RDKit 3D 51 54 0 0 0 0 0 0 0 0999 V2000 4.9615 -2.2696 -0.3846 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6214 -1.0450 0.1891 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0225 -0.9728 0.1492 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6920 0.1331 0.6673 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9854 1.1974 1.2417 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5779 1.1277 1.2739 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8866 0.0241 0.7539 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4759 -0.0815 0.7920 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5495 0.8741 1.1744 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7578 2.0413 1.4863 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1315 0.3300 1.1817 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5404 0.1310 -0.5261 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.1730 -0.0304 -0.1901 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4959 -0.8770 0.7336 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.8213 -1.0167 0.9525 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8530 -0.3633 0.3069 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1423 -0.8322 0.7655 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9901 -1.7399 1.8001 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3630 -2.0942 2.1505 S 0 0 0 0 0 0 0 0 0 0 0 0 -6.6172 -0.4799 0.2536 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7695 -0.9420 0.8693 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9631 -0.5098 0.2168 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6884 0.2601 -0.8875 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0108 0.4506 -1.1219 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.4556 0.6477 -0.6674 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2588 1.4147 -1.1887 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0773 0.7269 -0.9257 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6686 1.6986 -1.9401 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5030 1.0734 -3.3037 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7607 -0.1863 -3.6849 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7326 2.3878 1.8161 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9966 2.4012 1.6651 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0504 3.2797 2.4100 O 0 0 0 0 0 1 0 0 0 0 0 0 5.6965 -2.9843 -0.7704 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3061 -1.9939 -1.2172 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3799 -2.7851 0.3873 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6109 -1.7755 -0.2863 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7797 0.1768 0.6333 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0526 1.9650 1.7289 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0867 -0.9341 0.4170 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1089 -0.6280 1.7111 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4938 1.0367 1.7235 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7526 -2.2580 2.3617 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7835 -1.5577 1.7594 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9663 -0.7542 0.5424 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3894 0.7199 -1.5701 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4064 2.5047 -2.0218 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7332 2.1848 -1.6470 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1216 1.7590 -4.0602 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5877 -0.4931 -4.7125 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1448 -0.9419 -3.0078 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 2 0 5 6 1 0 6 7 2 0 7 8 1 0 8 9 1 0 9 10 2 0 9 11 1 0 11 12 1 0 12 13 1 0 13 14 2 0 14 15 1 0 15 16 2 0 16 17 1 0 17 18 2 0 18 19 1 0 17 20 1 0 20 21 2 0 21 22 1 0 22 23 2 0 23 24 1 0 16 25 1 0 25 26 2 0 25 27 1 0 27 28 1 0 28 29 1 0 29 30 2 0 5 31 1 0 31 32 2 0 31 33 1 0 7 2 1 0 27 13 1 0 19 15 1 0 24 20 1 0 1 34 1 0 1 35 1 0 1 36 1 0 3 37 1 0 4 38 1 0 6 39 1 0 8 40 1 0 11 41 1 0 11 42 1 0 18 43 1 0 21 44 1 0 22 45 1 0 23 46 1 0 28 47 1 0 28 48 1 0 29 49 1 0 30 50 1 0 30 51 1 0 M CHG 1 33 -1 M END