D08MCE
-OEChem-10101305022D
38 40 0 0 0 0 0 0 0999 V2000
4.9889 2.1767 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
5.2619 0.4214 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
4.6783 -0.3833 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
6.7619 -0.4446 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.2619 0.4214 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.7619 -0.4446 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.2619 -1.3106 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 0.9214 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 -0.0786 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.6783 1.2261 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.2619 -1.3106 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 1.4214 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -0.5786 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.7619 -2.1767 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.7619 -0.4446 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 0.9214 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -0.0786 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
10.7619 -2.1767 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
10.7619 -0.4446 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
11.2619 -1.3106 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.1793 -0.6567 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.8695 -1.0552 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.8445 0.6335 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.1542 1.0320 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.3445 -0.2326 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.6542 0.1660 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.6793 -1.5227 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.3695 -1.9212 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.8709 -0.9726 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 2.0414 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -1.1986 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.4519 -2.7136 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.4519 0.0923 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4631 1.2314 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4631 -0.3886 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
11.0719 -2.7136 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
11.0719 0.0923 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
11.8819 -1.3106 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
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2 10 1 0 0 0 0
3 9 1 0 0 0 0
3 29 1 0 0 0 0
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4 6 1 0 0 0 0
4 21 1 0 0 0 0
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5 23 1 0 0 0 0
5 24 1 0 0 0 0
6 7 1 0 0 0 0
6 25 1 0 0 0 0
6 26 1 0 0 0 0
7 11 1 0 0 0 0
7 27 1 0 0 0 0
7 28 1 0 0 0 0
8 9 1 0 0 0 0
8 10 1 0 0 0 0
8 12 2 0 0 0 0
9 13 2 0 0 0 0
11 14 2 0 0 0 0
11 15 1 0 0 0 0
12 16 1 0 0 0 0
12 30 1 0 0 0 0
13 17 1 0 0 0 0
13 31 1 0 0 0 0
14 18 1 0 0 0 0
14 32 1 0 0 0 0
15 19 2 0 0 0 0
15 33 1 0 0 0 0
16 17 2 0 0 0 0
16 34 1 0 0 0 0
17 35 1 0 0 0 0
18 20 2 0 0 0 0
18 36 1 0 0 0 0
19 20 1 0 0 0 0
19 37 1 0 0 0 0
20 38 1 0 0 0 0
M END
$$$$