BU91PH -OEChem-04022114393D 44 46 0 0 0 0 0 0 0999 V2000 1.2569 0.0812 -2.3009 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1759 -0.0726 1.7584 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.4328 2.3736 0.4563 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.4092 -2.3988 0.3705 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3887 0.0083 -0.0787 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8526 0.0013 -0.0031 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1050 -0.0440 1.1837 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3608 0.0106 -0.5098 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9944 0.0374 -1.1127 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2383 0.0029 -0.0221 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2602 -0.0413 0.9589 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5160 0.0368 -1.2057 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8593 0.0193 -0.6482 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9191 0.0438 -1.2388 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9521 -0.0361 1.1757 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4976 -1.1965 -0.4032 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5097 1.2191 -0.3596 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7984 1.2030 0.1737 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7865 -1.2125 0.1300 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3138 0.0456 -1.2577 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3469 -0.0344 1.1566 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0277 0.0065 -0.0601 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4369 -0.0127 0.4185 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7215 3.5799 0.1823 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6859 -3.5873 0.0537 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0551 -0.0329 1.1825 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5412 -0.0742 2.0947 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4808 0.0790 -2.2922 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4386 0.0751 -2.2066 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4768 -0.0684 2.1498 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9475 -2.1005 -0.6459 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9685 2.1366 -0.5694 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8400 0.0775 -2.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8392 -0.0660 2.1227 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4411 -0.0252 0.8345 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8163 3.6613 0.7935 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5131 3.6904 -0.8873 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3745 4.4113 0.4674 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4766 -3.6575 -1.0191 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7797 -3.6814 0.6617 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3304 -4.4349 0.3089 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8366 0.8570 1.7824 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8381 -0.9611 1.7221 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1311 -0.0253 0.9798 H 0 0 0 0 0 0 0 0 0 0 0 0 1 9 2 0 0 0 0 2 11 2 0 0 0 0 3 18 1 0 0 0 0 3 24 1 0 0 0 0 4 19 1 0 0 0 0 4 25 1 0 0 0 0 5 22 1 0 0 0 0 5 26 1 0 0 0 0 6 7 1 0 0 0 0 6 9 1 0 0 0 0 6 10 1 0 0 0 0 7 11 1 0 0 0 0 7 27 1 0 0 0 0 8 9 1 0 0 0 0 8 11 1 0 0 0 0 8 12 2 0 0 0 0 10 14 2 0 0 0 0 10 15 1 0 0 0 0 12 13 1 0 0 0 0 12 28 1 0 0 0 0 13 16 2 0 0 0 0 13 17 1 0 0 0 0 14 20 1 0 0 0 0 14 29 1 0 0 0 0 15 21 2 0 0 0 0 15 30 1 0 0 0 0 16 19 1 0 0 0 0 16 31 1 0 0 0 0 17 18 2 0 0 0 0 17 32 1 0 0 0 0 18 23 1 0 0 0 0 19 23 2 0 0 0 0 20 22 2 0 0 0 0 20 33 1 0 0 0 0 21 22 1 0 0 0 0 21 34 1 0 0 0 0 23 35 1 0 0 0 0 24 36 1 0 0 0 0 24 37 1 0 0 0 0 24 38 1 0 0 0 0 25 39 1 0 0 0 0 25 40 1 0 0 0 0 25 41 1 0 0 0 0 26 42 1 0 0 0 0 26 43 1 0 0 0 0 26 44 1 0 0 0 0 M END $$$$