RDKit 3D 49 52 0 0 0 0 0 0 0 0999 V2000 0.8025 -2.3100 2.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2947 -1.6286 1.1104 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5658 -2.2898 0.1216 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8885 -1.5993 -0.0229 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9005 -0.1592 0.3073 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.8728 0.6017 -0.6012 C 0 0 1 0 0 0 0 0 0 0 0 0 -4.3110 0.2035 -0.2617 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7700 2.0839 -0.3551 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2051 2.3309 1.0201 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7903 1.8576 1.0675 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5844 0.5550 0.2732 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.3321 0.8967 -1.1685 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6137 1.6389 -1.5432 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1587 0.3922 -2.1850 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5743 0.3338 -2.0456 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5504 -0.1732 0.9163 C 0 0 2 0 0 0 0 0 0 0 0 0 1.8015 0.0290 0.1254 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9925 -0.7075 0.7602 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2193 -0.4857 -0.0452 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1647 0.5064 0.0626 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0947 0.2501 -0.9243 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7584 -0.8151 -1.5947 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6367 -1.2806 -1.0912 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4302 -1.8189 2.8322 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5955 -3.3572 2.2183 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7512 -3.3293 0.4548 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0274 -2.3927 -0.8483 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6296 -2.1460 0.6165 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2376 -1.8117 -1.0756 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3115 -0.0223 1.3502 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4471 0.4275 0.8159 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9536 0.9302 -0.8119 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5370 -0.8248 -0.5455 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7700 2.5901 -0.3845 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1667 2.6040 -1.1451 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1946 3.4350 1.2094 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8723 1.8946 1.7625 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5739 1.5841 2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1352 2.6520 0.7090 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9693 1.2062 -2.6301 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0297 -0.5573 -2.4690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7118 0.2362 1.9387 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6263 -0.3500 -0.8937 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0813 1.1009 0.1811 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7639 -1.7922 0.7249 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1121 -0.4279 1.8106 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1443 1.2946 0.7785 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9956 0.8223 -1.1527 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1700 -2.1782 -1.5063 H 0 0 0 0 0 0 0 0 0 0 0 0 6 7 1 1 6 8 1 0 8 9 1 0 9 10 1 0 10 11 1 0 11 16 1 0 16 17 1 0 17 18 1 0 18 19 1 0 19 23 2 0 23 22 1 0 22 21 1 0 21 20 2 0 16 2 1 0 2 1 2 3 2 3 1 0 3 4 1 0 4 5 1 0 11 12 1 6 12 13 2 0 12 14 1 0 14 15 1 0 5 6 1 0 15 6 1 0 5 11 1 0 20 19 1 0 7 31 1 0 7 32 1 0 7 33 1 0 8 34 1 0 8 35 1 0 9 36 1 0 9 37 1 0 10 38 1 0 10 39 1 0 16 42 1 1 17 43 1 0 17 44 1 0 18 45 1 0 18 46 1 0 23 49 1 0 21 48 1 0 20 47 1 0 1 24 1 0 1 25 1 0 3 26 1 0 3 27 1 0 4 28 1 0 4 29 1 0 5 30 1 1 15 40 1 0 15 41 1 0 M END