B5A6BG
-OEChem-04012119232D
33 34 0 0 0 0 0 0 0999 V2000
4.5981 -2.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -0.2500 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0
2.8660 1.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
8.9282 1.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
8.0622 0.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 1.2500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 0.2500 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0
4.5981 0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 -0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 -0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 -1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.3301 1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 -1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 -1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 2.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.1962 1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.3301 3.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.1962 2.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.0622 1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 -3.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.0611 1.5600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.0010 0.0600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.1951 -1.5600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.3301 0.6300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.0010 -1.5600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.9272 3.0600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.3301 3.8700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.7331 3.0600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.1541 -3.7869 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.0010 -3.5600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.7741 -2.7131 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.4651 1.4400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 14 1 0 0 0 0
1 21 1 0 0 0 0
2 7 1 0 0 0 0
3 7 2 0 0 0 0
4 20 1 0 0 0 0
4 33 1 0 0 0 0
5 20 2 0 0 0 0
6 8 1 0 0 0 0
6 9 1 0 0 0 0
6 22 1 0 0 0 0
7 10 1 0 0 0 0
8 10 2 0 0 0 0
8 11 1 0 0 0 0
9 13 1 0 0 0 0
9 16 2 0 0 0 0
10 12 1 0 0 0 0
11 15 2 0 0 0 0
11 23 1 0 0 0 0
12 14 2 0 0 0 0
12 24 1 0 0 0 0
13 17 2 0 0 0 0
13 25 1 0 0 0 0
14 15 1 0 0 0 0
15 26 1 0 0 0 0
16 18 1 0 0 0 0
16 27 1 0 0 0 0
17 19 1 0 0 0 0
17 20 1 0 0 0 0
18 19 2 0 0 0 0
18 28 1 0 0 0 0
19 29 1 0 0 0 0
21 30 1 0 0 0 0
21 31 1 0 0 0 0
21 32 1 0 0 0 0
M CHG 2 2 -1 7 1
M END
$$$$