B8ZQ5L
-OEChem-04022100222D
42 44 0 1 0 0 0 0 0999 V2000
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2.3100 -0.0160 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.3100 1.7160 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
6.7638 -1.0044 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
6.7906 -2.9852 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.3100 3.4481 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.4000 -1.5228 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
3.3100 -0.0160 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0
2.8100 0.8500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.3100 -1.0160 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.1760 -1.5160 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.0420 -1.0160 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.0420 -0.0160 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.3100 1.7160 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0
4.1921 -2.5575 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.9015 -1.5108 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.0692 -3.0203 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.9150 -2.5024 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8100 2.5821 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.2940 -3.0853 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3920 -2.5644 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.6335 -1.4979 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.8103 -3.9850 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3350 1.2486 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3350 0.4515 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.6526 -0.1237 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.2541 0.5666 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.6200 1.1791 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.0890 -3.6399 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3350 2.9806 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3350 2.1836 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 0.5209 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.2964 -3.7052 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.8538 -2.8724 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.6200 2.2530 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.0000 3.9850 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.3275 -2.0372 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.1727 -1.8040 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.9395 -0.9587 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.1905 -3.9972 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.8226 -4.6049 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.4302 -3.9728 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
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3 14 1 0 0 0 0
3 35 1 0 0 0 0
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20 21 2 0 0 0 0
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21 34 1 0 0 0 0
22 37 1 0 0 0 0
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23 40 1 0 0 0 0
23 41 1 0 0 0 0
23 42 1 0 0 0 0
M END
$$$$