MMs01195884 MOE2007 2D CORINA 3.40 0006 02.08.2006 55 57 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 1.3946 -0.5525 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5703 0.3790 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 2.5703 -0.8210 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0149 -0.0247 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5375 -1.4307 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8453 1.2246 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9138 2.4003 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 2.8746 3.0003 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5078 1.8777 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 4.3175 3.8450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7704 4.2177 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1741 5.6624 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1248 6.7343 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6719 6.3615 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2682 4.9169 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8152 4.5441 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7660 5.6160 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6270 6.0351 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0307 7.4798 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3440 1.2871 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1475 0.0204 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3414 1.4121 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8401 1.4746 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9483 -1.1212 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4496 -1.1837 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4420 1.1156 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1156 0.4420 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4420 -1.1156 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7656 -1.5744 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2918 -1.3494 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6098 3.3602 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4477 7.8900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8324 7.2191 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6235 6.4555 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0735 6.4736 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0916 4.7766 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1864 7.1568 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3536 8.6355 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8750 7.8027 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0865 2.4591 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4535 1.7441 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0379 -0.4366 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4049 -1.1516 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5003 2.6015 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1976 1.7752 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5826 2.6467 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9496 1.9317 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7894 -2.3106 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0921 -1.4843 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7071 -2.3558 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3401 -1.6408 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6462 0.0829 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.6436 0.2080 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.8425 0.2580 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 30 1 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 10 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 21 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 11 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 32 1 0 0 0 0 13 14 1 0 0 0 0 13 19 1 0 0 0 0 14 15 2 0 0 0 0 14 33 1 0 0 0 0 15 16 1 0 0 0 0 15 34 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 18 35 1 0 0 0 0 18 36 1 0 0 0 0 18 37 1 0 0 0 0 19 20 1 0 0 0 0 20 38 1 0 0 0 0 20 39 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 43 1 0 0 0 0 22 44 1 0 0 0 0 22 53 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 23 53 1 0 0 0 0 24 47 1 0 0 0 0 24 48 1 0 0 0 0 24 54 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 25 54 1 0 0 0 0 26 51 1 0 0 0 0 26 52 1 0 0 0 0 26 53 1 0 0 0 0 54 55 1 0 0 0 0 M END