BC0RN9
-OEChem-04012115042D
43 46 0 1 0 0 0 0 0999 V2000
2.5381 1.7395 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
6.9343 1.2154 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0
6.0682 -0.2846 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0
6.9343 0.2154 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0
6.0682 1.7154 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.8003 -0.2846 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.2022 0.2154 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.2022 1.2154 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.6663 0.2154 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.8003 1.7154 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.0682 -1.2846 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.3083 -0.3193 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.8003 -1.2846 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.3083 1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.5323 -0.2846 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.4022 1.2362 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.4022 0.1946 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.6503 1.2569 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.6663 -1.7846 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.5323 -1.2846 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
10.4424 0.2222 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.5483 1.7846 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
10.4504 1.2638 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.9343 -0.4046 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.4668 2.1903 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.6697 2.1903 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.1103 1.1784 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.3372 2.0254 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.4903 2.2523 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.4482 -1.2846 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.0682 -1.9046 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.6882 -1.2846 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.3154 -0.9392 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.2634 -1.5946 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.3154 2.3700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8665 -0.1175 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.1098 1.5607 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.6663 -2.4046 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
10.0693 -1.5946 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
10.9757 -0.0940 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.5459 2.4046 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
10.9885 1.5717 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 1.4316 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 16 1 0 0 0 0
1 43 1 0 0 0 0
2 4 1 0 0 0 0
2 5 1 0 0 0 0
2 10 1 0 0 0 0
3 4 1 0 0 0 0
3 7 1 0 0 0 0
3 11 1 0 0 0 0
4 6 1 0 0 0 0
4 24 1 0 0 0 0
5 8 1 0 0 0 0
5 25 1 0 0 0 0
5 26 1 0 0 0 0
6 9 1 0 0 0 0
6 13 2 0 0 0 0
7 8 2 0 0 0 0
7 12 1 0 0 0 0
8 14 1 0 0 0 0
9 15 1 0 0 0 0
9 18 2 0 0 0 0
10 27 1 0 0 0 0
10 28 1 0 0 0 0
10 29 1 0 0 0 0
11 30 1 0 0 0 0
11 31 1 0 0 0 0
11 32 1 0 0 0 0
12 17 2 0 0 0 0
12 33 1 0 0 0 0
13 19 1 0 0 0 0
13 34 1 0 0 0 0
14 16 2 0 0 0 0
14 35 1 0 0 0 0
15 20 1 0 0 0 0
15 21 2 0 0 0 0
16 17 1 0 0 0 0
17 36 1 0 0 0 0
18 22 1 0 0 0 0
18 37 1 0 0 0 0
19 20 2 0 0 0 0
19 38 1 0 0 0 0
20 39 1 0 0 0 0
21 23 1 0 0 0 0
21 40 1 0 0 0 0
22 23 2 0 0 0 0
22 41 1 0 0 0 0
23 42 1 0 0 0 0
M END
$$$$