BXD7Q8
-OEChem-04022101022D
37 38 0 0 0 0 0 0 0999 V2000
2.8660 -1.0000 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0
2.3660 -0.1340 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.3660 -1.8660 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 0.5000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 -0.5000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
6.3301 -2.0000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
7.1962 0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.3301 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.1962 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 -1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.0622 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.3301 2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.0622 -1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 -2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.0622 2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.1962 2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.3301 -1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 -2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.5856 -0.3923 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.9841 -1.0826 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.9272 0.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.5991 0.6900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.7932 2.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 0.1200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.7522 -1.5369 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.5991 -1.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.3722 -0.4631 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.0611 -2.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.8671 -0.6900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.5991 2.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.1962 3.1200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.6900 -0.9631 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4631 -1.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3100 -2.0369 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 -3.1200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 2 2 0 0 0 0
1 3 2 0 0 0 0
1 5 1 0 0 0 0
1 19 1 0 0 0 0
4 8 1 0 0 0 0
4 9 1 0 0 0 0
4 23 1 0 0 0 0
5 11 1 0 0 0 0
5 26 1 0 0 0 0
6 18 2 0 0 0 0
6 20 1 0 0 0 0
7 8 1 0 0 0 0
7 10 1 0 0 0 0
7 12 2 0 0 0 0
8 13 2 0 0 0 0
9 11 2 0 0 0 0
9 18 1 0 0 0 0
10 14 1 0 0 0 0
10 21 1 0 0 0 0
10 22 1 0 0 0 0
11 15 1 0 0 0 0
12 16 1 0 0 0 0
12 24 1 0 0 0 0
13 17 1 0 0 0 0
13 25 1 0 0 0 0
14 27 1 0 0 0 0
14 28 1 0 0 0 0
14 29 1 0 0 0 0
15 20 2 0 0 0 0
15 30 1 0 0 0 0
16 17 2 0 0 0 0
16 32 1 0 0 0 0
17 33 1 0 0 0 0
18 31 1 0 0 0 0
19 34 1 0 0 0 0
19 35 1 0 0 0 0
19 36 1 0 0 0 0
20 37 1 0 0 0 0
M END
$$$$