BTWS09
-OEChem-04022110212D
27 27 0 0 0 0 0 0 0999 V2000
4.5981 2.9400 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 0.9400 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 2.4400 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -3.0600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -2.0600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -3.5600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 -3.5600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -1.5600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 -1.5600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -0.5600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 -0.5600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -0.0600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 1.4400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -3.6800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.6900 -3.0231 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4631 -3.8700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3100 -4.0969 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.4220 -4.0969 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.2690 -3.8700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.0420 -3.0231 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4631 -1.8700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.2690 -1.8700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4631 -0.2500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.2690 -0.2500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.2690 1.1300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.1951 2.7500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 3.5600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 3 1 0 0 0 0
1 27 1 0 0 0 0
2 12 1 0 0 0 0
2 13 2 0 0 0 0
3 13 1 0 0 0 0
3 26 1 0 0 0 0
4 5 1 0 0 0 0
4 6 1 0 0 0 0
4 7 1 0 0 0 0
4 14 1 0 0 0 0
5 8 2 0 0 0 0
5 9 1 0 0 0 0
6 15 1 0 0 0 0
6 16 1 0 0 0 0
6 17 1 0 0 0 0
7 18 1 0 0 0 0
7 19 1 0 0 0 0
7 20 1 0 0 0 0
8 10 1 0 0 0 0
8 21 1 0 0 0 0
9 11 2 0 0 0 0
9 22 1 0 0 0 0
10 12 2 0 0 0 0
10 23 1 0 0 0 0
11 12 1 0 0 0 0
11 24 1 0 0 0 0
13 25 1 0 0 0 0
M END
$$$$