BJ7A6Q
-OEChem-04022100232D
34 35 0 1 0 0 0 0 0999 V2000
4.5134 -0.6048 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.6166 -2.3649 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
5.4364 0.9829 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
5.9677 -3.9830 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.7044 3.9830 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.7044 0.9829 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
5.7867 -2.2604 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
4.5704 2.4830 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
4.2044 -1.5559 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0
3.2044 -1.5559 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0
2.8954 -0.6048 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7044 -0.0171 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0
4.7922 -2.3649 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5704 1.4830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8384 1.4830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8384 2.4830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.3745 -3.0694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7044 2.9830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.3690 -2.9649 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.8168 -1.4589 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.4859 -2.1083 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.5854 -0.0679 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3290 -0.8570 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.2568 0.2644 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.2349 -2.6367 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.9631 -2.9609 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -2.3001 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.0389 -1.6940 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3014 1.1730 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.1074 2.7930 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3014 2.7930 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.4338 -3.5815 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.9856 -2.9001 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.3042 -2.3483 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 9 1 0 0 0 0
1 12 1 0 0 0 0
2 10 1 0 0 0 0
2 27 1 0 0 0 0
3 14 2 0 0 0 0
4 17 2 0 0 0 0
5 18 2 0 0 0 0
6 12 1 0 0 0 0
6 14 1 0 0 0 0
6 15 1 0 0 0 0
7 13 1 0 0 0 0
7 17 1 0 0 0 0
7 28 1 0 0 0 0
8 14 1 0 0 0 0
8 18 1 0 0 0 0
8 30 1 0 0 0 0
9 10 1 0 0 0 0
9 13 1 0 0 0 0
9 20 1 0 0 0 0
10 11 1 0 0 0 0
10 21 1 0 0 0 0
11 12 1 0 0 0 0
11 22 1 0 0 0 0
11 23 1 0 0 0 0
12 24 1 0 0 0 0
13 25 1 0 0 0 0
13 26 1 0 0 0 0
15 16 2 0 0 0 0
15 29 1 0 0 0 0
16 18 1 0 0 0 0
16 31 1 0 0 0 0
17 19 1 0 0 0 0
19 32 1 0 0 0 0
19 33 1 0 0 0 0
19 34 1 0 0 0 0
M END
$$$$