RDKit 3D 40 41 0 0 0 0 0 0 0 0999 V2000 1.3813 3.1143 0.6144 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3083 2.1911 0.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9254 2.3250 0.6826 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9507 1.3170 0.2018 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3660 -0.0369 0.3968 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.3005 -1.1431 -0.0184 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6992 -1.0892 -1.4552 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5677 -1.1425 0.8144 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0578 -0.1999 -0.3378 C 0 0 2 0 0 0 0 0 0 0 0 0 0.8737 -1.0892 0.4062 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1015 -1.2476 -0.0741 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1127 -2.1045 0.5751 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4662 -3.0936 -0.3690 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3685 -0.4725 -1.3435 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0669 0.9773 -0.9323 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5804 1.0948 -0.7160 C 0 0 2 0 0 0 0 0 0 0 0 0 2.1252 2.6582 1.2944 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9988 4.0865 1.0002 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9537 3.3774 -0.3223 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1913 3.1151 1.3754 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1093 1.4748 -0.8965 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8688 1.4817 0.7596 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1426 -0.1535 1.4869 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8221 -2.1341 0.1575 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9447 -1.6200 -2.0945 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6258 -1.7286 -1.5550 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9764 -0.1082 -1.8372 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3328 -1.2895 1.9068 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2150 -0.2856 0.6276 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1331 -2.0647 0.5220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2933 -0.7359 -1.2923 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5637 -1.6048 1.3285 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6165 -2.6557 1.3985 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9967 -1.5588 0.9381 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7312 -2.5759 -1.1889 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6216 -0.7361 -2.1003 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4127 -0.5800 -1.6554 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6116 1.1052 0.0466 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4557 1.6970 -1.6647 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1756 1.4352 -1.7244 H 0 0 0 0 0 0 0 0 0 0 0 0 7 6 1 0 6 8 1 0 6 5 1 0 5 4 1 0 4 3 1 0 3 2 2 0 2 1 1 0 2 16 1 0 16 15 1 0 15 14 1 0 14 11 1 0 11 12 1 0 12 13 1 0 11 10 2 0 10 9 1 0 9 5 1 0 9 16 1 0 7 25 1 0 7 26 1 0 7 27 1 0 6 24 1 0 8 28 1 0 8 29 1 0 8 30 1 0 5 23 1 1 4 21 1 0 4 22 1 0 3 20 1 0 1 17 1 0 1 18 1 0 1 19 1 0 16 40 1 6 15 38 1 0 15 39 1 0 14 36 1 0 14 37 1 0 12 33 1 0 12 34 1 0 13 35 1 0 10 32 1 0 9 31 1 6 M END