B9R3XB
-OEChem-04012114482D
32 33 0 0 0 0 0 0 0999 V2000
6.3301 3.1550 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0
6.3301 4.1550 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0
7.1962 3.6550 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 3.6550 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0
7.1962 2.6550 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 2.6550 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -3.8450 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -2.3450 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 0.1550 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
6.3301 2.1550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 1.6550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.1962 1.6550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 0.6550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.1962 0.6550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.3301 0.1550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 -0.8450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 -1.3450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 -1.3450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 -2.3450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 -2.3450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 -2.8450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -2.8450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.9272 1.9650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.7331 1.9650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.7331 0.3450 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.3301 -0.4650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.0611 0.4650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.1951 -1.0350 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.0010 -1.0350 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.0010 -2.6550 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 -3.4650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3291 -4.1550 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 2 1 0 0 0 0
1 3 1 0 0 0 0
1 4 1 0 0 0 0
1 5 1 0 0 0 0
1 6 1 0 0 0 0
1 10 1 0 0 0 0
7 22 1 0 0 0 0
7 32 1 0 0 0 0
8 22 2 0 0 0 0
9 13 1 0 0 0 0
9 16 1 0 0 0 0
9 27 1 0 0 0 0
10 11 1 0 0 0 0
10 12 2 0 0 0 0
11 13 2 0 0 0 0
11 23 1 0 0 0 0
12 14 1 0 0 0 0
12 24 1 0 0 0 0
13 15 1 0 0 0 0
14 15 2 0 0 0 0
14 25 1 0 0 0 0
15 26 1 0 0 0 0
16 17 1 0 0 0 0
16 18 2 0 0 0 0
17 19 2 0 0 0 0
17 28 1 0 0 0 0
18 20 1 0 0 0 0
18 29 1 0 0 0 0
19 21 1 0 0 0 0
19 22 1 0 0 0 0
20 21 2 0 0 0 0
20 30 1 0 0 0 0
21 31 1 0 0 0 0
M END
$$$$