RDKit 3D 43 46 0 0 0 0 0 0 0 0999 V2000 3.8687 0.3963 2.8652 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6313 0.3516 1.4706 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3898 0.1284 0.9083 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4188 -0.0444 1.6757 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1715 0.0870 -0.5239 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3015 0.3244 -1.3211 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1221 0.3122 -2.6797 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8787 0.0757 -3.2415 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7665 -0.1582 -2.4655 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4806 -0.3950 -3.0515 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9419 -0.1473 -1.0999 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1844 -0.4528 -0.2871 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1786 0.3793 -0.0521 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3320 1.7225 -0.5428 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6066 2.2930 -0.4735 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8023 3.5905 -0.8865 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7778 4.3702 -1.3755 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5683 3.8009 -1.4306 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3462 2.5011 -1.0218 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2021 -0.1325 0.7189 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1877 -1.3714 1.1917 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2381 -1.8612 1.9719 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2208 -3.1461 2.4628 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1792 -4.0028 2.2123 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1353 -3.5358 1.4447 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1452 -2.2447 0.9472 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1248 -1.7458 0.1816 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8393 -2.5102 -0.0627 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6948 1.1461 3.0168 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3054 -0.5749 3.2165 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0125 0.7302 3.4508 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2734 0.5092 -0.8744 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9928 0.4954 -3.3052 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7830 0.0759 -4.3355 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6053 -0.4024 -4.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4632 1.7297 -0.0956 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8166 3.9895 -0.8131 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9301 5.3972 -1.7034 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6829 2.2273 -1.1091 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0605 -1.1942 2.1734 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0437 -3.5079 3.0656 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1482 -5.0212 2.5917 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2972 -4.1846 1.2272 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 3 5 1 0 5 6 2 0 6 7 1 0 7 8 2 0 8 9 1 0 9 10 1 0 9 11 2 0 11 12 1 0 12 13 1 0 13 14 1 0 14 15 2 0 15 16 1 0 16 17 2 0 17 18 1 0 18 19 2 0 13 20 2 0 20 21 1 0 21 22 2 0 22 23 1 0 23 24 2 0 24 25 1 0 25 26 2 0 26 27 1 0 27 28 2 0 11 5 1 0 27 12 1 0 19 14 1 0 26 21 1 0 1 29 1 0 1 30 1 0 1 31 1 0 6 32 1 0 7 33 1 0 8 34 1 0 10 35 1 0 15 36 1 0 16 37 1 0 17 38 1 0 19 39 1 0 22 40 1 0 23 41 1 0 24 42 1 0 25 43 1 0 M END