BW5JI7
-OEChem-04012119332D
41 43 0 1 0 0 0 0 0999 V2000
5.9213 1.2380 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
6.7863 -2.0330 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
5.0564 -2.0330 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
9.4260 0.3255 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.4166 0.3255 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.4766 2.5724 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
8.4804 -2.5724 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
6.4213 -0.3008 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0
5.4213 -0.3008 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.7304 0.6502 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.1123 0.6502 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.1063 -1.0856 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.1123 -1.2519 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.7364 -1.0856 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.0969 0.8825 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.7458 0.8825 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.1268 -0.8768 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7158 -0.8768 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.4487 0.1138 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.3940 0.1138 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7989 1.8371 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.7931 -1.6226 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.0496 -1.6226 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8232 2.0563 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.7720 -1.4184 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.5227 -1.0603 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.9207 -1.8415 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.7020 -1.4435 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.9305 1.4743 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.5872 -1.2095 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.6365 -2.0849 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.5119 -2.0356 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.6468 -2.4985 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.6154 0.9159 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.9591 2.6612 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.2183 2.1922 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.6873 1.4514 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -0.1337 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.8986 -2.0254 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
10.3790 -1.2918 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.6454 -0.8115 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 10 1 0 0 0 0
1 11 1 0 0 0 0
2 12 2 0 0 0 0
3 14 1 0 0 0 0
3 33 1 0 0 0 0
4 19 1 0 0 0 0
4 34 1 0 0 0 0
5 20 1 0 0 0 0
5 38 1 0 0 0 0
6 21 2 0 0 0 0
7 22 2 0 0 0 0
8 9 1 0 0 0 0
8 10 1 0 0 0 0
8 12 1 0 0 0 0
8 13 1 6 0 0 0
9 11 1 0 0 0 0
9 14 2 0 0 0 0
10 16 2 0 0 0 0
11 15 2 0 0 0 0
12 17 1 0 0 0 0
13 26 1 0 0 0 0
13 27 1 0 0 0 0
13 28 1 0 0 0 0
14 18 1 0 0 0 0
15 20 1 0 0 0 0
15 21 1 0 0 0 0
16 19 1 0 0 0 0
16 29 1 0 0 0 0
17 19 2 0 0 0 0
17 22 1 0 0 0 0
18 20 2 0 0 0 0
18 23 1 0 0 0 0
21 24 1 0 0 0 0
22 25 1 0 0 0 0
23 30 1 0 0 0 0
23 31 1 0 0 0 0
23 32 1 0 0 0 0
24 35 1 0 0 0 0
24 36 1 0 0 0 0
24 37 1 0 0 0 0
25 39 1 0 0 0 0
25 40 1 0 0 0 0
25 41 1 0 0 0 0
M END
$$$$