RDKit 3D 48 50 0 0 0 0 0 0 0 0999 V2000 1.4551 2.3501 -1.0389 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3149 1.7822 -1.3408 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3954 1.7859 -2.6159 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1112 1.8564 -3.7588 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7495 1.6941 -2.2557 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8987 0.9898 -1.0394 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.9129 1.7588 -0.2254 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6527 1.1880 0.7104 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6561 1.9351 1.5212 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5198 -0.2857 1.0183 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4565 -0.5307 2.0752 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8014 -1.8271 1.9951 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0344 -2.2684 1.0375 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2174 -3.3675 0.5038 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0627 -4.5676 0.8779 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2894 -2.6201 -0.5122 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6505 -1.5605 -0.1867 C 0 0 2 0 0 0 0 0 0 0 0 0 0.0524 -0.2666 0.0073 C 0 0 1 0 0 0 0 0 0 0 0 0 1.3050 -0.3992 -0.7004 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5274 -0.4986 -0.0581 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5428 -0.4722 1.1785 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7303 -0.6286 -0.8591 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6555 -0.6550 -2.3480 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9100 -0.7260 -0.3040 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0254 -0.7038 1.1721 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5621 0.9826 -0.4402 C 0 0 1 0 0 0 0 0 0 0 0 0 2.0494 2.9264 -1.7365 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8597 2.2720 -0.0421 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3290 0.0203 -1.3636 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0421 2.8123 -0.4090 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6107 3.0171 1.3846 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6963 1.6015 1.2863 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4111 1.7463 2.6038 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4755 -0.6616 1.4782 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3984 -0.8940 0.1109 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9481 -0.4139 3.1062 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7260 0.2984 2.0732 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9756 -2.5200 2.8491 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4356 -1.6506 -0.9555 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3623 -0.2409 1.0808 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0356 -1.5198 -2.6960 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2119 0.3024 -2.7268 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6385 -0.7666 -2.7994 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8223 -0.8248 -0.9237 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5352 -1.5622 1.6685 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1206 -0.8276 1.4255 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7008 0.2791 1.6033 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6372 1.6607 0.4815 H 0 0 0 0 0 0 0 0 0 0 0 0 25 24 1 0 24 22 2 0 22 23 1 0 22 20 1 0 20 21 2 0 20 19 1 0 19 18 1 0 18 17 1 0 17 16 1 0 16 14 1 0 14 15 2 0 14 13 1 0 13 12 2 0 12 11 1 0 11 10 1 0 10 8 1 0 8 9 1 0 8 7 2 0 7 6 1 0 6 5 1 0 5 3 1 0 3 4 2 0 3 2 1 0 2 1 2 3 2 26 1 0 26 18 1 0 13 17 1 0 26 6 1 0 25 45 1 0 25 46 1 0 25 47 1 0 24 44 1 0 23 41 1 0 23 42 1 0 23 43 1 0 18 40 1 1 17 39 1 6 12 38 1 0 11 36 1 0 11 37 1 0 10 34 1 0 10 35 1 0 9 31 1 0 9 32 1 0 9 33 1 0 7 30 1 0 6 29 1 6 1 27 1 0 1 28 1 0 26 48 1 1 M END