D00DEH
Wcorina 10100417253D 1 1.00000 0.00000
CORINA evaluation license 3.40 0067 02.08.2006
38 40 0 0 0 0 0 0 0999 V2000
3.5050 2.6980 -3.4012 Cl 0 0 0 0 0 0 0 0 0 0 0 0
-0.0164 1.3546 0.0095 O 0 0 0 0 0 0 0 0 0 0 0 0
-5.1601 -0.7387 0.2901 N 0 0 0 0 0 0 0 0 0 0 0 0
-2.3165 -0.2440 0.3798 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.9502 -1.1408 -0.6873 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.1716 -0.2920 1.6491 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.3829 -0.6736 -0.9541 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.5978 0.1506 1.3145 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.9263 -0.7359 0.6902 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1660 0.0960 0.4880 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7386 -2.0129 1.1816 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4446 -0.3600 0.7747 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5369 -2.4649 1.4666 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6273 -1.6403 1.2606 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0870 2.0948 -0.2758 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6618 2.0272 -1.5364 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6371 2.9237 0.6918 C 0 0 0 0 0 0 0 0 0 0 0 0
2.7845 2.7814 -1.8240 C 0 0 0 0 0 0 0 0 0 0 0 0
2.7586 3.6752 0.4000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.3342 3.6022 -0.8552 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.2676 0.7810 0.0121 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.3695 -1.0775 -1.6075 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.9635 -2.1721 -0.3348 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.1883 -1.3100 2.0383 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.7490 0.3777 2.3981 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.8418 -1.3189 -1.7031 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.3679 0.3532 -1.3197 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.5819 1.1735 0.9384 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.2128 0.1039 2.2133 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.1319 -0.5265 0.1210 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.5887 -2.6591 1.3434 H 0 0 0 0 0 0 0 0 0 0 0 0
2.2963 0.2852 0.6178 H 0 0 0 0 0 0 0 0 0 0 0 0
0.6815 -3.4638 1.8511 H 0 0 0 0 0 0 0 0 0 0 0 0
2.6223 -1.9957 1.4840 H 0 0 0 0 0 0 0 0 0 0 0 0
1.2331 1.3860 -2.2924 H 0 0 0 0 0 0 0 0 0 0 0 0
1.1883 2.9814 1.6724 H 0 0 0 0 0 0 0 0 0 0 0 0
3.1867 4.3203 1.1530 H 0 0 0 0 0 0 0 0 0 0 0 0
4.2113 4.1904 -1.0811 H 0 0 0 0 0 0 0 0 0 0 0 0
1 18 1 0 0 0 0
2 10 1 0 0 0 0
2 15 1 0 0 0 0
3 7 1 0 0 0 0
3 8 1 0 0 0 0
3 30 1 0 0 0 0
4 5 1 0 0 0 0
4 6 1 0 0 0 0
4 9 1 0 0 0 0
4 21 1 0 0 0 0
5 7 1 0 0 0 0
5 22 1 0 0 0 0
5 23 1 0 0 0 0
6 8 1 0 0 0 0
6 24 1 0 0 0 0
6 25 1 0 0 0 0
7 26 1 0 0 0 0
7 27 1 0 0 0 0
8 28 1 0 0 0 0
8 29 1 0 0 0 0
9 10 1 0 0 0 0
9 11 2 0 0 0 0
10 12 2 0 0 0 0
11 13 1 0 0 0 0
11 31 1 0 0 0 0
12 14 1 0 0 0 0
12 32 1 0 0 0 0
13 14 2 0 0 0 0
13 33 1 0 0 0 0
14 34 1 0 0 0 0
15 16 2 0 0 0 0
15 17 1 0 0 0 0
16 18 1 0 0 0 0
16 35 1 0 0 0 0
17 19 2 0 0 0 0
17 36 1 0 0 0 0
18 20 2 0 0 0 0
19 20 1 0 0 0 0
19 37 1 0 0 0 0
20 38 1 0 0 0 0
M END
$$$$