MMs01259739 MOE2007 2D CORINA 3.40 0006 02.08.2006 33 35 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 0.7585 -1.2941 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0171 -2.5980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4829 -2.6079 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2414 -1.3138 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5000 -0.0098 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7066 -1.6353 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.8536 -3.1281 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1476 -3.8866 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4793 -3.7292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8278 -0.6389 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2514 -1.1118 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5536 -2.5810 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.3726 -0.1155 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.7962 -0.5883 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0984 -2.0576 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.5219 -2.5305 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.6432 -1.5341 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.3409 -0.0649 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9174 0.4080 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.4622 0.9315 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -13.0667 -2.0070 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.4902 -2.4799 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5932 1.0431 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9585 -1.2862 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6239 -3.6333 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1068 1.0254 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8871 0.1061 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3982 0.4169 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1309 1.0599 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2014 -2.8547 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.7637 -3.7058 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6757 1.5834 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 24 1 0 0 0 0 2 3 2 0 0 0 0 2 25 1 0 0 0 0 3 4 1 0 0 0 0 3 26 1 0 0 0 0 4 5 2 0 0 0 0 4 10 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 27 1 0 0 0 0 7 8 1 0 0 0 0 7 11 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 11 12 1 0 0 0 0 11 28 1 0 0 0 0 11 29 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 30 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 31 1 0 0 0 0 17 18 1 0 0 0 0 17 32 1 0 0 0 0 18 19 2 0 0 0 0 18 22 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 20 33 1 0 0 0 0 22 23 3 0 0 0 0 M END