D0ID3Y
Wcorina 10100417253D 1 1.00000 0.00000
CORINA evaluation license 3.40 0067 02.08.2006
28 29 0 1 0 0 0 0 0999 V2000
-0.0226 1.8162 0.0120 S 0 0 0 0 0 0 0 0 0 0 0 0
3.5455 1.6569 1.3671 O 0 0 0 0 0 0 0 0 0 0 0 0
-5.2733 -1.9765 -0.0583 O 0 0 0 0 0 0 0 0 0 0 0 0
2.0055 0.1496 1.4428 N 0 0 0 0 0 0 0 0 0 0 0 0
0.0021 -0.0041 0.0020 C 0 0 3 0 0 0 0 0 0 0 0 0
0.7153 -0.4793 1.2673 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4095 -0.5315 -0.0143 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7560 2.1949 -0.0029 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4572 1.2948 0.9730 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8365 -1.3284 -1.0605 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.2738 -0.2225 1.0198 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.1298 -1.8135 -1.0775 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.5681 -0.7051 1.0074 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.0005 -1.5005 -0.0438 C 0 0 0 0 0 0 0 0 0 0 0 0
-6.1142 -1.6138 1.0387 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5382 -0.3597 -0.8779 H 0 0 0 0 0 0 0 0 0 0 0 0
0.8539 -1.5589 1.2100 H 0 0 0 0 0 0 0 0 0 0 0 0
0.0911 -0.2509 2.1312 H 0 0 0 0 0 0 0 0 0 0 0 0
2.6341 -0.3473 1.9894 H 0 0 0 0 0 0 0 0 0 0 0 0
2.1555 2.0294 -1.0035 H 0 0 0 0 0 0 0 0 0 0 0 0
1.9097 3.2349 0.2849 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.1584 -1.5715 -1.8651 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.9365 0.3965 1.8381 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.4630 -2.4356 -1.8951 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.2427 -0.4637 1.8155 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.6760 -1.9776 1.9681 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.2078 -0.5287 1.0815 H 0 0 0 0 0 0 0 0 0 0 0 0
-7.1001 -2.0585 0.9034 H 0 0 0 0 0 0 0 0 0 0 0 0
1 5 1 0 0 0 0
1 8 1 0 0 0 0
2 9 2 0 0 0 0
3 14 1 0 0 0 0
3 15 1 0 0 0 0
4 6 1 0 0 0 0
4 9 1 0 0 0 0
4 19 1 0 0 0 0
5 6 1 0 0 0 0
5 7 1 0 0 0 0
5 16 1 0 0 0 0
6 17 1 0 0 0 0
6 18 1 0 0 0 0
7 10 2 0 0 0 0
7 11 1 0 0 0 0
8 9 1 0 0 0 0
8 20 1 0 0 0 0
8 21 1 0 0 0 0
10 12 1 0 0 0 0
10 22 1 0 0 0 0
11 13 2 0 0 0 0
11 23 1 0 0 0 0
12 14 2 0 0 0 0
12 24 1 0 0 0 0
13 14 1 0 0 0 0
13 25 1 0 0 0 0
15 26 1 0 0 0 0
15 27 1 0 0 0 0
15 28 1 0 0 0 0
M END
$$$$