B7R0PY
-OEChem-04012118482D
29 31 0 0 0 0 0 0 0999 V2000
3.7243 -0.9713 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0
4.6024 3.5980 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.8704 3.5980 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
6.3345 3.5980 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -2.9780 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.6024 1.5980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.6185 0.5564 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7364 2.0980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4685 2.0980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7205 0.0287 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4956 0.0937 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8264 1.5911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8184 0.5495 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.3279 1.6032 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.3414 0.6116 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7364 3.0980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4685 3.0980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8602 -1.4746 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8641 -2.4746 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.5155 -0.5260 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.2931 1.9073 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.2803 0.2416 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.8626 1.9172 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.8843 0.3122 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.6459 -0.8928 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.2501 -1.5846 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.0784 -3.0564 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.4742 -2.3646 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0024 -3.5980 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 10 1 0 0 0 0
1 18 1 0 0 0 0
2 16 1 0 0 0 0
2 17 1 0 0 0 0
3 16 2 0 0 0 0
4 17 2 0 0 0 0
5 19 1 0 0 0 0
5 29 1 0 0 0 0
6 7 1 0 0 0 0
6 8 2 0 0 0 0
6 9 1 0 0 0 0
7 10 2 0 0 0 0
7 11 1 0 0 0 0
8 12 1 0 0 0 0
8 16 1 0 0 0 0
9 14 2 0 0 0 0
9 17 1 0 0 0 0
10 13 1 0 0 0 0
11 15 2 0 0 0 0
11 20 1 0 0 0 0
12 13 2 0 0 0 0
12 21 1 0 0 0 0
13 22 1 0 0 0 0
14 15 1 0 0 0 0
14 23 1 0 0 0 0
15 24 1 0 0 0 0
18 19 1 0 0 0 0
18 25 1 0 0 0 0
18 26 1 0 0 0 0
19 27 1 0 0 0 0
19 28 1 0 0 0 0
M END
$$$$