B2ALG5
-OEChem-04012113252D
43 46 0 0 0 0 0 0 0999 V2000
10.7404 -1.8208 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 -0.0161 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
11.3241 -1.0161 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
6.3301 1.4839 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
12.0027 1.0466 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
10.4647 1.5492 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
12.0044 2.0466 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
11.0539 2.3572 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
7.1962 -0.0161 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.0622 -0.5161 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.3301 -0.5161 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 -0.0161 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.7942 -0.5161 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.7942 -1.5161 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.9282 -0.0161 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 -0.5161 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.0622 -1.5161 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.9282 -2.0161 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
10.7404 -0.2113 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.1962 0.9839 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.3301 -1.5161 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 0.9839 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -0.5161 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
11.0511 0.7392 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -0.0161 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.9282 0.6039 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.1996 -0.9910 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.9966 -0.9910 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.5252 -1.8261 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.9282 -2.6361 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.7331 1.2939 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.7101 -1.5161 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.3301 -2.1361 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.9501 -1.5161 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.9272 1.2939 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
10.9331 -2.4101 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 0.6039 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.4675 -0.9910 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.2646 -0.9910 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3100 0.5209 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4631 0.2939 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.6900 -0.5530 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
12.5067 2.4101 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 3 1 0 0 0 0
1 14 1 0 0 0 0
1 36 1 0 0 0 0
2 16 1 0 0 0 0
2 23 1 0 0 0 0
2 37 1 0 0 0 0
3 19 2 0 0 0 0
4 20 2 0 0 0 0
4 22 1 0 0 0 0
5 7 1 0 0 0 0
5 24 2 0 0 0 0
6 8 2 0 0 0 0
6 24 1 0 0 0 0
7 8 1 0 0 0 0
7 43 1 0 0 0 0
9 10 1 0 0 0 0
9 11 2 0 0 0 0
9 20 1 0 0 0 0
10 15 2 0 0 0 0
10 17 1 0 0 0 0
11 12 1 0 0 0 0
11 21 1 0 0 0 0
12 16 1 0 0 0 0
12 22 2 0 0 0 0
13 14 2 0 0 0 0
13 15 1 0 0 0 0
13 19 1 0 0 0 0
14 18 1 0 0 0 0
15 26 1 0 0 0 0
16 27 1 0 0 0 0
16 28 1 0 0 0 0
17 18 2 0 0 0 0
17 29 1 0 0 0 0
18 30 1 0 0 0 0
19 24 1 0 0 0 0
20 31 1 0 0 0 0
21 32 1 0 0 0 0
21 33 1 0 0 0 0
21 34 1 0 0 0 0
22 35 1 0 0 0 0
23 25 1 0 0 0 0
23 38 1 0 0 0 0
23 39 1 0 0 0 0
25 40 1 0 0 0 0
25 41 1 0 0 0 0
25 42 1 0 0 0 0
M END
$$$$