MMs00970228 MOE2007 2D CORINA 3.40 0006 02.08.2006 54 56 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 -0.7567 1.2951 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0135 2.5980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4865 2.6058 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2432 1.3107 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5000 0.0078 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2567 -1.2874 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 2.2298 3.9087 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.7702 3.8932 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2702 3.8854 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.1455 2.6673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5745 3.1234 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5823 4.6234 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.1581 5.0943 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7020 6.5233 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.8004 5.4988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1675 4.8816 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3166 3.3890 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.3856 5.7570 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.7527 5.1398 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.8461 6.1667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.3454 6.1196 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.3723 5.0262 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.3252 3.5270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.2318 2.5001 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.7326 2.5471 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7057 3.6405 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5946 -1.0423 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9567 1.2889 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4432 1.3169 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3553 4.3094 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9847 5.0738 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1032 2.0727 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6279 1.5686 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8179 1.9484 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7686 3.2427 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9415 6.3369 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4765 6.4902 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2663 6.9510 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4421 6.2989 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8262 6.7990 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.1929 7.3155 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.0713 7.2879 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.4029 6.6867 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.0046 6.0461 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.5211 4.6794 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.4935 3.8010 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.8923 2.4694 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.2517 1.8678 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.8850 1.3513 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.0066 1.3788 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6750 1.9800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5569 3.9873 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0734 2.6206 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 28 1 0 0 0 0 2 3 2 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 9 1 0 0 0 0 4 5 2 0 0 0 0 4 8 1 0 0 0 0 5 6 1 0 0 0 0 5 30 1 0 0 0 0 6 7 1 0 0 0 0 9 10 1 0 0 0 0 9 31 1 0 0 0 0 9 32 1 0 0 0 0 10 11 1 0 0 0 0 10 14 1 0 0 0 0 11 12 1 0 0 0 0 11 33 1 0 0 0 0 11 34 1 0 0 0 0 12 13 1 0 0 0 0 12 35 1 0 0 0 0 12 36 1 0 0 0 0 13 14 1 0 0 0 0 13 16 1 0 0 0 0 14 15 2 0 0 0 0 16 17 1 0 0 0 0 16 37 1 0 0 0 0 16 38 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 39 1 0 0 0 0 20 21 1 0 0 0 0 20 27 1 0 0 0 0 20 40 1 0 0 0 0 21 22 1 0 0 0 0 21 41 1 0 0 0 0 21 42 1 0 0 0 0 22 23 1 0 0 0 0 22 43 1 0 0 0 0 22 44 1 0 0 0 0 23 24 1 0 0 0 0 23 45 1 0 0 0 0 23 46 1 0 0 0 0 24 25 1 0 0 0 0 24 47 1 0 0 0 0 24 48 1 0 0 0 0 25 26 1 0 0 0 0 25 49 1 0 0 0 0 25 50 1 0 0 0 0 26 27 1 0 0 0 0 26 51 1 0 0 0 0 26 52 1 0 0 0 0 27 53 1 0 0 0 0 27 54 1 0 0 0 0 M END