RDKit 3D 57 61 0 0 0 0 0 0 0 0999 V2000 -8.3543 0.7502 2.3117 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0978 1.1024 0.8572 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3003 0.0940 0.2431 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.9373 0.2304 0.2397 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2144 1.2621 0.8311 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8153 1.2981 0.7349 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1257 0.2757 0.0538 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8614 -0.7649 -0.5069 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2648 -0.8003 -0.4325 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7721 -1.8765 -1.2331 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.4426 -0.9013 -0.7782 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7570 0.1948 -0.1137 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1377 -1.2400 -1.0840 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9813 -0.3765 -0.8112 C 0 0 1 0 0 0 0 0 0 0 0 0 2.1284 -1.2928 -1.0169 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8142 -2.4974 -1.5184 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2854 -2.4639 -1.6047 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4116 -3.3825 -2.0163 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4692 -3.5239 -1.8328 O 0 0 0 0 0 1 0 0 0 0 0 0 3.4756 -0.8335 -0.6211 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9589 0.1817 -1.1268 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1971 -1.5011 0.5080 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6708 -2.5697 1.2405 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3780 -3.0934 2.3257 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6104 -2.5467 2.6907 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1502 -1.4740 1.9753 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4442 -0.9607 0.8850 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3625 -1.0240 2.4340 O 0 0 0 0 0 0 0 0 0 0 0 0 7.9427 0.0647 1.7323 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9666 0.8648 -1.6975 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0552 0.7760 -3.0978 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9899 1.9247 -3.8909 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8365 3.1767 -3.2962 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7588 3.2729 -1.9142 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8195 2.1343 -1.1121 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6087 4.5148 -1.3631 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.4230 0.7075 2.8836 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0171 1.4852 2.7775 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8235 -0.2353 2.3864 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6874 2.1078 0.7391 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0542 1.1108 0.3249 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6924 2.0630 1.3827 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2490 2.1056 1.1863 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8223 -1.6093 -0.8944 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9416 -0.0926 0.2478 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7215 -3.0308 0.9711 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9688 -3.9372 2.8758 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1556 -2.9566 3.5364 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8382 -0.1300 0.3077 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2941 0.9546 1.7632 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8765 0.3192 2.2410 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1815 -0.2130 0.6944 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1810 -0.1923 -3.5775 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0690 1.8439 -4.9721 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7811 4.0702 -3.9085 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7358 2.2157 -0.0315 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6125 4.4179 -0.3987 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 2 0 5 6 1 0 6 7 2 0 7 8 1 0 8 9 2 0 8 10 1 0 10 11 1 0 11 12 2 0 11 13 1 0 13 14 1 0 14 15 1 0 15 16 2 0 16 17 1 0 17 18 2 0 16 19 1 0 15 20 1 0 20 21 2 0 20 22 1 0 22 23 2 0 23 24 1 0 24 25 2 0 25 26 1 0 26 27 2 0 26 28 1 0 28 29 1 0 14 30 1 0 30 31 2 0 31 32 1 0 32 33 2 0 33 34 1 0 34 35 2 0 34 36 1 0 9 4 1 0 12 7 1 0 17 13 1 0 27 22 1 0 35 30 1 0 1 37 1 0 1 38 1 0 1 39 1 0 2 40 1 0 2 41 1 0 5 42 1 0 6 43 1 0 9 44 1 0 14 45 1 1 23 46 1 0 24 47 1 0 25 48 1 0 27 49 1 0 29 50 1 0 29 51 1 0 29 52 1 0 31 53 1 0 32 54 1 0 33 55 1 0 35 56 1 0 36 57 1 0 M CHG 1 19 -1 M END