B3CMW1
-OEChem-04012114312D
24 25 0 0 0 0 0 0 0999 V2000
2.2788 0.2063 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0
2.4067 2.8799 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
3.0878 -0.3815 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.0878 -1.3815 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5878 1.1573 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.8968 0.2063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.5878 1.1573 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 1.9664 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2218 -1.8815 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.9538 -1.8815 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2218 -2.8815 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.9538 -2.8815 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.0878 -3.3815 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.4865 0.0147 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.9522 1.6589 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4860 2.3131 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.5693 1.5204 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.6848 -1.5715 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.4908 -1.5715 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.6848 -3.1915 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.4908 -3.1915 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.0878 -4.0015 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0423 3.3815 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.0233 2.9447 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 3 1 0 0 0 0
1 5 1 0 0 0 0
2 8 1 0 0 0 0
2 23 1 0 0 0 0
2 24 1 0 0 0 0
3 4 1 0 0 0 0
3 6 2 0 0 0 0
4 9 2 0 0 0 0
4 10 1 0 0 0 0
5 7 2 0 0 0 0
5 8 1 0 0 0 0
6 7 1 0 0 0 0
6 14 1 0 0 0 0
7 15 1 0 0 0 0
8 16 1 0 0 0 0
8 17 1 0 0 0 0
9 11 1 0 0 0 0
9 18 1 0 0 0 0
10 12 2 0 0 0 0
10 19 1 0 0 0 0
11 13 2 0 0 0 0
11 20 1 0 0 0 0
12 13 1 0 0 0 0
12 21 1 0 0 0 0
13 22 1 0 0 0 0
M END
$$$$