D0X9RM
Wcorina 10100417213D 1 1.00000 0.00000
CORINA evaluation license 3.40 0067 02.08.2006
26 28 0 0 0 0 0 0 0999 V2000
-0.0218 1.7546 0.0117 S 0 0 0 0 0 0 0 0 0 0 0 0
-0.2286 -2.9693 1.8112 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.5998 -1.1843 1.3913 N 0 0 0 0 0 0 0 0 0 0 0 0
-2.5549 -0.4819 2.1329 N 0 0 0 0 0 0 0 0 0 0 0 0
-1.2174 -0.8895 0.0081 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7503 -2.1098 3.4614 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.6560 -1.0375 3.3989 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0817 -2.1716 2.1495 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
-1.6387 -2.8582 4.6309 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.4337 -0.7338 4.5072 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4204 -2.5416 5.7224 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.3134 -1.4839 5.6601 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2646 -0.4342 -0.0123 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2216 0.5659 -0.0161 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7362 1.8083 -0.0048 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.9932 -1.8202 -0.5131 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.0389 -0.3799 -0.4953 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.0669 0.2767 1.8115 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.9434 -3.6830 4.6827 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.1323 0.0890 4.4683 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.3358 -3.1208 6.6300 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.9203 -1.2441 6.5207 H 0 0 0 0 0 0 0 0 0 0 0 0
1.5208 -1.4834 -0.0201 H 0 0 0 0 0 0 0 0 0 0 0 0
3.2810 0.3563 -0.0270 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3315 2.7094 -0.0060 H 0 0 0 0 0 0 0 0 0 0 0 0
1 9 1 0 0 0 0
1 16 1 0 0 0 0
2 8 2 0 0 0 0
3 4 1 0 0 0 0
3 5 1 0 0 0 0
3 8 1 0 0 0 0
4 7 1 0 0 0 0
4 19 1 0 0 0 0
5 9 1 0 0 0 0
5 17 1 0 0 0 0
5 18 1 0 0 0 0
6 7 1 0 0 0 0
6 8 1 0 0 0 0
6 10 2 0 0 0 0
7 11 2 0 0 0 0
9 14 2 0 0 0 0
10 12 1 0 0 0 0
10 20 1 0 0 0 0
11 13 1 0 0 0 0
11 21 1 0 0 0 0
12 13 2 0 0 0 0
12 22 1 0 0 0 0
13 23 1 0 0 0 0
14 15 1 0 0 0 0
14 24 1 0 0 0 0
15 16 2 0 0 0 0
15 25 1 0 0 0 0
16 26 1 0 0 0 0
M END
$$$$