D0F3CS
Wcorina 10100417253D 1 1.00000 0.00000
CORINA evaluation license 3.40 0067 02.08.2006
25 25 0 1 0 0 0 0 0999 V2000
1.4143 0.2536 1.8698 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.0178 1.4648 0.0101 N 0 0 0 0 0 0 0 0 0 0 0 0
0.0021 -0.0041 0.0020 C 0 0 1 0 0 0 0 0 0 0 0 0
0.7182 -0.4975 -1.2568 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0771 -0.1029 -2.4745 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7309 -0.5033 1.2229 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1626 1.1097 -3.0934 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0424 -0.9559 -2.9758 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6071 -1.9471 1.6366 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5670 1.4717 -4.2104 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7719 -0.5939 -4.0928 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5359 0.6210 -4.7087 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0205 -0.3814 0.0098 H 0 0 0 0 0 0 0 0 0 0 0 0
1.7103 -0.0491 -1.3098 H 0 0 0 0 0 0 0 0 0 0 0 0
0.8116 -1.5829 -1.2198 H 0 0 0 0 0 0 0 0 0 0 0 0
0.9196 1.7744 -2.7042 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.2264 -1.9053 -2.4951 H 0 0 0 0 0 0 0 0 0 0 0 0
0.9191 1.8392 0.0032 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.5563 1.8234 -0.7642 H 0 0 0 0 0 0 0 0 0 0 0 0
1.1999 -2.1198 2.5348 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.4383 -2.1780 1.8412 H 0 0 0 0 0 0 0 0 0 0 0 0
0.9701 -2.5877 0.8329 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.3802 2.4194 -4.6936 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.5259 -1.2606 -4.4847 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.1061 0.9039 -5.5811 H 0 0 0 0 0 0 0 0 0 0 0 0
1 6 2 0 0 0 0
3 2 1 0 0 0 0
2 18 1 0 0 0 0
2 19 1 0 0 0 0
3 4 1 0 0 0 0
3 6 1 0 0 0 0
3 13 1 0 0 0 0
4 5 1 0 0 0 0
4 14 1 0 0 0 0
4 15 1 0 0 0 0
5 7 2 0 0 0 0
5 8 1 0 0 0 0
6 9 1 0 0 0 0
7 10 1 0 0 0 0
7 16 1 0 0 0 0
8 11 2 0 0 0 0
8 17 1 0 0 0 0
9 20 1 0 0 0 0
9 21 1 0 0 0 0
9 22 1 0 0 0 0
10 12 2 0 0 0 0
10 23 1 0 0 0 0
11 12 1 0 0 0 0
11 24 1 0 0 0 0
12 25 1 0 0 0 0
M END
$$$$