0.9572 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6373 -2.5886 -0.7425 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1478 -0.7952 -2.1466 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1042 -1.0927 1.0309 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2866 -0.1479 1.9303 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.9189 1.2405 1.9064 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8357 1.7468 0.4725 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.3639 1.8249 0.0059 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3314 0.5285 0.1631 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2197 -0.0246 1.5507 C 0 0 2 0 0 0 0 0 0 0 0 0 0.9878 -1.3284 1.6986 C 0 0 1 0 0 0 0 0 0 0 0 0 2.4542 -1.0737 1.3949 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6056 -0.4057 0.0498 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5579 0.3649 -0.5013 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7721 0.8947 -1.7888 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9854 0.7425 -2.4710 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0213 0.0272 -1.8741 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8377 -0.5513 -0.6193 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2991 -0.1277 -2.5765 N 0 0 0 0 0 4 0 0 0 0 0 0 6.2054 -0.7559 -2.0101 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4064 0.3873 -3.7009 O 0 0 0 0 0 1 0 0 0 0 0 0 1.0108 -1.8371 3.1388 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9557 -0.9577 4.0437 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0845 -3.0924 3.2550 O 0 0 0 0 0 1 0 0 0 0 0 0 -4.5375 0.9604 -3.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2462 2.4205 -1.7490 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7032 -1.4750 -2.7778 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5258 -1.9675 0.7177 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9324 -1.4914 1.6340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3536 -0.5295 2.9558 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9607 1.1973 2.2487 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3887 1.9190 2.5858 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2519 2.7629 0.4487 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1648 2.5864 0.5948 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3715 2.1764 -1.0298 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6660 0.7245 2.2234 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6013 -2.1014 1.0241 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9991 -2.0271 1.3969 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9243 -0.4295 2.1502 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9766 1.4145 -2.3126 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0907 1.1774 -3.4614 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6294 -1.1305 -0.1473 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 2 0 3 4 1 0 4 5 1 0 5 6 2 0 5 7 1 0 4 8 1 0 8 9 1 0 9 10 1 0 10 11 1 0 11 12 1 0 12 13 1 0 13 14 1 0 14 15 1 0 15 16 1 0 16 17 1 0 17 18 2 0 18 19 1 0 19 20 2 0 20 21 1 0 21 22 2 0 21 23 1 0 23 24 2 0 23 25 1 0 15 26 1 0 26 27 2 0 26 28 1 0 7 1 2 0 11 3 1 0 14 9 1 0 18 13 1 0 22 17 1 0 1 29 1 0 2 30 1 0 7 31 1 0 8 32 1 0 8 33 1 0 9 34 1 1 10 35 1 0 10 36 1 0 11 37 1 1 12 38 1 0 12 39 1 0 14 40 1 1 15 41 1 6 16 42 1 0 16 43 1 0 19 44 1 0 20 45 1 0 22 46 1 0 M CHG 3 23 1 25 -1 28 -1 M END