BLQA14
-OEChem-04012115452D
25 27 0 0 0 0 0 0 0999 V2000
4.0948 -0.7248 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0
3.0778 1.6546 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.7099 -1.8462 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
8.6096 -1.0350 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
2.6166 -0.0667 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
5.9313 0.2698 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.6634 0.2698 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.6634 -0.7302 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.7974 0.7698 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.0653 0.7698 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.9313 -0.7302 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.1993 0.2698 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.7974 -1.2302 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.6096 0.5745 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.2857 0.6765 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.1932 -0.2302 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.1166 -0.9327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.7974 1.3898 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.0653 1.3898 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.3944 -1.0402 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.7974 -1.8502 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.8022 1.1638 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.8132 -0.2302 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -0.0018 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.4882 1.8462 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 12 1 0 0 0 0
1 17 1 0 0 0 0
2 15 1 0 0 0 0
2 25 1 0 0 0 0
3 17 2 0 0 0 0
4 8 2 0 0 0 0
4 16 1 0 0 0 0
5 15 1 0 0 0 0
5 17 1 0 0 0 0
5 24 1 0 0 0 0
6 9 1 0 0 0 0
6 10 2 0 0 0 0
6 11 1 0 0 0 0
7 8 1 0 0 0 0
7 9 2 0 0 0 0
7 14 1 0 0 0 0
8 13 1 0 0 0 0
9 18 1 0 0 0 0
10 12 1 0 0 0 0
10 19 1 0 0 0 0
11 13 2 0 0 0 0
11 20 1 0 0 0 0
12 15 2 0 0 0 0
13 21 1 0 0 0 0
14 16 2 0 0 0 0
14 22 1 0 0 0 0
16 23 1 0 0 0 0
M END
$$$$