BPFB64
-OEChem-04012119282D
52 54 0 1 0 0 0 0 0999 V2000
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8.3037 1.4726 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
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10.8820 -4.3514 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.5827 1.2173 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0
7.9930 -1.0874 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
3.4782 2.2119 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0
2.5000 2.4198 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6691 0.8106 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 1.5538 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.2213 2.8810 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.3147 0.2173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.1808 0.7173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
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6.1808 -1.2827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.3037 -2.0379 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.9930 0.5221 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.2822 -2.2441 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.5766 -0.2827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.5928 -3.1947 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0
4.7565 4.5283 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
10.5713 -3.4009 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.0570 1.9897 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.6916 3.0094 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.9336 2.6720 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
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1.4984 1.9182 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.5851 1.0930 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.5498 2.3552 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.7962 3.1132 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.1808 1.3373 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.7778 -1.0927 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.1808 -1.9027 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.6898 -2.1253 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.2831 -2.6576 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.8960 -2.1568 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.3027 -1.6245 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.7854 -3.7840 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.1714 4.0675 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.2173 4.9431 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.3417 4.9890 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
11.1852 -3.3135 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
10.5919 -2.7812 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.1176 -4.5283 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
11.4887 -4.4792 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
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28 50 1 0 0 0 0
M END
$$$$