RDKit 3D 49 52 0 0 0 0 0 0 0 0999 V2000 -4.5171 2.0939 1.9018 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7618 1.5657 0.9789 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7978 1.7660 -0.4541 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5514 2.5529 -1.0879 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8458 0.9367 -1.0727 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5970 -0.0865 -0.1188 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.3268 -0.7933 -0.3028 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2371 -1.9284 -0.9399 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4108 -2.6005 -1.5532 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1035 -2.6942 -2.9338 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0623 -2.6601 -1.1299 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2734 -1.8284 -1.0334 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0626 -0.3833 -0.7582 C 0 0 2 0 0 0 0 0 0 0 0 0 2.2382 0.0741 -0.0673 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0375 1.0778 -0.5189 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7697 1.6538 -1.5807 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2361 1.4542 0.3053 C 0 0 1 0 0 0 0 0 0 0 0 0 4.4699 0.6861 1.5850 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4533 1.7370 -0.5028 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7408 2.7380 0.1791 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0650 -0.2089 0.2357 C 0 0 2 0 0 0 0 0 0 0 0 0 0.3656 -0.8108 1.5339 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3526 1.2593 0.4851 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3807 1.2810 1.5949 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6553 0.6016 1.2317 C 0 0 1 0 0 0 0 0 0 0 0 0 -4.3964 1.8681 2.9471 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2949 2.7866 1.5976 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4878 -0.7514 -0.1616 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3753 -2.1538 -1.4065 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4432 -3.6775 -1.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8460 -3.1831 -3.4102 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0384 -3.4872 -0.3610 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0121 -3.1750 -2.1092 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9863 -2.3288 -0.3168 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8281 -1.8870 -2.0174 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9115 0.1910 -1.6889 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4441 0.4781 2.0063 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0455 1.2694 2.3153 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9794 -0.2634 1.3159 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4432 1.4352 -0.1324 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3776 1.8478 -1.6053 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8632 -0.0684 2.2106 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5101 -1.2714 2.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1162 -1.6110 1.3748 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7819 1.7769 -0.3778 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5385 1.8146 0.8019 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9779 0.7616 2.5145 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6083 2.3202 1.9077 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9449 -0.1746 1.9636 H 0 0 0 0 0 0 0 0 0 0 0 0 18 17 1 0 17 19 1 0 19 20 1 0 17 15 1 6 15 16 2 0 15 14 1 0 14 13 1 0 13 12 1 0 12 11 1 0 11 8 1 0 8 9 1 0 9 10 1 0 8 7 2 0 7 6 1 0 6 5 1 0 5 3 1 0 3 4 2 0 3 2 1 0 2 1 2 3 2 25 1 0 25 24 1 0 24 23 1 0 23 21 1 0 21 22 1 1 20 17 1 0 21 13 1 0 21 7 1 0 25 6 1 0 18 37 1 0 18 38 1 0 18 39 1 0 19 40 1 0 19 41 1 0 13 36 1 6 12 34 1 0 12 35 1 0 11 32 1 0 11 33 1 0 9 29 1 0 9 30 1 0 10 31 1 0 6 28 1 1 1 26 1 0 1 27 1 0 25 49 1 1 24 47 1 0 24 48 1 0 23 45 1 0 23 46 1 0 22 42 1 0 22 43 1 0 22 44 1 0 M END