D0XU4O Wcorina 11010620323D 1 1.00000 0.00000 0 CORINA evaluation license 3.40 0067 02.08.2006 35 38 0 0 0 999 V2000 -0.0162 1.3468 0.0094 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2297 2.0202 0.0304 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2613 3.4002 0.0382 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1709 2.0485 0.0019 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1546 3.4483 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0765 4.1223 0.0254 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3462 5.4523 0.0092 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3260 4.1375 0.0020 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5532 6.1250 -0.0047 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7557 5.4062 -0.0142 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9329 6.0623 -0.0278 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2044 5.3022 -0.0378 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9513 7.2773 -0.0318 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4232 5.9788 -0.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5546 5.2967 -0.0494 N 0 0 0 0 0 0 0 0 0 0 0 0 9.5312 3.9758 -0.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3196 3.2992 -0.0368 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1865 3.9720 -0.0334 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0021 -0.0041 0.0020 F 0 0 0 0 0 0 0 0 0 0 0 0 0.7978 7.5490 0.0179 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0906 6.2026 0.0191 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1050 5.5146 0.0326 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1193 6.4155 0.0397 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5961 7.6658 0.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1540 1.4617 0.0404 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2088 3.9182 0.0538 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1120 1.5188 -0.0103 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5678 7.0949 -0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7410 4.4363 -0.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4425 7.0586 -0.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4577 3.4209 -0.0481 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3052 2.2193 -0.0332 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5100 8.3608 0.0093 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1723 6.1755 0.0506 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1564 8.5891 0.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 1 19 1 0 0 0 0 1 4 1 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 2 25 1 0 0 0 0 3 6 2 0 0 0 0 3 26 1 0 0 0 0 4 5 2 0 0 0 0 4 27 1 0 0 0 0 5 8 1 0 0 0 0 5 6 1 0 0 0 0 6 22 1 0 0 0 0 7 21 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 28 1 0 0 0 0 10 11 1 0 0 0 0 10 29 1 0 0 0 0 11 12 1 0 0 0 0 11 13 2 0 0 0 0 12 18 1 0 0 0 0 12 14 2 0 0 0 0 14 15 1 0 0 0 0 14 30 1 0 0 0 0 15 16 2 0 0 0 0 16 17 1 0 0 0 0 16 31 1 0 0 0 0 17 18 2 0 0 0 0 17 32 1 0 0 0 0 20 21 2 0 0 0 0 20 24 1 0 0 0 0 20 33 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 23 24 2 0 0 0 0 23 34 1 0 0 0 0 24 35 1 0 0 0 0 M END $$$$