MMs02874047 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 0.7569 1.2950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0139 2.5980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4861 2.6061 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2291 3.9091 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7291 3.9171 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4860 2.6221 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7430 1.3191 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2430 1.3111 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5000 0.0080 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9860 2.6301 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7290 3.9332 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.7430 1.3351 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.2429 1.3432 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9860 2.6462 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.4859 2.6542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2429 1.3592 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.4998 0.0562 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9999 0.0482 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2568 -1.2549 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -12.7429 1.3673 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -8.2290 3.9412 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -4.4721 5.2202 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5944 -1.0424 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9569 1.2886 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6195 3.6340 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6236 4.9451 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3485 0.2831 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1055 -1.0280 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1485 0.2927 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.0804 3.6967 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.1054 -0.9798 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8666 6.2562 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 10 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 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 27 1 0 0 0 0 6 7 1 0 0 0 0 6 23 1 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 8 28 1 0 0 0 0 9 10 1 0 0 0 0 10 29 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 30 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 22 1 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 21 1 0 0 0 0 18 19 1 0 0 0 0 18 32 1 0 0 0 0 19 20 1 0 0 0 0 23 33 1 0 0 0 0 M END