BHU2X5
-OEChem-04022108252D
45 47 0 0 0 0 0 0 0999 V2000
10.6603 -0.1550 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 -3.1550 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -3.1550 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0
11.1603 0.7110 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
10.1603 -1.0210 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 2.8450 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 1.3450 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
6.3301 0.3450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 -1.1550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.7942 0.3450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.0622 1.3450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.3301 1.3450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 -0.1550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.1962 1.8450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 -1.6550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.7942 1.3450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.9282 -0.1550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.9282 1.8450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.0622 0.3450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.1962 -0.1550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.3301 -1.6550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.1962 -1.1550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
11.5263 -0.6550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 -2.6550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 -1.1550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 1.8450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 -3.1550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -1.6550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -2.6550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.9272 0.1550 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.1962 2.4650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
10.3312 1.6550 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.9282 -0.7750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.9282 2.4650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.5252 0.0350 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.7331 0.1550 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.3301 -2.2750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.7331 -1.4650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
11.2163 -1.1919 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
12.0632 -0.9650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
11.8363 -0.1181 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 -0.5350 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 -3.7750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3291 -1.3450 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.9272 3.1550 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 4 2 0 0 0 0
1 5 2 0 0 0 0
1 10 1 0 0 0 0
1 23 1 0 0 0 0
2 24 1 0 0 0 0
3 29 1 0 0 0 0
6 26 1 0 0 0 0
6 45 1 0 0 0 0
7 26 2 0 0 0 0
8 12 1 0 0 0 0
8 13 1 0 0 0 0
8 20 2 0 0 0 0
9 13 2 0 0 0 0
9 15 1 0 0 0 0
9 21 1 0 0 0 0
10 16 2 0 0 0 0
10 17 1 0 0 0 0
11 14 1 0 0 0 0
11 18 2 0 0 0 0
11 19 1 0 0 0 0
12 14 2 0 0 0 0
12 26 1 0 0 0 0
13 30 1 0 0 0 0
14 31 1 0 0 0 0
15 24 2 0 0 0 0
15 25 1 0 0 0 0
16 18 1 0 0 0 0
16 32 1 0 0 0 0
17 19 2 0 0 0 0
17 33 1 0 0 0 0
18 34 1 0 0 0 0
19 35 1 0 0 0 0
20 22 1 0 0 0 0
20 36 1 0 0 0 0
21 22 2 0 0 0 0
21 37 1 0 0 0 0
22 38 1 0 0 0 0
23 39 1 0 0 0 0
23 40 1 0 0 0 0
23 41 1 0 0 0 0
24 27 1 0 0 0 0
25 28 2 0 0 0 0
25 42 1 0 0 0 0
27 29 2 0 0 0 0
27 43 1 0 0 0 0
28 29 1 0 0 0 0
28 44 1 0 0 0 0
M END
$$$$