MMs00039790 MOE2007 2D CORINA 3.40 0006 02.08.2006 57 61 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 0.7527 -1.2974 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2527 -1.2943 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0055 -2.5917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5055 -2.5886 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2527 -1.2879 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 0.0095 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 0.0063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7527 -1.2848 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5000 0.0159 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5055 -2.5822 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.0055 -2.5790 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 8.4055 -3.6183 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8846 -1.3636 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3121 -1.8241 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.3153 -3.3241 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 12.3546 -2.7241 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8897 -3.7907 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 9.0412 -4.6392 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8929 -5.2907 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.3205 -5.7512 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1996 -4.5358 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 12.5101 -5.6949 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6996 -4.5326 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.4523 -5.8301 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7051 -7.1307 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.4578 -8.4281 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.9578 -8.4250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.7051 -7.1244 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.9523 -5.8269 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 18.2050 -7.1212 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.9523 -5.8206 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.4523 -5.8174 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.2050 -7.1148 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.4578 -8.4155 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.9578 -8.4186 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.2105 -9.7129 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.9633 -11.0104 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0380 0.6022 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6022 1.0380 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0380 -0.6022 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4077 -3.6322 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1077 -3.6265 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0978 1.0500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3978 1.0443 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9077 -3.6227 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8441 -0.7658 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3703 -0.2664 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8347 -6.8485 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3610 -6.3490 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2974 -3.4921 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8600 -9.4686 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.5600 -9.4629 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.3501 -4.7826 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 21.0501 -4.7769 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 22.4050 -7.1123 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.3600 -9.4591 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 39 1 0 0 0 0 1 40 1 0 0 0 0 1 41 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 42 1 0 0 0 0 5 6 1 0 0 0 0 5 43 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 44 1 0 0 0 0 8 45 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 46 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 47 1 0 0 0 0 14 48 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 22 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 21 49 1 0 0 0 0 21 50 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 24 51 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 27 28 1 0 0 0 0 27 52 1 0 0 0 0 28 29 2 0 0 0 0 28 53 1 0 0 0 0 29 30 1 0 0 0 0 29 31 1 0 0 0 0 31 32 1 0 0 0 0 31 36 2 0 0 0 0 32 33 2 0 0 0 0 32 54 1 0 0 0 0 33 34 1 0 0 0 0 33 55 1 0 0 0 0 34 35 2 0 0 0 0 34 56 1 0 0 0 0 35 36 1 0 0 0 0 35 37 1 0 0 0 0 36 57 1 0 0 0 0 37 38 3 0 0 0 0 M END