D08VSQ
Wcorina 11010620243D 1 1.00000 0.00000 0
CORINA evaluation license 3.40 0067 02.08.2006
49 53 0 0 0 999 V2000
0.6310 -0.0736 -0.4851 C 0 0 0 0 0 0 0 0 0 0 0 0
0.9329 -1.5594 -0.2803 C 0 0 1 0 0 0 0 0 0 0 0 0
1.9351 0.7245 -0.4276 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8767 -2.0447 -1.3824 C 0 0 0 0 0 0 0 0 0 0 0 0
1.5950 -1.7620 1.0840 C 0 0 0 0 0 0 0 0 0 0 0 0
3.1064 -0.2294 -0.1845 C 0 0 2 0 0 0 0 0 0 0 0 0
3.1808 -1.2467 -1.3249 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8992 -0.9640 1.1415 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2852 -2.3048 -0.3340 O 0 0 0 0 0 0 0 0 0 0 0 0
4.3910 0.5566 -0.1279 C 0 0 0 0 0 0 0 0 0 0 0 0
5.8657 3.5690 2.2132 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5697 3.1163 2.5117 C 0 0 0 0 0 0 0 0 0 0 0 0
4.0085 2.1253 1.7879 C 0 0 0 0 0 0 0 0 0 0 0 0
6.5595 3.0024 1.1832 C 0 0 0 0 0 0 0 0 0 0 0 0
5.9569 1.9657 0.4361 C 0 0 0 0 0 0 0 0 0 0 0 0
4.6893 1.5473 0.7549 N 0 0 0 0 0 0 0 0 0 0 0 0
5.4251 0.4067 -0.9154 N 0 0 0 0 0 0 0 0 0 0 0 0
6.3558 1.2341 -0.5910 N 0 0 0 0 0 0 0 0 0 0 0 0
7.8134 3.4292 0.8809 O 0 0 0 0 0 0 0 0 0 0 0 0
8.0055 4.0506 -0.3120 C 0 0 0 0 0 0 0 0 0 0 0 0
9.2870 4.3916 -0.7193 C 0 0 0 0 0 0 0 0 0 0 0 0
9.4796 5.0235 -1.9340 C 0 0 0 0 0 0 0 0 0 0 0 0
8.3951 5.3157 -2.7422 C 0 0 0 0 0 0 0 0 0 0 0 0
7.1171 4.9768 -2.3374 C 0 0 0 0 0 0 0 0 0 0 0 0
6.9204 4.3399 -1.1277 C 0 0 0 0 0 0 0 0 0 0 0 0
10.4679 4.0742 0.1615 C 0 0 0 0 0 0 0 0 0 0 0 0
11.0826 5.4510 -2.4451 Cl 0 0 0 0 0 0 0 0 0 0 0 0
0.1593 0.0708 -1.4571 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.0414 0.2722 0.3001 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0828 1.2478 -1.3723 H 0 0 0 0 0 0 0 0 0 0 0 0
1.8821 1.4492 0.3848 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0918 -3.1033 -1.2365 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4050 -1.9004 -2.3543 H 0 0 0 0 0 0 0 0 0 0 0 0
0.9226 -1.4163 1.8692 H 0 0 0 0 0 0 0 0 0 0 0 0
1.8101 -2.8206 1.2299 H 0 0 0 0 0 0 0 0 0 0 0 0
4.0153 -1.9262 -1.1517 H 0 0 0 0 0 0 0 0 0 0 0 0
3.3285 -0.7233 -2.2696 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8461 -0.2393 1.9540 H 0 0 0 0 0 0 0 0 0 0 0 0
3.7336 -1.6436 1.3147 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.1693 -3.2570 -0.2116 H 0 0 0 0 0 0 0 0 0 0 0 0
6.3107 4.3625 2.7954 H 0 0 0 0 0 0 0 0 0 0 0 0
4.0192 3.5640 3.3258 H 0 0 0 0 0 0 0 0 0 0 0 0
3.0117 1.7860 2.0280 H 0 0 0 0 0 0 0 0 0 0 0 0
8.5471 5.8096 -3.6906 H 0 0 0 0 0 0 0 0 0 0 0 0
6.2723 5.2066 -2.9697 H 0 0 0 0 0 0 0 0 0 0 0 0
5.9218 4.0756 -0.8124 H 0 0 0 0 0 0 0 0 0 0 0 0
10.8498 3.0837 -0.0858 H 0 0 0 0 0 0 0 0 0 0 0 0
11.2505 4.8158 0.0011 H 0 0 0 0 0 0 0 0 0 0 0 0
10.1576 4.0936 1.2062 H 0 0 0 0 0 0 0 0 0 0 0 0
1 2 1 0 0 0 0
1 3 1 0 0 0 0
1 28 1 0 0 0 0
1 29 1 0 0 0 0
2 9 1 0 0 0 0
2 4 1 0 0 0 0
2 5 1 0 0 0 0
3 6 1 0 0 0 0
3 30 1 0 0 0 0
3 31 1 0 0 0 0
4 7 1 0 0 0 0
4 32 1 0 0 0 0
4 33 1 0 0 0 0
5 8 1 0 0 0 0
5 34 1 0 0 0 0
5 35 1 0 0 0 0
6 7 1 0 0 0 0
6 8 1 0 0 0 0
6 10 1 0 0 0 0
7 36 1 0 0 0 0
7 37 1 0 0 0 0
8 38 1 0 0 0 0
8 39 1 0 0 0 0
9 40 1 0 0 0 0
10 16 1 0 0 0 0
10 17 2 0 0 0 0
11 12 1 0 0 0 0
11 14 2 0 0 0 0
11 41 1 0 0 0 0
12 13 2 0 0 0 0
12 42 1 0 0 0 0
13 16 1 0 0 0 0
13 43 1 0 0 0 0
14 15 1 0 0 0 0
14 19 1 0 0 0 0
15 16 1 0 0 0 0
15 18 2 0 0 0 0
17 18 1 0 0 0 0
19 20 1 0 0 0 0
20 21 2 0 0 0 0
20 25 1 0 0 0 0
21 22 1 0 0 0 0
21 26 1 0 0 0 0
22 23 2 0 0 0 0
22 27 1 0 0 0 0
23 24 1 0 0 0 0
23 44 1 0 0 0 0
24 25 2 0 0 0 0
24 45 1 0 0 0 0
25 46 1 0 0 0 0
26 47 1 0 0 0 0
26 48 1 0 0 0 0
26 49 1 0 0 0 0
M END
$$$$