BN05OR
-OEChem-04012116422D
49 54 0 1 0 0 0 0 0999 V2000
5.4110 0.2615 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
5.7171 2.0113 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.5786 2.9664 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
8.1603 -1.5426 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 2.6528 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
8.1603 -3.1521 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.6820 -1.8265 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0
4.5880 -1.3127 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0
4.5996 -0.3128 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0
5.4820 -1.8474 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.8017 0.2801 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.6820 -2.8682 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4820 -2.8474 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5880 -3.3820 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.1233 1.2270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.1173 1.2112 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0
6.3480 -1.3474 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8179 -1.3232 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.4641 1.9790 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8209 0.0852 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.3480 -3.3474 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.2140 -1.8474 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.2140 -2.8474 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4833 1.7841 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1617 0.8372 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6756 3.3820 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.7439 -2.3474 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.7100 1.8918 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.8561 -0.8806 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.3523 -0.7077 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.0711 -2.7621 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.4729 -3.4519 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.1944 -3.8610 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.9926 -3.8518 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.8444 1.7679 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.3480 -0.7273 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.1300 -0.7875 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.2822 -1.0111 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.5058 -1.8589 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.6214 -0.5018 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.3480 -3.9674 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.5536 0.7164 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.9925 3.9149 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.1790 3.7532 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.2047 -2.7621 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.2047 -1.9326 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.6359 1.2763 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.3255 1.8178 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.7840 2.5074 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 9 1 0 0 0 0
1 16 1 0 0 0 0
16 2 1 6 0 0 0
2 28 1 0 0 0 0
3 19 1 0 0 0 0
3 26 1 0 0 0 0
4 22 1 0 0 0 0
4 27 1 0 0 0 0
5 24 1 0 0 0 0
5 26 1 0 0 0 0
6 23 1 0 0 0 0
6 27 1 0 0 0 0
7 8 1 0 0 0 0
7 12 1 0 0 0 0
7 18 1 0 0 0 0
8 9 1 0 0 0 0
8 10 1 0 0 0 0
8 29 1 1 0 0 0
9 11 1 0 0 0 0
9 30 1 1 0 0 0
10 13 1 0 0 0 0
10 17 2 0 0 0 0
11 15 2 0 0 0 0
11 20 1 0 0 0 0
12 14 1 0 0 0 0
12 31 1 0 0 0 0
12 32 1 0 0 0 0
13 14 1 0 0 0 0
13 21 2 0 0 0 0
14 33 1 0 0 0 0
14 34 1 0 0 0 0
15 16 1 0 0 0 0
15 19 1 0 0 0 0
16 35 1 0 0 0 0
17 22 1 0 0 0 0
17 36 1 0 0 0 0
18 37 1 0 0 0 0
18 38 1 0 0 0 0
18 39 1 0 0 0 0
19 24 2 0 0 0 0
20 25 2 0 0 0 0
20 40 1 0 0 0 0
21 23 1 0 0 0 0
21 41 1 0 0 0 0
22 23 2 0 0 0 0
24 25 1 0 0 0 0
25 42 1 0 0 0 0
26 43 1 0 0 0 0
26 44 1 0 0 0 0
27 45 1 0 0 0 0
27 46 1 0 0 0 0
28 47 1 0 0 0 0
28 48 1 0 0 0 0
28 49 1 0 0 0 0
M END
$$$$