MMs00247631 MOE2007 2D CORINA 3.40 0006 02.08.2006 47 50 0 0 1 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 -1.2993 0.7495 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5981 -0.0010 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5975 -1.5010 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2981 -2.2505 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0006 -1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2999 -2.2495 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4573 -3.7412 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9247 -4.0525 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6742 -2.7531 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6700 -1.6388 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5353 -5.4225 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 2.3353 -5.4225 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6542 -6.6364 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2648 -8.0065 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7567 -8.1627 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6379 -6.9488 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.0272 -5.5787 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1297 -7.1050 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 6.9735 -8.5968 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2859 -5.6131 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.6215 -7.2612 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5027 -6.0473 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9946 -6.2035 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6052 -7.5736 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7240 -8.7874 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2322 -8.6313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0971 -7.7298 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 13.9783 -6.5159 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.7077 -9.0998 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 -3.8974 0.7484 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.0390 0.6004 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2998 1.9495 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6365 -2.1015 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2976 -3.4505 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8202 -5.7736 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6596 -7.3079 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1006 -8.2973 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3490 -9.2035 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4264 -9.3163 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8354 -8.6883 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9430 -4.3817 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1914 -5.2880 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0142 -4.9512 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6995 -5.2324 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2126 -9.8835 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5273 -9.6024 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 32 1 0 0 0 0 2 3 2 0 0 0 0 2 33 1 0 0 0 0 3 4 1 0 0 0 0 3 31 1 0 0 0 0 4 5 2 0 0 0 0 4 34 1 0 0 0 0 5 6 1 0 0 0 0 5 35 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 11 2 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 10 11 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 18 1 0 0 0 0 14 15 1 0 0 0 0 14 36 1 0 0 0 0 14 37 1 0 0 0 0 15 16 1 0 0 0 0 15 38 1 0 0 0 0 15 39 1 0 0 0 0 16 17 1 0 0 0 0 16 40 1 0 0 0 0 16 41 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 18 42 1 0 0 0 0 18 43 1 0 0 0 0 19 20 2 0 0 0 0 19 21 2 0 0 0 0 19 22 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 44 1 0 0 0 0 24 25 1 0 0 0 0 24 45 1 0 0 0 0 25 26 2 0 0 0 0 25 28 1 0 0 0 0 26 27 1 0 0 0 0 26 46 1 0 0 0 0 27 47 1 0 0 0 0 28 29 2 0 0 0 0 28 30 1 0 0 0 0 M CHG 1 28 1 M CHG 1 30 -1 M END