BUOE94 -OEChem-04042106083D 36 38 0 0 0 0 0 0 0999 V2000 -0.2659 -1.3453 -0.0034 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0865 -0.1974 0.0027 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7048 0.4760 -0.0013 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6138 0.8051 -0.0029 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.5080 2.1149 -0.0005 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9878 1.9302 -0.0001 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9966 0.7044 0.0011 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9410 -0.2100 -0.0002 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3185 0.2840 0.0024 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1951 -1.5743 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4329 -0.1258 -0.0024 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5802 -1.0852 0.0023 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5253 -2.0074 0.0013 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0081 0.5502 -0.0012 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9078 1.6132 0.0008 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4719 -0.7629 -0.0021 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2797 1.3615 0.0019 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8438 -1.0147 -0.0009 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7478 0.0476 0.0009 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4967 -1.5641 0.0016 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8399 2.6499 -0.8956 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8401 2.6524 0.8930 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5316 2.3825 -0.8882 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5322 2.3805 0.8893 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1336 0.9999 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4093 -2.3191 -0.0008 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6068 -1.4405 0.0031 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7441 -3.0720 0.0013 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3728 1.7909 -0.0027 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5559 2.6416 0.0016 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8430 -1.6408 -0.0039 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9791 2.1931 0.0036 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1404 -2.0581 -0.0016 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1740 -2.0803 -0.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1718 -2.0824 0.9101 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5916 -1.5728 0.0029 H 0 0 0 0 0 0 0 0 0 0 0 0 1 11 2 0 0 0 0 2 19 1 0 0 0 0 2 20 1 0 0 0 0 3 6 1 0 0 0 0 3 8 1 0 0 0 0 3 11 1 0 0 0 0 4 11 1 0 0 0 0 4 14 1 0 0 0 0 4 29 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 21 1 0 0 0 0 5 22 1 0 0 0 0 6 23 1 0 0 0 0 6 24 1 0 0 0 0 7 8 1 0 0 0 0 7 9 2 0 0 0 0 8 10 2 0 0 0 0 9 12 1 0 0 0 0 9 25 1 0 0 0 0 10 13 1 0 0 0 0 10 26 1 0 0 0 0 12 13 2 0 0 0 0 12 27 1 0 0 0 0 13 28 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 15 17 1 0 0 0 0 15 30 1 0 0 0 0 16 18 2 0 0 0 0 16 31 1 0 0 0 0 17 19 2 0 0 0 0 17 32 1 0 0 0 0 18 19 1 0 0 0 0 18 33 1 0 0 0 0 20 34 1 0 0 0 0 20 35 1 0 0 0 0 20 36 1 0 0 0 0 M END $$$$