B4K9MD
-OEChem-04012118222D
30 31 0 0 0 0 0 0 0999 V2000
2.3660 -1.9510 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -3.3170 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0
3.3660 -3.6830 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 0.6830 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 0.6830 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 2.1830 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
7.1962 1.6830 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 -0.8170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 -2.3170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 -1.3170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 -1.3170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 0.1830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 -2.8170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 1.6830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 -2.3170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -2.8170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.3301 2.1830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.3301 3.1830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 3.6830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 3.1830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.1951 -1.0070 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.0010 -1.0070 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 -3.4370 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.0010 -2.6270 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.0010 0.3730 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.8671 3.4930 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 4.3030 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.0611 3.4930 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.7331 1.9930 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.1962 1.0630 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 16 1 0 0 0 0
2 16 1 0 0 0 0
3 16 1 0 0 0 0
4 12 2 0 0 0 0
5 12 1 0 0 0 0
5 14 1 0 0 0 0
5 25 1 0 0 0 0
6 14 1 0 0 0 0
6 20 2 0 0 0 0
7 17 1 0 0 0 0
7 29 1 0 0 0 0
7 30 1 0 0 0 0
8 10 2 0 0 0 0
8 11 1 0 0 0 0
8 12 1 0 0 0 0
9 10 1 0 0 0 0
9 13 2 0 0 0 0
9 16 1 0 0 0 0
10 21 1 0 0 0 0
11 15 2 0 0 0 0
11 22 1 0 0 0 0
13 15 1 0 0 0 0
13 23 1 0 0 0 0
14 17 2 0 0 0 0
15 24 1 0 0 0 0
17 18 1 0 0 0 0
18 19 2 0 0 0 0
18 26 1 0 0 0 0
19 20 1 0 0 0 0
19 27 1 0 0 0 0
20 28 1 0 0 0 0
M END
$$$$