RDKit 3D 44 45 0 0 0 0 0 0 0 0999 V2000 5.9005 3.2071 0.1004 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1845 1.9905 0.0967 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8834 1.8627 -0.2838 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3254 2.9619 -0.6540 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0683 0.6710 -0.3229 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7388 0.7810 -0.7587 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8847 -0.2957 -0.8345 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3115 -1.5512 -0.4740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4707 -2.7400 -0.4059 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7898 -2.7071 -0.1674 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5726 -1.5079 0.0857 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2419 -0.5971 1.0956 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0085 0.5255 1.3097 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1178 0.8198 0.5687 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9203 1.9126 0.7274 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8004 2.9481 1.6495 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4907 -0.0728 -0.4633 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5226 0.0969 -1.2348 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.5328 0.2286 -2.0172 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6827 -1.2123 -0.6545 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0773 -4.0801 -0.6562 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2816 -4.2107 -0.9162 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2691 -5.1945 -0.5980 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6219 -1.6495 -0.0468 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5123 -0.5728 0.0382 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8065 -0.7950 0.4816 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4604 3.9288 0.7895 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9952 3.6239 -0.9412 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9375 2.9773 0.4799 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3444 1.7435 -1.0536 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1227 -0.1211 -1.2482 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3375 -3.6904 -0.1523 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3869 -0.7944 1.6964 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7641 1.2436 2.0915 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7348 2.9191 2.2858 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9463 2.8908 2.3326 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7764 3.9609 1.1652 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3877 0.9035 -1.7164 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2404 0.4687 -3.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0852 -0.7654 -2.1634 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9505 -1.9161 -1.4454 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2042 -5.5198 0.2298 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0699 -2.5881 0.2833 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4731 -0.0842 0.5639 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 3 5 1 0 5 6 2 0 6 7 1 0 7 8 2 0 8 24 1 0 24 25 2 0 25 26 1 0 8 9 1 0 9 10 2 0 10 11 1 0 11 12 2 0 12 13 1 0 13 14 2 0 14 15 1 0 15 16 1 0 14 17 1 0 17 18 1 0 18 19 1 0 17 20 2 0 9 21 1 0 21 23 1 0 21 22 2 0 25 5 1 0 20 11 1 0 1 27 1 0 1 28 1 0 1 29 1 0 6 30 1 0 7 31 1 0 24 43 1 0 26 44 1 0 10 32 1 0 12 33 1 0 13 34 1 0 16 35 1 0 16 36 1 0 16 37 1 0 19 38 1 0 19 39 1 0 19 40 1 0 20 41 1 0 23 42 1 0 M END