RDKit 3D 69 73 0 0 0 0 0 0 0 0999 V2000 6.1223 3.5961 0.0233 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0108 1.8105 0.2919 S 0 0 0 0 0 0 0 0 0 0 0 0 4.6015 1.1562 -0.6441 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4849 -0.3398 -0.4312 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2821 -0.6505 1.0277 C 0 0 2 0 0 0 0 0 0 0 0 0 4.1682 -2.0471 1.3226 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2023 -3.1422 0.4577 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0361 -4.0826 0.7165 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3439 -3.3177 -0.7549 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8130 -3.8393 -1.9447 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4006 -3.7994 -2.9266 S 0 0 0 0 0 0 0 0 0 0 0 0 1.3269 -3.1375 -1.7884 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0802 -2.9796 -0.7313 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1289 -2.7347 -1.7062 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5380 -2.6386 -0.3234 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.8043 -2.9315 0.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8612 -3.7102 1.2309 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1174 -2.4462 -0.2537 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.4630 -1.3426 0.6633 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.7469 -0.3526 0.1875 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7268 -0.4286 -1.2003 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1362 -1.7372 -1.5531 C 0 0 2 0 0 0 0 0 0 0 0 0 -4.6012 -1.6486 -1.9932 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1309 0.6019 1.1435 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.2178 1.4293 1.8243 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9683 2.1797 0.7986 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5371 3.4334 0.4396 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2265 4.1672 -0.5246 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3378 3.5939 -1.0924 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7729 2.3331 -0.7325 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0774 1.6158 0.2272 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2305 1.4794 0.4012 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1452 1.5719 0.6411 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7941 2.5211 0.1242 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9377 0.6172 1.4806 C 0 0 2 0 0 0 0 0 0 0 0 0 1.1072 1.3426 2.8261 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7150 0.5603 3.2805 S 0 0 0 0 0 0 0 0 0 0 0 0 3.1381 0.0650 1.6180 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1932 0.4663 0.8866 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3493 3.8602 -1.0293 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2124 4.1247 0.3782 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9677 3.9586 0.6587 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6799 1.7123 -0.4621 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8528 1.3421 -1.7299 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5521 -0.6341 -0.9660 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3697 -0.7976 -0.8629 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2586 -0.3317 1.5154 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0501 -2.2449 2.3688 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8277 -4.1966 -2.2101 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6544 -3.5353 -2.2687 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2555 -1.7378 -2.1714 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2239 -2.3098 0.3406 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8747 -3.2533 -0.1666 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6017 -2.1753 -2.3843 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1889 -1.1845 -1.1564 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6155 -0.9485 -2.8518 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0006 -2.6414 -2.2528 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5954 0.0787 1.9601 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8721 0.7128 2.3679 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7741 2.0859 2.5938 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6621 3.8934 0.8816 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8732 5.1331 -0.7838 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8926 4.1382 -1.8424 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6367 1.8744 -1.1662 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4389 0.6267 0.4942 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6400 2.0724 -0.3533 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3862 -0.3243 1.6745 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2316 2.4150 2.6613 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3342 1.0519 3.5381 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 2 0 7 9 1 0 9 10 2 0 10 11 1 0 11 12 1 0 12 13 2 0 12 14 1 0 14 15 1 0 15 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 1 0 22 23 1 0 20 24 1 0 24 25 1 0 25 26 1 0 26 27 2 0 27 28 1 0 28 29 2 0 29 30 1 0 30 31 2 0 24 32 1 0 32 33 1 0 33 34 2 0 33 35 1 0 35 36 1 0 36 37 1 0 37 38 1 0 38 39 2 0 38 5 1 0 13 9 1 0 22 18 1 0 31 26 1 0 39 35 1 0 1 40 1 0 1 41 1 0 1 42 1 0 3 43 1 0 3 44 1 0 4 45 1 0 4 46 1 0 5 47 1 1 6 48 1 0 10 49 1 0 14 50 1 0 14 51 1 0 15 52 1 0 18 53 1 6 22 54 1 6 23 55 1 0 23 56 1 0 23 57 1 0 24 58 1 1 25 59 1 0 25 60 1 0 27 61 1 0 28 62 1 0 29 63 1 0 30 64 1 0 31 65 1 0 32 66 1 0 35 67 1 1 36 68 1 0 36 69 1 0 M END