MMs01395714 MOE2007 2D CORINA 3.40 0006 02.08.2006 54 55 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 1.5000 -0.0003 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2498 -1.2994 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4995 -2.5983 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0005 -2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7498 -1.2997 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 3.7495 -2.7997 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7500 0.2003 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2498 -1.3000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9995 -2.5991 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4995 -2.5994 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2498 -1.3005 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5000 -0.0013 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0000 -0.0011 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2502 1.2976 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5005 2.5968 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.7502 1.2973 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.5005 2.5962 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.0005 2.5960 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7502 1.2968 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.7507 3.8949 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2507 3.8946 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.0009 5.1935 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2511 6.4927 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0014 7.7916 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.5014 7.7913 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2511 6.4922 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.5009 5.1932 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2507 3.8941 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7498 -1.3008 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.0002 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 0.0002 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0001 -0.6000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2918 1.1815 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6277 0.4100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6271 -3.0090 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2910 -3.7801 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0004 -1.9981 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2005 -2.5979 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0007 -3.7981 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3994 -3.6383 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0994 -3.6387 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4002 1.0383 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3500 0.2580 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9006 3.6356 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6231 4.3055 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9593 5.0766 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0511 6.4929 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.4016 8.8309 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.1016 8.8304 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.4511 6.4919 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.2114 3.2943 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.8505 2.8547 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.2900 4.4939 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 34 1 0 0 0 0 2 35 1 0 0 0 0 3 4 1 0 0 0 0 3 6 1 0 0 0 0 4 5 1 0 0 0 0 4 36 1 0 0 0 0 4 37 1 0 0 0 0 5 38 1 0 0 0 0 5 39 1 0 0 0 0 5 40 1 0 0 0 0 6 7 2 0 0 0 0 6 8 2 0 0 0 0 6 9 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 41 1 0 0 0 0 11 12 1 0 0 0 0 11 42 1 0 0 0 0 12 13 2 0 0 0 0 12 30 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 14 43 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 44 1 0 0 0 0 18 19 1 0 0 0 0 18 45 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 46 1 0 0 0 0 21 47 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 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 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 1 0 0 0 0 29 52 1 0 0 0 0 29 53 1 0 0 0 0 29 54 1 0 0 0 0 M END