D0D1PE
-OEChem-10101305022D
27 29 0 0 0 0 0 0 0999 V2000
8.0321 -0.0608 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.5274 0.8518 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -0.2724 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
4.0274 -0.6871 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.0274 -0.6871 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.3424 -1.4718 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7183 0.2640 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.3364 0.2640 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3219 -1.2631 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.7123 -1.4718 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.7029 0.4963 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.3518 0.4963 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.0547 -0.2724 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.7328 -1.2631 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.7040 -0.8013 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.1160 -2.0490 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.8724 -1.7936 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.5274 1.4718 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.7081 -1.3510 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3034 -1.8828 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.5139 -2.0592 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.5182 1.0881 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.5365 1.0881 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.1459 -1.7254 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.2449 -1.2180 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.1207 -1.2605 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.1632 -0.3847 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 13 1 0 0 0 0
1 15 1 0 0 0 0
2 7 1 0 0 0 0
2 8 1 0 0 0 0
2 18 1 0 0 0 0
3 9 1 0 0 0 0
3 11 2 0 0 0 0
4 5 1 0 0 0 0
4 6 1 0 0 0 0
4 7 2 0 0 0 0
5 8 2 0 0 0 0
5 10 1 0 0 0 0
6 9 1 0 0 0 0
6 16 1 0 0 0 0
6 17 1 0 0 0 0
7 11 1 0 0 0 0
8 12 1 0 0 0 0
9 19 1 0 0 0 0
9 20 1 0 0 0 0
10 14 2 0 0 0 0
10 21 1 0 0 0 0
11 22 1 0 0 0 0
12 13 2 0 0 0 0
12 23 1 0 0 0 0
13 14 1 0 0 0 0
14 24 1 0 0 0 0
15 25 1 0 0 0 0
15 26 1 0 0 0 0
15 27 1 0 0 0 0
M END
$$$$