MMs02717545 MOE2007 2D CORINA 3.40 0006 02.08.2006 53 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 -0.7530 -1.2973 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2530 -1.2939 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0000 0.0068 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5000 0.0102 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2529 -1.2871 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5059 -2.5878 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0059 -2.5912 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2589 -3.8920 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0118 -5.1893 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7529 -1.2837 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.5000 0.0171 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7470 1.3144 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.2470 1.3110 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4941 2.6083 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.0000 0.0205 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.7529 -1.2768 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2529 -1.2734 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.0000 0.0273 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -11.2470 1.3247 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7470 1.3212 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.5000 0.0307 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -13.5034 -1.4693 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -13.4965 1.5307 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -15.0000 0.0342 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.7529 -1.2632 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -17.2529 -1.2598 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -18.0000 0.0410 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -17.2470 1.3383 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.7470 1.3349 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -19.4999 0.0444 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.0379 -0.6024 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6024 1.0379 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0379 0.6024 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3976 1.0447 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1083 -3.6257 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0497 -4.5869 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6142 -6.2272 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9740 -5.7917 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2941 2.6056 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0917 3.6489 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6262 -1.6898 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9640 -2.4581 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.0472 -2.4557 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.3815 -1.6813 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.3737 1.7376 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.0359 2.5059 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6185 1.7291 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9527 2.5035 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.1553 -2.3038 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -17.8553 -2.2976 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -17.8446 2.3789 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.1446 2.3728 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 3 8 1 0 0 0 0 4 5 1 0 0 0 0 4 35 1 0 0 0 0 5 6 1 0 0 0 0 5 14 2 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 36 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 37 1 0 0 0 0 10 38 1 0 0 0 0 10 39 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 12 16 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 15 40 1 0 0 0 0 15 41 1 0 0 0 0 16 17 1 0 0 0 0 16 21 1 0 0 0 0 17 18 1 0 0 0 0 17 42 1 0 0 0 0 17 43 1 0 0 0 0 18 19 1 0 0 0 0 18 44 1 0 0 0 0 18 45 1 0 0 0 0 19 20 1 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 20 46 1 0 0 0 0 20 47 1 0 0 0 0 21 48 1 0 0 0 0 21 49 1 0 0 0 0 22 23 2 0 0 0 0 22 24 2 0 0 0 0 22 25 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 26 50 1 0 0 0 0 27 28 1 0 0 0 0 27 51 1 0 0 0 0 28 29 2 0 0 0 0 28 31 1 0 0 0 0 29 30 1 0 0 0 0 29 52 1 0 0 0 0 30 53 1 0 0 0 0 M END