D08BOH
-OEChem-10101305022D
52 54 0 1 0 0 0 0 0999 V2000
6.3782 -2.7756 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
8.0995 -3.2368 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
6.5949 1.9268 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
10.0590 1.9268 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.9511 -0.9085 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
8.3269 2.9268 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.5352 1.0478 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
6.5474 -1.1664 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0
7.4609 -1.5732 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0
5.8782 -1.9096 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.3395 -0.1883 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.3269 -1.0732 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.3564 -2.5677 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.3884 0.1207 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.3269 -0.0732 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.6453 -0.5484 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.1930 0.4268 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.4609 0.4268 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.1805 1.0989 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.4609 1.4268 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.1930 1.4268 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.6942 -0.2394 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.2294 1.4079 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.3269 1.9268 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.4863 0.7388 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.7289 1.4268 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
10.9250 1.4268 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -0.5995 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.9485 -1.0060 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.9809 -1.9108 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.4634 -1.4488 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.3766 -2.2740 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.9591 -0.1667 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.4258 0.4257 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.5390 -1.6558 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.9375 -0.9655 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.7742 -1.1548 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.7299 0.1168 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.9240 0.1168 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.6412 1.5137 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.1005 2.0143 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.8639 3.2368 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.4063 1.6542 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.4189 1.9638 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.1919 1.1168 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.0389 0.8899 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
10.6150 0.8899 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
11.4620 1.1168 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
11.2350 1.9638 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.1916 -0.0098 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4103 -0.4079 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.8084 -1.1892 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 10 1 0 0 0 0
1 13 1 0 0 0 0
2 13 2 0 0 0 0
3 20 1 0 0 0 0
3 26 1 0 0 0 0
4 21 1 0 0 0 0
4 27 1 0 0 0 0
5 22 1 0 0 0 0
5 28 1 0 0 0 0
6 24 1 0 0 0 0
6 42 1 0 0 0 0
7 25 1 0 0 0 0
7 43 1 0 0 0 0
8 9 1 0 0 0 0
8 10 1 0 0 0 0
8 11 1 1 0 0 0
8 29 1 0 0 0 0
9 12 1 6 0 0 0
9 13 1 0 0 0 0
9 30 1 0 0 0 0
10 31 1 0 0 0 0
10 32 1 0 0 0 0
11 14 1 0 0 0 0
11 33 1 0 0 0 0
11 34 1 0 0 0 0
12 15 1 0 0 0 0
12 35 1 0 0 0 0
12 36 1 0 0 0 0
14 16 2 0 0 0 0
14 19 1 0 0 0 0
15 17 2 0 0 0 0
15 18 1 0 0 0 0
16 22 1 0 0 0 0
16 37 1 0 0 0 0
17 21 1 0 0 0 0
17 38 1 0 0 0 0
18 20 2 0 0 0 0
18 39 1 0 0 0 0
19 23 2 0 0 0 0
19 40 1 0 0 0 0
20 24 1 0 0 0 0
21 24 2 0 0 0 0
22 25 2 0 0 0 0
23 25 1 0 0 0 0
23 41 1 0 0 0 0
26 44 1 0 0 0 0
26 45 1 0 0 0 0
26 46 1 0 0 0 0
27 47 1 0 0 0 0
27 48 1 0 0 0 0
27 49 1 0 0 0 0
28 50 1 0 0 0 0
28 51 1 0 0 0 0
28 52 1 0 0 0 0
M END
$$$$