RDKit 3D 42 47 0 0 0 0 0 0 0 0999 V2000 5.0444 0.6638 -0.0016 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5013 0.3571 -0.0490 C 0 0 1 0 0 0 0 0 0 0 0 0 3.1529 0.4977 -1.4898 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7922 0.4386 -1.7866 C 0 0 1 0 0 0 0 0 0 0 0 0 1.1462 1.5867 -1.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1629 1.7066 -1.1600 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8395 0.3755 -1.2498 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.2324 -0.1790 -2.3957 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9400 0.2597 -2.7870 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2514 0.4699 -1.2361 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7913 1.1135 -2.2097 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2002 -0.0548 -0.2791 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5789 0.1713 -0.4045 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0335 0.9241 -1.4855 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.4623 -0.3440 0.5272 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9948 -1.0845 1.5873 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6356 -1.3073 1.7107 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7656 -0.7888 0.7764 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3273 -1.0277 0.9126 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9164 -1.7104 1.8887 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3818 -0.5089 -0.0309 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8596 -0.7365 0.0551 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5966 -0.9116 -1.1748 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6066 -0.8245 1.2566 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0698 -0.1036 2.3478 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6919 -2.1488 1.6780 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0499 -0.2925 1.0116 C 0 0 2 0 0 0 0 0 0 0 0 0 2.9068 1.1820 0.9292 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1085 1.7163 -0.3785 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5857 -0.0616 -0.6038 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3922 0.6979 1.0356 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7655 -0.2935 -2.0253 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6073 1.4546 -1.9099 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6893 2.3522 -0.5973 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7433 2.5962 -1.1423 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0170 1.0802 -1.5669 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5076 -0.1273 0.3627 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7045 -1.4770 2.3028 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3148 -1.8955 2.5610 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2875 -0.5661 3.1967 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3915 -2.5700 1.0926 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6752 -0.6297 1.8437 H 0 0 0 0 0 0 0 0 0 0 0 0 2 1 1 6 2 3 1 0 4 3 1 6 4 9 1 0 9 8 1 0 8 7 1 0 7 6 1 0 6 5 2 0 7 10 1 6 10 11 2 0 10 12 1 0 12 13 2 0 13 14 1 0 13 15 1 0 15 16 2 0 16 17 1 0 17 18 2 0 18 19 1 0 19 20 2 0 19 21 1 0 21 22 2 0 22 23 1 0 22 24 1 0 24 25 1 0 24 26 1 0 24 27 1 0 27 28 1 0 27 2 1 0 28 2 1 0 5 4 1 0 18 12 1 0 23 4 1 0 21 7 1 0 1 29 1 0 1 30 1 0 1 31 1 0 3 32 1 0 3 33 1 0 6 35 1 0 5 34 1 0 14 36 1 0 15 37 1 0 16 38 1 0 17 39 1 0 25 40 1 0 26 41 1 0 27 42 1 1 M END