RDKit 3D 83 86 0 0 0 0 0 0 0 0999 V2000 3.9158 -3.4634 1.1150 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0009 -2.7839 0.5429 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9395 -1.5053 -0.0117 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7486 -0.7972 -0.0343 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6828 0.4705 -0.5820 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4632 1.2535 -0.6289 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4967 2.3905 -1.1272 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2288 0.8374 -0.1545 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0678 1.6042 -0.2027 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.4518 2.0131 1.1551 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5035 3.0208 0.9325 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6649 4.0250 1.8632 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8263 4.0402 2.9728 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3602 4.7450 2.8458 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3526 4.8446 3.9564 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6361 5.3343 1.7595 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6508 4.9743 1.6576 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4688 4.9315 0.5432 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4647 5.8637 0.3046 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1702 7.0084 -0.4098 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1814 8.0565 -0.7081 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9831 7.1525 -0.8191 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2682 3.8974 -0.3705 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2865 2.9451 -0.1738 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1137 1.9398 -1.0909 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9959 1.0681 -1.1023 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.3817 -0.3330 -0.8666 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8999 -1.3932 -1.6063 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3111 -2.7011 -1.3372 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8337 -3.7493 -2.0705 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2744 -4.4963 -1.7852 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6429 -5.6057 -2.7067 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9298 -4.2138 -0.7615 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2089 -2.9547 -0.3237 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6391 -4.2530 -0.0295 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7228 -4.7485 -0.7382 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2560 -6.1297 -0.4911 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3215 -4.0834 -1.6213 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6952 -1.8947 0.4215 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5947 -2.1516 1.4367 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9632 -2.1228 1.2937 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8107 -2.4189 2.4637 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4605 -1.8487 0.1853 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2745 -0.6149 0.1366 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8454 0.9928 -1.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0365 0.3032 -1.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0835 -0.9424 -0.5433 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2867 -1.6580 -0.5208 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6596 -2.4993 -1.5438 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9249 -3.2554 -1.5265 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8889 -2.6182 -2.5179 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3627 -4.1193 1.9207 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2392 -2.7642 1.6102 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4421 -4.0888 0.3284 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8499 -1.2063 0.3672 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3790 2.5849 -0.6876 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7714 1.1945 1.7907 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4057 2.5534 1.6544 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8687 5.0541 4.9364 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0670 5.6550 3.7780 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9182 3.8973 3.9562 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7762 5.7653 2.3930 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7777 8.7424 -1.4775 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4120 8.6772 0.2052 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1102 7.6203 -1.1474 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9237 3.8713 -1.2546 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5875 1.1434 -2.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1938 -1.2086 -2.4056 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0635 -6.4613 -2.5307 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6445 -5.2914 -3.7562 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6527 -6.0113 -2.4641 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4107 -6.7825 -0.2253 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7400 -6.5381 -1.4096 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0397 -6.0831 0.3004 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7936 -2.7618 2.0814 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9429 -1.4846 3.0461 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3209 -3.1758 3.1142 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6675 0.1902 0.7292 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8528 1.9806 -1.5414 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9269 0.7763 -1.5153 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2228 -3.5609 -0.5095 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7265 -2.5464 -1.8815 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9101 -4.0974 -2.2448 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 4 5 1 0 5 45 2 0 45 46 1 0 46 47 2 0 47 48 1 0 48 49 1 0 49 50 1 0 49 51 2 0 5 6 1 0 6 7 2 0 6 8 1 0 8 9 1 0 9 10 1 0 10 11 1 0 11 12 2 0 12 13 1 0 13 14 1 0 14 15 1 0 14 16 2 0 12 17 1 0 17 18 2 0 18 19 1 0 19 20 1 0 20 21 1 0 20 22 2 0 18 23 1 0 23 24 2 0 24 25 1 0 25 26 1 0 26 27 1 0 27 28 2 0 28 29 1 0 29 30 1 0 30 31 1 0 31 32 1 0 31 33 2 0 29 34 2 0 34 35 1 0 35 36 1 0 36 37 1 0 36 38 2 0 34 39 1 0 39 40 1 0 40 41 1 0 41 42 1 0 41 43 2 0 39 44 2 0 47 3 1 0 26 9 1 0 44 27 1 0 24 11 1 0 1 52 1 0 1 53 1 0 1 54 1 0 4 55 1 0 45 79 1 0 46 80 1 0 50 81 1 0 50 82 1 0 50 83 1 0 9 56 1 6 10 57 1 0 10 58 1 0 15 59 1 0 15 60 1 0 15 61 1 0 17 62 1 0 21 63 1 0 21 64 1 0 21 65 1 0 23 66 1 0 26 67 1 6 28 68 1 0 32 69 1 0 32 70 1 0 32 71 1 0 37 72 1 0 37 73 1 0 37 74 1 0 42 75 1 0 42 76 1 0 42 77 1 0 44 78 1 0 M END