BU9QS8 -OEChem-04012113273D 51 55 0 1 0 0 0 0 0999 V2000 1.1888 -1.3059 2.0803 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8348 -1.3289 -1.2379 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7874 -1.8979 1.0644 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3360 0.9813 0.2252 N 0 0 0 0 0 0 0 0 0 0 0 0 1.9278 0.3260 0.1106 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.2977 -1.6221 -2.1699 N 0 0 0 0 0 0 0 0 0 0 0 0 5.3742 -1.9167 -0.6377 N 0 0 0 0 0 0 0 0 0 0 0 0 6.8093 1.4245 -0.0421 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.8951 -1.6300 0.2501 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0014 -3.1871 1.7349 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0837 -3.9128 0.9227 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6738 -2.7841 0.1338 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2740 -0.4366 -0.3476 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3580 -1.1367 1.1868 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5665 -0.1385 0.0580 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.8011 -2.8046 -0.6682 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5973 0.8464 -0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4084 -0.4543 -1.1722 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1572 -1.6322 -1.3367 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4278 2.0745 0.1378 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7429 1.9665 0.5723 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8775 3.3137 -0.1644 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9643 -0.3182 -0.5522 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3167 0.2712 -0.3767 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5206 3.1166 0.7064 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6554 4.4638 -0.0302 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9768 4.3652 0.4053 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4357 -0.5278 -0.4248 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4037 1.6293 -0.1664 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6601 0.0974 -0.2518 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6742 2.1579 -0.0047 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3418 -2.9744 2.7556 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0664 -3.7534 1.7955 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8138 -4.4021 1.5732 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6361 -4.6470 0.2449 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4237 -0.6349 -0.9099 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3846 -3.7137 -0.7754 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7230 0.4423 -1.7026 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1149 1.1059 0.7315 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5410 -0.7850 -2.6827 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8209 -2.4746 -2.3194 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1882 1.0223 0.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8538 3.4148 -0.5142 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5458 3.0417 1.0573 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2328 5.4361 -0.2662 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5816 5.2609 0.5122 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5528 2.2997 -0.1535 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5902 -0.4627 -0.2763 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8174 3.2214 0.1565 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2277 -2.4593 -0.6616 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4862 -2.3867 -0.7452 H 0 0 0 0 0 0 0 0 0 0 0 0 1 14 2 0 0 0 0 2 23 2 0 0 0 0 3 9 1 0 0 0 0 3 10 1 0 0 0 0 3 14 1 0 0 0 0 4 15 1 0 0 0 0 4 17 2 0 0 0 0 5 15 1 0 0 0 0 5 23 1 0 0 0 0 5 39 1 0 0 0 0 6 19 1 0 0 0 0 6 40 1 0 0 0 0 6 41 1 0 0 0 0 7 28 1 0 0 0 0 7 50 1 0 0 0 0 7 51 1 0 0 0 0 8 30 2 0 0 0 0 8 31 1 0 0 0 0 9 12 2 0 0 0 0 9 13 1 0 0 0 0 10 11 1 0 0 0 0 10 32 1 0 0 0 0 10 33 1 0 0 0 0 11 12 1 0 0 0 0 11 34 1 0 0 0 0 11 35 1 0 0 0 0 12 16 1 0 0 0 0 13 17 1 0 0 0 0 13 18 2 0 0 0 0 14 15 1 0 0 0 0 15 36 1 0 0 0 0 16 19 2 0 0 0 0 16 37 1 0 0 0 0 17 20 1 0 0 0 0 18 19 1 0 0 0 0 18 38 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 21 25 1 0 0 0 0 21 42 1 0 0 0 0 22 26 2 0 0 0 0 22 43 1 0 0 0 0 23 24 1 0 0 0 0 24 28 2 0 0 0 0 24 29 1 0 0 0 0 25 27 2 0 0 0 0 25 44 1 0 0 0 0 26 27 1 0 0 0 0 26 45 1 0 0 0 0 27 46 1 0 0 0 0 28 30 1 0 0 0 0 29 31 2 0 0 0 0 29 47 1 0 0 0 0 30 48 1 0 0 0 0 31 49 1 0 0 0 0 M END $$$$