BJV05P
-OEChem-04012116212D
29 29 0 1 0 0 0 0 0999 V2000
3.0000 1.2500 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0
3.0000 0.2500 0.0000 P 0 0 1 0 0 0 0 0 0 0 0 0
4.0000 0.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 0.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.0000 -0.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1340 -1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.8660 -1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.8660 1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5000 1.1160 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1340 -2.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.8660 -2.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.0000 -2.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.8660 2.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.5000 1.1160 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.5970 -0.9400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.4030 -0.9400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.0781 1.1674 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.4766 1.8577 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.6077 1.7266 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.9174 1.3281 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.5970 -2.5600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.4030 -2.5600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.0000 -3.3700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.4860 2.7500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.8660 3.3700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.2460 2.7500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.5000 0.4960 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.1200 1.1160 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.5000 1.7360 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 2 1 0 0 0 0
1 8 1 0 0 0 0
2 3 1 1 0 0 0
2 4 2 0 0 0 0
2 5 1 0 0 0 0
3 9 1 0 0 0 0
5 6 2 0 0 0 0
5 7 1 0 0 0 0
6 10 1 0 0 0 0
6 15 1 0 0 0 0
7 11 2 0 0 0 0
7 16 1 0 0 0 0
8 13 1 0 0 0 0
8 17 1 0 0 0 0
8 18 1 0 0 0 0
9 14 1 0 0 0 0
9 19 1 0 0 0 0
9 20 1 0 0 0 0
10 12 2 0 0 0 0
10 21 1 0 0 0 0
11 12 1 0 0 0 0
11 22 1 0 0 0 0
12 23 1 0 0 0 0
13 24 1 0 0 0 0
13 25 1 0 0 0 0
13 26 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
M END
$$$$