BU7V6A
-OEChem-04012116512D
46 49 0 0 0 0 0 0 0999 V2000
8.9282 -2.0000 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0
12.3923 2.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -2.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 0.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
10.6603 1.0000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 -1.0000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
8.9282 1.0000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
7.1962 1.0000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
9.7942 -0.5000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
8.0622 -0.5000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
10.6603 2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
11.5263 0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
11.5263 2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
12.3923 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 -2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.7942 0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 -1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.3301 0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.3301 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.0622 0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.9282 -1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
10.4482 2.5826 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
10.0497 1.8923 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
11.1278 0.0251 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
11.9248 0.0251 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
11.9248 2.9750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
11.1278 2.9750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
12.6044 0.4174 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
13.0029 1.1077 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.9441 -2.5826 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.3426 -1.8923 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.4675 -2.9750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.2646 -2.9750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.7880 -0.4174 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.3894 -1.1077 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 -1.6200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.0611 0.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.8671 -0.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 1.6200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.1962 1.6200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 27 1 0 0 0 0
2 13 1 0 0 0 0
2 14 1 0 0 0 0
3 17 1 0 0 0 0
3 20 1 0 0 0 0
4 19 2 0 0 0 0
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5 12 1 0 0 0 0
5 16 1 0 0 0 0
6 15 1 0 0 0 0
6 18 1 0 0 0 0
6 19 1 0 0 0 0
7 16 1 0 0 0 0
7 26 2 0 0 0 0
8 23 1 0 0 0 0
8 26 1 0 0 0 0
8 46 1 0 0 0 0
9 16 2 0 0 0 0
9 27 1 0 0 0 0
10 26 1 0 0 0 0
10 27 2 0 0 0 0
11 13 1 0 0 0 0
11 28 1 0 0 0 0
11 29 1 0 0 0 0
12 14 1 0 0 0 0
12 30 1 0 0 0 0
12 31 1 0 0 0 0
13 32 1 0 0 0 0
13 33 1 0 0 0 0
14 34 1 0 0 0 0
14 35 1 0 0 0 0
15 17 1 0 0 0 0
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15 37 1 0 0 0 0
17 38 1 0 0 0 0
17 39 1 0 0 0 0
18 21 2 0 0 0 0
18 22 1 0 0 0 0
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20 40 1 0 0 0 0
20 41 1 0 0 0 0
21 24 1 0 0 0 0
21 42 1 0 0 0 0
22 25 2 0 0 0 0
22 43 1 0 0 0 0
23 24 2 0 0 0 0
23 25 1 0 0 0 0
24 44 1 0 0 0 0
25 45 1 0 0 0 0
M END
$$$$