RDKit 3D 48 51 0 0 0 0 0 0 0 0999 V2000 5.5098 1.8234 -0.0601 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6722 0.3657 -0.2558 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6833 -0.4905 -0.1244 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3633 0.0073 0.2296 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0837 1.2144 0.4245 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2710 -0.8695 0.3823 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9771 -0.3929 0.7281 C 0 0 2 0 0 0 0 0 0 0 0 0 0.4692 -1.0269 2.0037 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7687 -1.8352 1.6178 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.9280 -1.0784 1.7005 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8145 0.1839 1.1474 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.1582 0.8098 1.1818 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8238 1.2076 0.1178 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1817 1.8313 0.2609 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2152 1.0293 -1.1939 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5672 1.7700 -2.1420 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1966 -0.0432 -1.3169 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1858 0.2251 -0.1950 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.6497 1.6218 -0.4250 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0470 -0.7770 -0.3279 C 0 0 1 0 0 0 0 0 0 0 0 0 0.5069 -0.8351 -1.7022 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5006 -2.1086 0.1694 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.8194 -3.2539 -0.5402 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4763 -3.1381 -0.0196 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1695 2.0649 0.9664 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7717 2.2698 -0.7620 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4991 2.3101 -0.1960 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6592 -0.0065 -0.5207 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8926 -1.5359 -0.2858 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9441 0.6880 0.8532 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2543 -0.3150 2.8011 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2548 -1.7692 2.3301 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8745 -2.7222 2.2435 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1914 0.7829 1.8735 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6423 0.9569 2.1617 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0667 2.8900 0.5710 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7846 1.2509 0.9961 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6937 1.8253 -0.7380 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6559 0.0921 -2.2736 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6278 -1.0571 -1.2383 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2952 2.1932 -1.1352 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6848 2.2312 0.5268 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3627 1.6344 -0.8574 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4759 -1.3869 -1.6615 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5968 0.1247 -2.2073 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1930 -1.4565 -2.3263 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4701 -4.0443 -0.1025 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8573 -3.2613 -1.6492 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 2 0 3 4 1 0 4 5 2 0 4 6 1 0 6 7 1 0 7 8 1 0 8 9 1 0 9 10 1 0 10 11 1 0 11 12 1 0 12 13 2 0 13 14 1 0 13 15 1 0 15 16 2 0 15 17 1 0 17 18 1 0 18 19 1 6 18 20 1 0 20 21 1 6 20 22 1 0 22 23 1 0 23 24 1 0 20 7 1 0 22 24 1 1 22 9 1 0 18 11 1 0 1 25 1 0 1 26 1 0 1 27 1 0 2 28 1 0 3 29 1 0 7 30 1 1 8 31 1 0 8 32 1 0 9 33 1 1 11 34 1 1 12 35 1 0 14 36 1 0 14 37 1 0 14 38 1 0 17 39 1 0 17 40 1 0 19 41 1 0 19 42 1 0 19 43 1 0 21 44 1 0 21 45 1 0 21 46 1 0 23 47 1 0 23 48 1 0 M END