RDKit 3D 58 61 0 0 0 0 0 0 0 0999 V2000 3.3833 5.3873 0.2789 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5562 4.2677 -0.0099 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1866 3.0880 -0.3019 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5608 2.9189 -0.4758 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0846 1.6564 -0.7684 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2391 0.5533 -0.8914 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8503 0.7177 -0.7196 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3366 1.9857 -0.4328 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0584 -0.4509 -0.8152 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6983 -0.5793 -0.6889 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1011 0.3553 -0.6276 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1971 -1.9660 -0.6135 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8997 -3.2120 -0.6263 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0576 -4.2863 -0.5205 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5533 -3.8878 -0.3636 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.1697 -2.2242 -0.4566 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1775 -1.2694 -0.4509 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.4080 -1.4092 0.1445 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8181 -2.3226 0.8590 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3511 -0.2370 -0.1116 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4898 -0.2816 0.8777 N 0 0 0 0 0 4 0 0 0 0 0 0 -5.2502 0.4612 2.1505 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4369 1.9244 1.9824 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1366 3.0196 2.7621 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5779 4.1550 2.0421 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1162 3.6835 0.8688 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0400 2.3298 0.8240 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7247 -5.6082 -0.5588 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2107 -5.1954 -0.3712 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3109 -3.6809 -0.7313 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6476 -0.7289 -1.1677 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9945 -0.8803 -1.6084 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9784 5.6747 -0.5937 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7288 6.2295 0.5268 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0209 5.1929 1.1455 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2504 3.7513 -0.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1603 1.5720 -0.8911 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2752 2.1512 -0.2901 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6115 -1.2788 -0.9750 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8323 -0.3266 -0.6524 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8463 0.7288 -0.0412 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7970 -0.3592 -1.1007 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6448 -1.2815 1.1047 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3448 0.0925 0.4479 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9827 0.0735 2.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2445 0.2128 2.5034 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6573 3.0117 3.7337 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5104 5.1926 2.3372 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5736 4.1622 0.0125 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3955 -6.2804 0.2367 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5763 -6.0887 -1.5306 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4907 -5.3331 0.6804 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8904 -5.8096 -0.9683 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6810 -3.5534 -1.7534 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9748 -3.1715 -0.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6969 -0.6828 -0.7917 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2076 -0.2443 -2.4743 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1241 -1.9192 -1.9180 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 7 9 1 0 9 10 1 0 10 11 2 0 10 12 1 0 12 13 1 0 13 14 2 0 14 15 1 0 15 16 1 0 16 17 1 0 17 18 1 0 18 19 2 0 18 20 1 0 20 21 1 0 21 22 1 0 22 23 1 0 23 24 2 0 24 25 1 0 25 26 2 0 26 27 1 0 14 28 1 0 28 29 1 0 29 30 1 0 6 31 1 0 31 32 1 0 8 3 1 0 16 12 2 0 30 13 1 0 27 23 1 0 1 33 1 0 1 34 1 0 1 35 1 0 4 36 1 0 5 37 1 0 8 38 1 0 9 39 1 0 17 40 1 0 20 41 1 0 20 42 1 0 21 43 1 0 21 44 1 0 22 45 1 0 22 46 1 0 24 47 1 0 25 48 1 0 26 49 1 0 28 50 1 0 28 51 1 0 29 52 1 0 29 53 1 0 30 54 1 0 30 55 1 0 32 56 1 0 32 57 1 0 32 58 1 0 M CHG 1 21 1 M END