B69LNE
-OEChem-04022107253D
28 29 0 0 0 0 0 0 0999 V2000
4.0015 -1.4405 -0.0926 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.1437 -1.0799 -0.5578 N 0 0 0 0 0 0 0 0 0 0 0 0
4.2244 0.8648 0.0190 N 0 0 0 0 0 0 0 0 0 0 0 0
-0.6958 0.0034 0.0332 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1420 0.0406 0.0117 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0268 -0.1806 0.0129 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0351 1.0202 0.6263 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4218 0.9190 0.6116 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.8034 1.0973 -0.6142 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.8749 -0.9804 0.6166 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2067 -1.1438 -0.5524 C 0 0 0 0 0 0 0 0 0 0 0 0
3.4722 -0.3163 -0.0170 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.1977 1.1330 -0.6352 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.2692 -0.9448 0.5956 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.9305 0.1120 -0.0302 C 0 0 0 0 0 0 0 0 0 0 0 0
5.6686 0.8960 -0.0274 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4410 1.8715 1.1023 H 0 0 0 0 0 0 0 0 0 0 0 0
1.9942 1.7014 1.1008 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.2511 1.9004 -1.0966 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.3773 -1.8106 1.1125 H 0 0 0 0 0 0 0 0 0 0 0 0
1.6129 -2.0255 -1.0389 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.7127 1.9550 -1.1236 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.8401 -1.7393 1.0674 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.0162 0.1397 -0.0467 H 0 0 0 0 0 0 0 0 0 0 0 0
3.7551 1.7639 -0.0019 H 0 0 0 0 0 0 0 0 0 0 0 0
6.0145 1.7721 0.5260 H 0 0 0 0 0 0 0 0 0 0 0 0
5.9766 0.9746 -1.0729 H 0 0 0 0 0 0 0 0 0 0 0 0
6.0861 -0.0138 0.4108 H 0 0 0 0 0 0 0 0 0 0 0 0
1 12 2 0 0 0 0
2 4 2 0 0 0 0
2 11 1 0 0 0 0
3 12 1 0 0 0 0
3 16 1 0 0 0 0
3 25 1 0 0 0 0
4 5 1 0 0 0 0
4 7 1 0 0 0 0
5 9 2 0 0 0 0
5 10 1 0 0 0 0
6 8 1 0 0 0 0
6 11 2 0 0 0 0
6 12 1 0 0 0 0
7 8 2 0 0 0 0
7 17 1 0 0 0 0
8 18 1 0 0 0 0
9 13 1 0 0 0 0
9 19 1 0 0 0 0
10 14 2 0 0 0 0
10 20 1 0 0 0 0
11 21 1 0 0 0 0
13 15 2 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
16 26 1 0 0 0 0
16 27 1 0 0 0 0
16 28 1 0 0 0 0
M END
$$$$