RDKit 3D 85 89 0 0 0 0 0 0 0 0999 V2000 4.6497 2.1729 3.0002 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8325 1.6793 1.9529 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3212 0.8644 0.9452 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5409 0.5742 0.9967 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4628 0.3346 -0.1729 C 0 0 1 0 0 0 0 0 0 0 0 0 4.3165 -0.5182 -1.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6271 -1.8762 -0.5398 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3623 -2.5554 -0.1378 C 0 0 1 0 0 0 0 0 0 0 0 0 3.7182 -3.8515 0.5832 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5259 -1.7434 0.8126 C 0 0 1 0 0 0 0 0 0 0 0 0 3.3422 -1.6639 2.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2295 -0.3669 0.3462 C 0 0 2 0 0 0 0 0 0 0 0 0 1.0338 -0.2212 -0.5013 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1154 -1.1451 -0.7091 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0768 -0.9653 -1.5657 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6029 0.4315 -1.6473 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.0178 0.4710 -1.0649 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.6397 1.8170 -1.4913 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9064 -0.5739 -1.6223 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5863 -1.5105 -0.7295 C 0 0 1 0 0 0 0 0 0 0 0 0 -4.3083 -2.8616 -1.0778 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3613 -1.4059 0.7328 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.3245 -2.2575 1.1598 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0000 -0.0244 1.2133 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5122 -0.2035 2.6606 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1801 0.8638 1.2520 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8345 0.4203 0.4255 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.2080 1.6814 0.9572 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8637 1.8164 0.3459 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7089 1.4855 -1.0912 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.8025 2.7337 -1.9481 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7651 1.0649 -1.2356 C 0 0 2 0 0 0 0 0 0 0 0 0 1.1318 0.8352 -2.6757 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7034 2.0563 -0.6383 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0998 1.5764 -0.9906 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1479 1.3572 3.5609 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0847 2.8646 3.6210 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4548 2.7757 2.4875 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9030 -0.6276 -2.0785 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2834 0.0352 -1.1810 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4368 -1.8990 0.2054 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0361 -2.4639 -1.4148 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8215 -2.8478 -1.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5340 -3.6614 1.2843 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8215 -4.2561 1.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0788 -4.5679 -0.1845 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6360 -2.2916 1.1099 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1080 -2.5620 2.7706 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9653 -0.8094 2.6795 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4149 -1.7205 1.9503 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9823 0.2096 1.2958 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2338 -2.1032 -0.2333 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8653 -1.6181 -1.0814 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7915 -1.4117 -2.5427 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7599 0.6476 -2.7242 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7097 1.8517 -1.1176 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7698 1.8351 -2.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1597 2.6817 -1.0645 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6982 -0.1464 -2.3248 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3147 -1.1662 -2.3885 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7150 -1.4794 -0.8617 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7765 -3.4818 -0.4974 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2492 -1.7156 1.3311 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7263 -3.1768 1.2299 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5658 0.7328 3.2268 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5478 -0.7186 2.6936 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2584 -0.9007 3.1263 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7174 0.6678 2.2289 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9601 0.5892 0.4853 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9495 1.9355 1.2652 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0344 -0.3709 0.5902 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8503 2.5658 0.9305 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0601 1.4918 2.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1641 1.1798 0.9498 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5565 2.8983 0.4668 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0038 3.6454 -1.3544 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1553 2.9804 -2.4807 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5162 2.5900 -2.7992 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6039 1.7239 -3.1579 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7043 -0.1023 -2.8291 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1704 0.6508 -3.2399 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6124 3.0804 -1.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6631 2.1172 0.4675 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7724 2.4471 -0.7364 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2514 1.4098 -2.0616 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 5 3 1 1 5 6 1 0 6 7 1 0 7 8 1 0 8 9 1 0 8 10 1 0 10 11 1 0 10 12 1 0 12 13 1 0 13 14 2 0 14 15 1 0 15 16 1 0 16 17 1 0 17 18 1 1 17 19 1 0 19 20 1 0 20 21 1 0 20 22 1 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 28 29 1 0 29 30 1 0 30 31 1 6 30 32 1 0 32 33 1 6 32 34 1 0 34 35 1 0 12 5 1 0 32 13 1 0 35 5 1 0 30 16 1 0 27 17 1 0 1 36 1 0 1 37 1 0 1 38 1 0 6 39 1 0 6 40 1 0 7 41 1 0 7 42 1 0 8 43 1 6 9 44 1 0 9 45 1 0 9 46 1 0 10 47 1 1 11 48 1 0 11 49 1 0 11 50 1 0 12 51 1 1 14 52 1 0 15 53 1 0 15 54 1 0 16 55 1 6 18 56 1 0 18 57 1 0 18 58 1 0 19 59 1 0 19 60 1 0 20 61 1 1 21 62 1 0 22 63 1 1 23 64 1 0 25 65 1 0 25 66 1 0 25 67 1 0 26 68 1 0 26 69 1 0 26 70 1 0 27 71 1 6 28 72 1 0 28 73 1 0 29 74 1 0 29 75 1 0 31 76 1 0 31 77 1 0 31 78 1 0 33 79 1 0 33 80 1 0 33 81 1 0 34 82 1 0 34 83 1 0 35 84 1 0 35 85 1 0 M END