MMs01673594 MOE2007 2D CORINA 3.40 0006 02.08.2006 42 44 0 0 0 0 0 0 0 0999 V2000 0.0000 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9860 1.1304 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3658 0.5419 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2325 -0.9522 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 0.7703 -1.2871 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6529 1.3122 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6293 2.8120 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9635 0.5827 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.2506 1.3531 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.5613 0.6236 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5849 -0.8762 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.8484 1.3939 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8248 2.8938 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1119 3.6641 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4225 2.9346 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4461 1.4348 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1590 0.6645 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7568 0.7053 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 13.4863 2.0160 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.0273 -0.6053 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.0675 -0.0241 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 15.4280 0.6074 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.4491 -0.4914 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7197 -1.8020 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2477 -1.5133 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7096 3.7050 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -1.1953 0.1066 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7181 2.3001 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2996 -2.3909 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9824 -0.6171 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2317 2.5529 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7762 3.4773 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0930 4.8640 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1779 -0.5354 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.8118 1.6371 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.3876 1.3280 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.2380 0.4129 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.4309 -1.1813 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.8235 -2.2728 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3668 -2.9490 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0479 -1.5321 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1411 -2.7085 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 5 2 0 0 0 0 1 27 1 0 0 0 0 2 3 2 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 6 1 0 0 0 0 4 5 1 0 0 0 0 5 29 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 30 1 0 0 0 0 9 10 1 0 0 0 0 9 31 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 32 1 0 0 0 0 14 15 1 0 0 0 0 14 33 1 0 0 0 0 15 16 2 0 0 0 0 15 26 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 17 34 1 0 0 0 0 18 19 2 0 0 0 0 18 20 2 0 0 0 0 18 21 1 0 0 0 0 21 22 1 0 0 0 0 21 25 1 0 0 0 0 22 23 1 0 0 0 0 22 35 1 0 0 0 0 22 36 1 0 0 0 0 23 24 1 0 0 0 0 23 37 1 0 0 0 0 23 38 1 0 0 0 0 24 25 1 0 0 0 0 24 39 1 0 0 0 0 24 40 1 0 0 0 0 25 41 1 0 0 0 0 25 42 1 0 0 0 0 M END