MMs01323445 MOE2007 2D CORINA 3.40 0006 02.08.2006 60 63 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 1.5000 -0.0062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2446 -1.3084 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4892 -2.6043 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0108 -2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7554 -1.2959 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7662 -3.8940 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0216 -5.1961 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4783 -5.2024 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2338 -3.9064 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.0338 -3.9064 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7337 -3.9127 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4891 -2.6168 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7446 -1.3146 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9891 -2.6230 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7445 -1.3271 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2445 -1.3334 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9999 -0.0375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9891 -2.6355 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.4891 -2.6418 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2445 -1.3459 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7445 -1.3521 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4891 -2.6543 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7337 -3.9502 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2337 -3.9439 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4782 -5.2523 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7804 -4.5077 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 14.2228 -6.5545 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 12.1761 -5.9969 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 14.9891 -2.6605 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 2.2229 -6.5045 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 3.5251 -5.7599 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9208 -7.2491 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9675 -7.8067 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4675 -7.8129 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2121 -9.1150 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4567 -10.4110 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9567 -10.4047 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2121 -9.1026 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2013 -11.7131 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 -0.5957 1.0417 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1043 1.0305 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8446 -1.3109 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9554 -1.2909 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6823 -3.1188 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6887 -4.6615 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1510 -5.6018 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1818 -6.3787 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5204 -5.0936 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8597 -4.3278 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6186 -0.9120 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9578 -0.1462 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3848 -3.6723 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6488 -0.3042 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3488 -0.3154 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6294 -4.9806 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0718 -6.7762 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4121 -9.1200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3524 -11.4414 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0121 -9.0976 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 41 1 0 0 0 0 2 3 2 0 0 0 0 2 42 1 0 0 0 0 3 4 1 0 0 0 0 3 43 1 0 0 0 0 4 5 2 0 0 0 0 4 10 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 44 1 0 0 0 0 7 8 1 0 0 0 0 7 45 1 0 0 0 0 7 46 1 0 0 0 0 8 9 1 0 0 0 0 8 47 1 0 0 0 0 8 48 1 0 0 0 0 9 10 1 0 0 0 0 9 31 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 49 1 0 0 0 0 12 50 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 51 1 0 0 0 0 16 52 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 53 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 54 1 0 0 0 0 22 23 1 0 0 0 0 22 55 1 0 0 0 0 23 24 2 0 0 0 0 23 30 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 25 56 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 26 29 1 0 0 0 0 31 32 2 0 0 0 0 31 33 2 0 0 0 0 31 34 1 0 0 0 0 34 35 1 0 0 0 0 34 39 2 0 0 0 0 35 36 2 0 0 0 0 35 57 1 0 0 0 0 36 37 1 0 0 0 0 36 58 1 0 0 0 0 37 38 2 0 0 0 0 37 40 1 0 0 0 0 38 39 1 0 0 0 0 38 59 1 0 0 0 0 39 60 1 0 0 0 0 M END