RDKit 3D 27 28 0 0 0 0 0 0 0 0999 V2000 4.9469 0.1270 0.5862 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6111 0.5642 0.4887 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5357 -0.2805 0.3062 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7755 -1.4976 0.2249 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1869 0.2565 0.2159 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8373 1.6083 0.3436 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5213 1.7835 0.2142 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1051 0.5557 -0.0025 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4507 0.3322 -0.1785 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2300 1.3966 -0.7440 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4975 1.2447 -0.8292 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7519 2.5918 -1.2183 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0968 -0.8550 0.1461 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5337 -2.1111 0.2539 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2258 -2.5251 0.0432 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0774 -1.7806 -0.1762 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0017 -0.4003 0.0028 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3850 0.1278 -0.4295 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5647 0.7302 1.2625 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0024 -0.9344 0.9485 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5578 2.4106 0.5226 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0820 2.7211 0.2728 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1319 3.4511 -0.8232 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1688 -0.7678 0.3324 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2432 -2.8693 0.5490 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1016 -3.5926 0.0549 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8125 -2.2872 -0.5062 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 17 2 0 17 16 1 0 16 15 2 0 15 14 1 0 14 13 2 0 13 9 1 0 9 10 1 0 10 12 1 0 10 11 2 0 9 8 2 0 8 7 1 0 7 6 2 0 6 5 1 0 8 17 1 0 1 18 1 0 1 19 1 0 1 20 1 0 16 27 1 0 15 26 1 0 14 25 1 0 13 24 1 0 12 23 1 0 7 22 1 0 6 21 1 0 M END