BHY0E3
-OEChem-04012115253D
27 28 0 0 0 0 0 0 0999 V2000
-1.6849 1.2878 -0.0057 S 0 0 0 0 0 0 0 0 0 0 0 0
-3.4863 -2.0856 0.0051 O 0 0 0 0 0 0 0 0 0 0 0 0
-4.0194 2.5174 -0.0103 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.9922 0.1858 -0.0045 N 0 0 0 0 0 0 0 0 0 0 0 0
3.4009 -0.0986 0.0059 C 0 0 0 0 0 0 0 0 0 0 0 0
4.8357 0.3083 0.0055 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7173 -0.8609 0.0059 C 0 0 0 0 0 0 0 0 0 0 0 0
2.7374 -0.3157 -1.2019 C 0 0 0 0 0 0 0 0 0 0 0 0
2.7226 -0.2629 1.2136 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3956 -0.6967 -1.2017 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3808 -0.6441 1.2135 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6816 -1.2593 0.0057 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7480 -0.4333 0.0012 C 0 0 0 0 0 0 0 0 0 0 0 0
5.0094 1.8245 -0.0261 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.1508 -0.9107 0.0013 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.4368 1.4439 -0.0076 C 0 0 0 0 0 0 0 0 0 0 0 0
5.3401 -0.0972 0.8916 H 0 0 0 0 0 0 0 0 0 0 0 0
5.3504 -0.1350 -0.8562 H 0 0 0 0 0 0 0 0 0 0 0 0
3.2543 -0.1895 -2.1495 H 0 0 0 0 0 0 0 0 0 0 0 0
3.2278 -0.0954 2.1612 H 0 0 0 0 0 0 0 0 0 0 0 0
0.8924 -0.8623 -2.1514 H 0 0 0 0 0 0 0 0 0 0 0 0
0.8660 -0.7683 2.1633 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.8384 -2.3361 0.0084 H 0 0 0 0 0 0 0 0 0 0 0 0
4.5546 2.2565 -0.9240 H 0 0 0 0 0 0 0 0 0 0 0 0
6.0730 2.0830 -0.0254 H 0 0 0 0 0 0 0 0 0 0 0 0
4.5442 2.2947 0.8468 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.9997 0.0641 -0.0052 H 0 0 0 0 0 0 0 0 0 0 0 0
1 13 1 0 0 0 0
1 16 1 0 0 0 0
2 15 2 0 0 0 0
3 16 2 0 0 0 0
4 15 1 0 0 0 0
4 16 1 0 0 0 0
4 27 1 0 0 0 0
5 6 1 0 0 0 0
5 8 2 0 0 0 0
5 9 1 0 0 0 0
6 14 1 0 0 0 0
6 17 1 0 0 0 0
6 18 1 0 0 0 0
7 10 2 0 0 0 0
7 11 1 0 0 0 0
7 12 1 0 0 0 0
8 10 1 0 0 0 0
8 19 1 0 0 0 0
9 11 2 0 0 0 0
9 20 1 0 0 0 0
10 21 1 0 0 0 0
11 22 1 0 0 0 0
12 13 2 0 0 0 0
12 23 1 0 0 0 0
13 15 1 0 0 0 0
14 24 1 0 0 0 0
14 25 1 0 0 0 0
14 26 1 0 0 0 0
M END
$$$$