D0DR8N
Wcorina 10100417263D 1 1.00000 0.00000
CORINA evaluation license 3.40 0067 02.08.2006
30 33 0 0 0 0 0 0 0999 V2000
5.8684 2.4740 -0.0421 Br 0 0 0 0 0 0 0 0 0 0 0 0
1.8438 -2.9725 2.1213 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.0167 1.3778 0.0096 N 0 0 0 0 0 0 0 0 0 0 0 0
-0.2106 -2.5606 1.4676 N 0 0 0 0 0 0 0 0 0 0 0 0
-2.2339 -0.4831 -0.7539 N 0 0 0 0 0 0 0 0 0 0 0 0
1.2875 -0.4376 0.0062 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0021 -0.0041 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1357 0.7337 -0.0052 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7064 -1.8867 0.0405 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2629 1.8537 -0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1877 -0.8814 -0.0275 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.2203 -2.1051 0.6411 C 0 0 0 0 0 0 0 0 0 0 0 0
1.1067 -2.5083 1.2773 C 0 0 0 0 0 0 0 0 0 0 0 0
3.5259 0.8963 -0.0181 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7734 3.1502 -0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0
3.9996 2.1855 -0.0245 C 0 0 0 0 0 0 0 0 0 0 0 0
3.1514 3.2820 -0.0176 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3482 -2.9177 0.4839 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.3996 -2.4645 -0.2916 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.3123 -1.2211 -0.8929 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3360 -2.3995 -0.8472 H 0 0 0 0 0 0 0 0 0 0 0 0
2.7933 -1.9563 0.0819 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.8169 1.9260 0.0165 H 0 0 0 0 0 0 0 0 0 0 0 0
4.1944 0.0482 -0.0232 H 0 0 0 0 0 0 0 0 0 0 0 0
1.1237 4.0129 0.0005 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.4997 -2.9736 2.2964 H 0 0 0 0 0 0 0 0 0 0 0 0
3.5804 4.2731 -0.0227 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.3969 -3.8854 0.9610 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.2801 -3.0750 -0.4271 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.1391 -0.8535 -1.4825 H 0 0 0 0 0 0 0 0 0 0 0 0
1 16 1 0 0 0 0
2 13 2 0 0 0 0
3 7 1 0 0 0 0
3 10 1 0 0 0 0
3 23 1 0 0 0 0
4 12 1 0 0 0 0
4 13 1 0 0 0 0
4 26 1 0 0 0 0
5 11 1 0 0 0 0
5 20 2 0 0 0 0
6 7 2 0 0 0 0
6 8 1 0 0 0 0
6 9 1 0 0 0 0
7 11 1 0 0 0 0
8 10 2 0 0 0 0
8 14 1 0 0 0 0
9 13 1 0 0 0 0
9 21 1 0 0 0 0
9 22 1 0 0 0 0
10 15 1 0 0 0 0
11 12 2 0 0 0 0
12 18 1 0 0 0 0
14 16 2 0 0 0 0
14 24 1 0 0 0 0
15 17 2 0 0 0 0
15 25 1 0 0 0 0
16 17 1 0 0 0 0
17 27 1 0 0 0 0
18 19 2 0 0 0 0
18 28 1 0 0 0 0
19 20 1 0 0 0 0
19 29 1 0 0 0 0
20 30 1 0 0 0 0
M END
$$$$