RDKit 3D 40 42 0 0 0 0 0 0 0 0999 V2000 1.9675 3.2933 0.3807 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6441 2.1910 1.2374 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6980 1.2681 0.8024 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0776 0.1485 0.1371 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4333 -0.2425 -0.1931 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6016 -1.3079 -1.0793 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8371 -1.7850 -1.4313 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9754 -1.2111 -0.9063 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2481 -1.7028 -1.2698 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8467 -0.1741 -0.0416 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5732 0.2962 0.3039 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0709 -0.6578 -0.2408 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1803 -0.4080 0.0024 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1453 -1.3246 -0.4414 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6709 -2.5346 -1.1686 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4837 -1.0952 -0.2024 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4356 -1.9994 -0.6402 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8842 0.0290 0.4700 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2986 0.2945 0.7357 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9432 0.9655 0.9270 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4221 2.0467 1.5813 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6053 0.7297 0.6844 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6271 1.5852 1.0911 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9099 2.6286 1.7078 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5690 4.2408 0.8448 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0711 3.3680 0.3690 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5156 3.1984 -0.6068 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7399 -1.7743 -1.5042 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9677 -2.6081 -2.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6152 -2.4527 -0.6700 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7273 0.3017 0.3913 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5409 1.1053 1.0166 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2908 -3.3131 -0.4764 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8899 -2.2823 -1.9125 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5352 -2.9409 -1.7686 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4066 -1.8057 -0.4513 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4698 1.3393 1.0655 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6404 -0.3581 1.5779 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9133 0.1515 -0.1772 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9677 2.7969 1.9716 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 4 12 1 0 12 13 1 0 13 14 2 0 14 15 1 0 14 16 1 0 16 17 1 0 16 18 2 0 18 19 1 0 18 20 1 0 20 21 1 0 20 22 2 0 22 23 1 0 23 24 2 0 4 5 1 0 5 6 2 0 6 7 1 0 7 8 2 0 8 9 1 0 8 10 1 0 10 11 2 0 23 3 1 0 11 5 1 0 22 13 1 0 1 25 1 0 1 26 1 0 1 27 1 0 15 33 1 0 15 34 1 0 15 35 1 0 17 36 1 0 19 37 1 0 19 38 1 0 19 39 1 0 21 40 1 0 6 28 1 0 7 29 1 0 9 30 1 0 10 31 1 0 11 32 1 0 M END