BP3Q2J -OEChem-04022115433D 33 36 0 1 0 0 0 0 0999 V2000 2.7274 3.0396 0.6273 S 0 0 0 0 0 0 0 0 0 0 0 0 1.3999 0.0002 1.1130 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7057 -1.8447 0.2832 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5957 -2.7798 -1.1534 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6463 -1.1043 0.3952 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.7824 -1.7355 0.3061 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8947 1.2715 -0.0453 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.2378 1.8723 -0.3699 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.0050 0.2631 -0.2517 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6483 0.3056 0.4535 C 0 0 2 0 0 0 0 0 0 0 0 0 2.5094 1.5975 -0.2941 C 0 0 2 0 0 0 0 0 0 0 0 0 2.9605 -0.8780 -0.4555 C 0 0 2 0 0 0 0 0 0 0 0 0 1.5799 -1.4202 -0.7673 C 0 0 2 0 0 0 0 0 0 0 0 0 0.8516 -1.2104 0.5538 C 0 0 1 0 0 0 0 0 0 0 0 0 3.7293 2.3969 -0.6214 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3638 0.0269 0.1294 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5419 -2.1360 0.4923 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6858 -0.3857 0.0782 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6403 0.5923 -0.1827 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9097 2.1286 -0.2907 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4064 0.3868 1.2434 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6986 1.6044 -1.0103 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5333 -0.6287 -1.3536 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1215 -0.8300 -1.5703 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0101 -2.0304 1.2649 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6973 2.0301 -0.3051 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7388 2.9542 -1.5493 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5699 -1.4492 0.4894 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6736 -3.0605 -1.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2332 -3.1517 0.6981 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6230 3.1633 -0.4457 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3080 -0.6913 -0.1121 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6794 0.9916 -0.4423 H 0 0 0 0 0 0 0 0 0 0 0 0 1 11 1 0 0 0 0 1 15 1 0 0 0 0 2 10 1 0 0 0 0 2 14 1 0 0 0 0 3 12 1 0 0 0 0 3 28 1 0 0 0 0 4 13 1 0 0 0 0 4 29 1 0 0 0 0 5 14 1 0 0 0 0 5 16 1 0 0 0 0 5 17 1 0 0 0 0 6 17 2 0 0 0 0 6 18 1 0 0 0 0 7 16 2 0 0 0 0 7 20 1 0 0 0 0 8 19 1 0 0 0 0 8 20 2 0 0 0 0 9 19 1 0 0 0 0 9 32 1 0 0 0 0 9 33 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 21 1 0 0 0 0 11 15 1 0 0 0 0 11 22 1 0 0 0 0 12 13 1 0 0 0 0 12 23 1 0 0 0 0 13 14 1 0 0 0 0 13 24 1 0 0 0 0 14 25 1 0 0 0 0 15 26 1 0 0 0 0 15 27 1 0 0 0 0 16 18 1 0 0 0 0 17 30 1 0 0 0 0 18 19 2 0 0 0 0 20 31 1 0 0 0 0 M END $$$$