RDKit 3D 54 59 0 0 0 0 0 0 0 0999 V2000 3.9194 -1.6413 0.9928 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2248 -0.3507 0.7667 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8949 0.7730 0.5094 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0831 1.9661 0.3072 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4659 3.0657 0.7361 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7866 1.8784 -0.4168 C 0 0 1 0 0 0 0 0 0 0 0 0 2.1250 2.3021 -1.7277 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2872 0.4213 -0.4614 C 0 0 1 0 0 0 0 0 0 0 0 0 1.8988 -0.1733 -1.6914 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7494 -0.1969 0.8172 C 0 0 1 0 0 0 0 0 0 0 0 0 1.0645 -1.4267 1.2529 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0196 -1.9245 0.3586 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.8450 -2.7933 1.1245 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5959 -2.2175 2.1389 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8767 -2.8536 3.1803 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0400 -0.8025 1.9031 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.3291 -0.7216 2.4670 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1802 -0.6352 0.4225 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.0458 -1.6617 -0.0209 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6860 0.6951 -0.0089 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.3487 1.6522 0.8264 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1465 0.7603 0.1490 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3465 1.0446 -1.4318 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.6551 2.3917 -1.6145 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8686 0.8816 -1.7221 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.3725 1.9667 -2.3720 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7264 -0.2804 -2.5118 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1704 -1.2920 -1.6889 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8573 -0.8814 -0.2519 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.2000 0.4602 -0.4626 C 0 0 1 0 0 0 0 0 0 0 0 0 3.7241 -2.0001 2.0117 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5345 -2.4287 0.2843 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0171 -1.5295 0.9002 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9713 0.7781 0.4608 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0161 2.5182 0.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0679 3.2901 -1.6930 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9902 -0.1798 -1.5808 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6860 0.5475 -2.5343 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5034 -1.1349 -1.9972 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5709 0.5864 1.6158 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8131 -2.2469 1.3552 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6216 -1.3357 2.2883 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4591 -2.6006 -0.4111 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4107 -0.0674 2.4000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2494 -0.3242 3.3883 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9751 -1.3267 -0.0904 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4092 2.7084 0.4551 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4015 1.6001 1.9245 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9758 0.4711 -2.1474 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8464 2.9366 -1.3978 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4844 1.8490 -3.3522 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2493 -1.4214 -1.8634 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6270 -2.2378 -1.9627 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5355 1.1418 0.3503 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 4 6 1 0 6 7 1 0 6 8 1 0 8 9 1 6 8 30 1 0 30 25 1 0 25 26 1 6 25 27 1 0 27 28 1 0 29 28 1 6 29 12 1 0 12 11 1 0 11 10 1 0 12 13 1 0 13 14 1 0 14 15 2 0 14 16 1 0 16 17 1 0 16 18 1 0 18 19 1 6 18 20 1 0 20 21 1 0 21 22 1 0 20 23 1 0 23 24 1 0 10 2 1 0 20 22 1 6 10 8 1 0 29 30 1 0 18 29 1 0 23 25 1 0 1 31 1 0 1 32 1 0 1 33 1 0 3 34 1 0 6 35 1 1 7 36 1 0 9 37 1 0 9 38 1 0 9 39 1 0 30 54 1 1 26 51 1 0 28 52 1 0 28 53 1 0 12 43 1 6 11 41 1 0 11 42 1 0 10 40 1 1 16 44 1 1 17 45 1 0 19 46 1 0 21 47 1 0 21 48 1 0 23 49 1 6 24 50 1 0 M END