BR0SG8
-OEChem-04012118262D
36 38 0 0 0 0 0 0 0999 V2000
5.9209 2.9120 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
7.2566 1.4234 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.6783 -2.4996 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
5.2619 -1.6948 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -2.6948 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -1.1948 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 0.3052 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 -1.1948 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.6783 -0.8901 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 -2.1948 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.9889 0.0604 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.9889 -3.4501 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -0.6948 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.9674 0.2666 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.3211 0.8047 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.9674 -3.6563 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.2781 1.2172 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.6318 1.7552 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.6103 1.9615 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -2.1948 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.2531 3.6563 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.3751 -3.5374 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.9684 -4.0697 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.3815 -0.1948 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.7144 0.6769 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.8396 -4.2630 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.5741 -3.7842 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.0953 -3.0496 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.2177 2.2167 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4631 -2.5048 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3291 0.6152 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.4030 0.6152 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.6707 0.9619 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.7145 4.0704 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.8390 4.1178 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.7916 3.2422 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 19 1 0 0 0 0
1 21 1 0 0 0 0
2 17 1 0 0 0 0
2 33 1 0 0 0 0
3 4 1 0 0 0 0
3 10 1 0 0 0 0
3 12 1 0 0 0 0
4 9 2 0 0 0 0
5 10 2 0 0 0 0
5 20 1 0 0 0 0
6 13 1 0 0 0 0
6 20 2 0 0 0 0
7 13 1 0 0 0 0
7 31 1 0 0 0 0
7 32 1 0 0 0 0
8 9 1 0 0 0 0
8 10 1 0 0 0 0
8 13 2 0 0 0 0
9 11 1 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 22 1 0 0 0 0
12 23 1 0 0 0 0
14 17 1 0 0 0 0
14 24 1 0 0 0 0
15 18 2 0 0 0 0
15 25 1 0 0 0 0
16 26 1 0 0 0 0
16 27 1 0 0 0 0
16 28 1 0 0 0 0
17 19 2 0 0 0 0
18 19 1 0 0 0 0
18 29 1 0 0 0 0
20 30 1 0 0 0 0
21 34 1 0 0 0 0
21 35 1 0 0 0 0
21 36 1 0 0 0 0
M END
$$$$