BK9Y5R
-OEChem-04022100332D
22 23 0 1 0 0 0 0 0999 V2000
2.6200 0.6654 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.9431 -1.8769 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
5.7451 1.9134 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.5537 0.7100 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
5.5387 -1.3096 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
7.2571 0.6272 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
7.2651 -0.9822 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
4.1243 -0.1932 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0
4.5627 -1.0920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.3124 0.3178 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.1243 -0.1981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.3174 -0.6822 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.5275 0.9373 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.8447 -0.1746 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7918 0.3302 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.1647 1.1928 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.5428 -0.4131 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.2350 -0.8082 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.6797 -1.9134 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.4468 1.2175 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.4647 -0.1715 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 0.6623 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 11 1 0 0 0 0
1 22 1 0 0 0 0
2 9 2 0 0 0 0
3 13 2 0 0 0 0
4 8 1 0 0 0 0
4 13 1 0 0 0 0
4 16 1 0 0 0 0
5 9 1 0 0 0 0
5 12 1 0 0 0 0
5 19 1 0 0 0 0
6 10 1 0 0 0 0
6 14 1 0 0 0 0
6 20 1 0 0 0 0
7 12 1 0 0 0 0
7 14 2 0 0 0 0
8 9 1 0 0 0 0
8 11 1 0 0 0 0
8 15 1 0 0 0 0
10 12 2 0 0 0 0
10 13 1 0 0 0 0
11 17 1 0 0 0 0
11 18 1 0 0 0 0
14 21 1 0 0 0 0
M END
$$$$