BA7H5W
-OEChem-04022106052D
25 26 0 1 0 0 0 0 0999 V2000
3.6750 -0.7063 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.5471 -3.3799 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 0.8815 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 3.8815 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 0.8815 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 2.3815 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -0.1185 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0
3.3660 -1.6573 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0
2.0570 -0.7063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3660 -1.6573 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.9538 -2.4664 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 1.3815 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 1.3815 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 2.3815 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 2.8815 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.4184 0.1630 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.9784 -1.5603 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4674 -0.5147 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0016 -2.1589 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.4678 -2.8131 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.3845 -2.0204 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4631 1.0715 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.2690 2.6915 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4631 2.6915 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.9115 -3.8815 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 7 1 0 0 0 0
1 8 1 0 0 0 0
2 11 1 0 0 0 0
2 25 1 0 0 0 0
3 12 2 0 0 0 0
4 15 2 0 0 0 0
7 5 1 6 0 0 0
5 12 1 0 0 0 0
5 13 1 0 0 0 0
6 12 1 0 0 0 0
6 15 1 0 0 0 0
6 23 1 0 0 0 0
7 9 1 0 0 0 0
7 16 1 0 0 0 0
8 10 1 0 0 0 0
8 11 1 6 0 0 0
8 17 1 0 0 0 0
9 10 2 0 0 0 0
9 18 1 0 0 0 0
10 19 1 0 0 0 0
11 20 1 0 0 0 0
11 21 1 0 0 0 0
13 14 2 0 0 0 0
13 22 1 0 0 0 0
14 15 1 0 0 0 0
14 24 1 0 0 0 0
M END
$$$$