B4OUR5
-OEChem-04022105362D
47 50 0 1 0 0 0 0 0999 V2000
2.0000 -1.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 -1.0000 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0
7.1962 -2.0000 0.0000 N 0 0 3 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
4.5981 0.5000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
8.9282 -4.0000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
9.7942 -2.5000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 2.5000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 4.0000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 -2.0000 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0
6.3301 -2.5000 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
7.1962 -1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 -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
8.0622 -2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.0622 -3.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.9282 -2.0000 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
3.7320 -2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 1.0000 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
3.7320 2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.7942 -3.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 3.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 3.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.9272 -1.6900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.9316 -2.9750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.7287 -2.9750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.7287 -0.0251 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.9316 -0.0251 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.8067 -1.1077 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.4082 -0.4174 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.2881 -1.9631 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.0611 -2.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.9081 -3.0369 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.5252 -3.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.9282 -1.3800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.1120 -2.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 -2.6200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.3520 -2.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3291 0.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
10.3312 -3.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.1350 2.1900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.1350 3.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3291 3.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 19 2 0 0 0 0
2 10 1 0 0 0 0
2 12 1 0 0 0 0
2 15 1 0 0 0 0
3 11 1 0 0 0 0
3 13 1 0 0 0 0
3 16 1 0 0 0 0
4 15 1 0 0 0 0
4 19 1 0 0 0 0
4 20 1 0 0 0 0
5 15 2 0 0 0 0
5 21 1 0 0 0 0
6 17 2 0 0 0 0
6 24 1 0 0 0 0
7 18 1 0 0 0 0
7 24 2 0 0 0 0
8 23 2 0 0 0 0
8 27 1 0 0 0 0
9 26 1 0 0 0 0
9 27 2 0 0 0 0
10 11 1 0 0 0 0
10 14 1 1 0 0 0
10 28 1 0 0 0 0
11 29 1 0 0 0 0
11 30 1 0 0 0 0
12 13 1 0 0 0 0
12 31 1 0 0 0 0
12 32 1 0 0 0 0
13 33 1 0 0 0 0
13 34 1 0 0 0 0
14 35 1 0 0 0 0
14 36 1 0 0 0 0
14 37 1 0 0 0 0
16 17 1 0 0 0 0
16 18 2 0 0 0 0
17 38 1 0 0 0 0
18 39 1 0 0 0 0
19 22 1 0 0 0 0
20 40 1 0 0 0 0
20 41 1 0 0 0 0
20 42 1 0 0 0 0
21 22 2 0 0 0 0
21 23 1 0 0 0 0
22 43 1 0 0 0 0
23 25 1 0 0 0 0
24 44 1 0 0 0 0
25 26 2 0 0 0 0
25 45 1 0 0 0 0
26 46 1 0 0 0 0
27 47 1 0 0 0 0
M END
$$$$