D0W9VC
-OEChem-10101305032D
31 32 0 0 0 0 0 0 0999 V2000
5.3147 2.9462 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0
3.4782 -4.0483 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0
6.3147 2.9462 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.3147 2.9462 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.5827 -1.0538 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
5.3147 -1.0538 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
5.3147 3.9462 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
5.3147 1.9462 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.3147 -0.0538 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.4487 -2.5538 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.4487 1.4462 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.1808 1.4462 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.4487 0.4462 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.1808 0.4462 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.4487 -1.5538 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.5827 -3.0538 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6691 -2.6470 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -3.3902 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5000 -4.2562 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.6608 -3.1364 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.0593 -2.4461 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.9118 1.7562 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.7177 1.7562 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.9118 0.1362 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.7177 0.1362 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.8517 -1.3638 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.5402 -2.0406 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.3834 -3.3254 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.8517 4.2562 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.7778 4.2562 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.2478 -4.8226 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 3 2 0 0 0 0
1 4 2 0 0 0 0
1 7 1 0 0 0 0
1 8 1 0 0 0 0
2 16 1 0 0 0 0
2 19 1 0 0 0 0
5 15 2 0 0 0 0
6 9 1 0 0 0 0
6 15 1 0 0 0 0
6 26 1 0 0 0 0
7 29 1 0 0 0 0
7 30 1 0 0 0 0
8 11 2 0 0 0 0
8 12 1 0 0 0 0
9 13 2 0 0 0 0
9 14 1 0 0 0 0
10 15 1 0 0 0 0
10 16 1 0 0 0 0
10 20 1 0 0 0 0
10 21 1 0 0 0 0
11 13 1 0 0 0 0
11 22 1 0 0 0 0
12 14 2 0 0 0 0
12 23 1 0 0 0 0
13 24 1 0 0 0 0
14 25 1 0 0 0 0
16 17 2 0 0 0 0
17 18 1 0 0 0 0
17 27 1 0 0 0 0
18 19 2 0 0 0 0
18 28 1 0 0 0 0
19 31 1 0 0 0 0
M END
$$$$