BRD03F
-OEChem-04012113182D
48 51 0 0 0 0 0 0 0999 V2000
3.6730 1.9301 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.6730 -0.0699 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
5.4050 1.9301 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
3.6730 -1.0699 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5092 -2.5182 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.9819 -2.9533 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8368 -2.5182 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5092 -1.5527 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.9819 -1.9080 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8368 -1.5527 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.8876 -3.4301 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.6730 -2.8210 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -3.0010 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5390 0.4301 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5390 1.4301 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.2711 1.4301 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4050 2.9301 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.1371 1.9301 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.2711 3.4301 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.1371 2.9301 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.1016 -2.7009 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8478 -3.5586 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.3444 -2.1622 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.1198 -1.6603 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.7212 -0.9701 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.6383 -1.3920 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3885 -2.0875 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.6247 -0.9701 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.2262 -1.6603 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.5782 -3.9674 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.4127 -3.7597 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.3030 -3.3185 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.0430 -3.3185 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.5188 -2.6101 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.8068 -3.5901 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.1361 0.2401 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.7511 -0.1525 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.1496 0.5378 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.8725 0.9552 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.6696 0.9552 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.1930 3.5127 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.7945 2.8224 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.3492 1.3475 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.7477 2.0378 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.6696 3.9051 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.8725 3.9051 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.7477 2.8225 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.3491 3.5127 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 15 2 0 0 0 0
2 4 1 0 0 0 0
2 14 1 0 0 0 0
2 36 1 0 0 0 0
3 15 1 0 0 0 0
3 16 1 0 0 0 0
3 17 1 0 0 0 0
4 8 1 0 0 0 0
4 9 1 0 0 0 0
4 10 1 0 0 0 0
5 8 1 0 0 0 0
5 11 1 0 0 0 0
5 12 1 0 0 0 0
5 21 1 0 0 0 0
6 9 1 0 0 0 0
6 11 1 0 0 0 0
6 13 1 0 0 0 0
6 22 1 0 0 0 0
7 10 1 0 0 0 0
7 12 1 0 0 0 0
7 13 1 0 0 0 0
7 23 1 0 0 0 0
8 24 1 0 0 0 0
8 25 1 0 0 0 0
9 26 1 0 0 0 0
9 27 1 0 0 0 0
10 28 1 0 0 0 0
10 29 1 0 0 0 0
11 30 1 0 0 0 0
11 31 1 0 0 0 0
12 32 1 0 0 0 0
12 33 1 0 0 0 0
13 34 1 0 0 0 0
13 35 1 0 0 0 0
14 15 1 0 0 0 0
14 37 1 0 0 0 0
14 38 1 0 0 0 0
16 18 1 0 0 0 0
16 39 1 0 0 0 0
16 40 1 0 0 0 0
17 19 1 0 0 0 0
17 41 1 0 0 0 0
17 42 1 0 0 0 0
18 20 1 0 0 0 0
18 43 1 0 0 0 0
18 44 1 0 0 0 0
19 20 1 0 0 0 0
19 45 1 0 0 0 0
19 46 1 0 0 0 0
20 47 1 0 0 0 0
20 48 1 0 0 0 0
M END
$$$$