BWL63U
-OEChem-04022107372D
42 44 0 0 0 0 0 0 0999 V2000
2.8660 -4.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -2.0000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 0.5000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 0.5000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
6.3301 1.0000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 3.0000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 -2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 -3.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -3.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.3301 2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.1962 2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.0622 2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.1962 3.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.9282 2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.0622 4.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.9282 3.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.3426 -2.6077 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.9441 -1.9174 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.7880 -1.9174 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.3894 -2.6077 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.6540 -0.4174 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.2554 -1.1077 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.9441 -4.0826 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.3426 -3.3923 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.3894 -3.3923 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.7880 -4.0826 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.9441 -1.0826 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.3426 -0.3923 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.1951 0.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 3.1200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.0622 1.3800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.6592 3.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.4651 2.1900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.0622 4.6200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.4651 3.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 10 1 0 0 0 0
1 11 1 0 0 0 0
2 7 1 0 0 0 0
2 8 1 0 0 0 0
2 9 1 0 0 0 0
3 12 1 0 0 0 0
3 13 1 0 0 0 0
3 36 1 0 0 0 0
4 5 1 0 0 0 0
4 13 2 0 0 0 0
5 15 2 0 0 0 0
6 20 3 0 0 0 0
7 10 1 0 0 0 0
7 24 1 0 0 0 0
7 25 1 0 0 0 0
8 11 1 0 0 0 0
8 26 1 0 0 0 0
8 27 1 0 0 0 0
9 12 1 0 0 0 0
9 28 1 0 0 0 0
9 29 1 0 0 0 0
10 30 1 0 0 0 0
10 31 1 0 0 0 0
11 32 1 0 0 0 0
11 33 1 0 0 0 0
12 34 1 0 0 0 0
12 35 1 0 0 0 0
13 14 1 0 0 0 0
14 16 2 0 0 0 0
14 20 1 0 0 0 0
15 16 1 0 0 0 0
15 17 1 0 0 0 0
16 37 1 0 0 0 0
17 18 2 0 0 0 0
17 19 1 0 0 0 0
18 21 1 0 0 0 0
18 38 1 0 0 0 0
19 22 2 0 0 0 0
19 39 1 0 0 0 0
21 23 2 0 0 0 0
21 40 1 0 0 0 0
22 23 1 0 0 0 0
22 41 1 0 0 0 0
23 42 1 0 0 0 0
M END
$$$$