BO0XA5
-OEChem-04022102292D
52 54 0 1 0 0 0 0 0999 V2000
1.7320 8.3648 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0
1.7320 4.3648 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0
0.0000 5.3648 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0
11.3241 9.3648 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0
10.3241 10.3648 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0
10.3241 8.3648 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0
4.4605 1.7320 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0
4.0945 0.3660 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0
5.4605 0.0000 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0
6.6926 0.8660 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
5.8266 2.3660 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
5.1962 8.3648 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0
4.3301 5.8648 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
6.9282 8.3648 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
7.7942 8.8648 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
8.7404 10.1695 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
3.4641 7.3648 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0
4.3301 6.8648 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0
3.4641 8.3648 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.1962 7.3648 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.3301 8.8648 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5981 6.8648 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.0622 8.8648 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7320 7.3648 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5981 5.8648 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.0622 9.8648 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7320 5.3648 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8660 6.8648 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.9282 10.3648 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8660 5.8648 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.7942 9.8648 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.7404 8.5600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.3241 9.3648 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
10.3241 9.3648 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.9605 0.8660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.8266 1.3660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.9272 7.6748 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.8671 6.5548 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.2520 8.9474 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8535 8.2571 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.4082 6.7822 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.8067 7.4724 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.7287 9.3397 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.9316 9.3397 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.8671 5.5548 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.7932 5.5548 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.1350 5.5548 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.5252 10.1748 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
0.3291 7.1748 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.9282 10.9848 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.9331 7.9707 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.2295 1.1760 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 24 1 0 0 0 0
2 27 1 0 0 0 0
3 30 1 0 0 0 0
4 34 1 0 0 0 0
5 34 1 0 0 0 0
6 34 1 0 0 0 0
7 35 1 0 0 0 0
8 35 1 0 0 0 0
9 35 1 0 0 0 0
10 36 1 0 0 0 0
10 52 1 0 0 0 0
11 36 2 0 0 0 0
12 20 1 0 0 0 0
12 21 1 0 0 0 0
12 23 1 0 0 0 0
18 13 1 6 0 0 0
13 45 1 0 0 0 0
13 46 1 0 0 0 0
14 15 1 0 0 0 0
14 23 2 0 0 0 0
15 31 1 0 0 0 0
15 32 1 0 0 0 0
16 31 2 0 0 0 0
16 33 1 0 0 0 0
17 18 1 0 0 0 0
17 19 1 0 0 0 0
17 22 1 1 0 0 0
17 37 1 0 0 0 0
18 20 1 0 0 0 0
18 38 1 0 0 0 0
19 21 1 0 0 0 0
19 39 1 0 0 0 0
19 40 1 0 0 0 0
20 41 1 0 0 0 0
20 42 1 0 0 0 0
21 43 1 0 0 0 0
21 44 1 0 0 0 0
22 24 1 0 0 0 0
22 25 2 0 0 0 0
23 26 1 0 0 0 0
24 28 2 0 0 0 0
25 27 1 0 0 0 0
25 47 1 0 0 0 0
26 29 2 0 0 0 0
26 48 1 0 0 0 0
27 30 2 0 0 0 0
28 30 1 0 0 0 0
28 49 1 0 0 0 0
29 31 1 0 0 0 0
29 50 1 0 0 0 0
32 33 2 0 0 0 0
32 51 1 0 0 0 0
33 34 1 0 0 0 0
35 36 1 0 0 0 0
M END
$$$$