MMs02510587 MOE2007 2D CORINA 3.40 0006 02.08.2006 58 58 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 1.3004 -0.7476 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 0.0048 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3032 -2.2476 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0055 -3.0000 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.0447 -3.6000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2949 -2.2524 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.3341 -1.6524 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5926 -3.0048 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5898 -4.5048 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.2894 -5.2524 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0083 -4.5000 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 0.0083 -5.7000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3087 -5.2476 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 2.3479 -5.8476 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3114 -6.7476 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.3114 -7.9476 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6119 -7.4952 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6146 -8.9952 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0138 -7.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6063 -4.4952 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3374 -5.8052 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5850 -7.1028 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0898 -4.5075 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8422 -3.2099 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3422 -3.2126 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0946 -1.9150 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5946 -1.9177 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -9.3470 -0.6201 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.8469 -0.6228 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2977 -0.7524 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5981 1.0403 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0403 0.5981 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5981 -1.0403 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3435 -2.8457 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0051 -1.8779 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1832 -3.1100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0202 -6.3668 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7940 -7.7014 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6550 -9.5933 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 -8.7000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6467 -5.0933 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2787 -3.0036 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0527 -2.0285 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1316 -4.3940 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4691 -3.6251 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9677 -1.5025 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3051 -0.7336 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2201 -0.2076 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5575 0.5613 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.6364 -1.8042 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.9738 -1.0353 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.0012 1.7152 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3380 -0.1543 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8374 -5.8079 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.5993 0.6748 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -12.7993 0.6726 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4355 -6.8483 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 2 0 0 0 0 2 4 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 7 1 0 0 0 0 5 12 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 31 1 0 0 0 0 9 10 1 0 0 0 0 9 36 1 0 0 0 0 9 37 1 0 0 0 0 10 11 1 0 0 0 0 10 22 1 0 0 0 0 10 24 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 21 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 20 1 0 0 0 0 18 19 1 0 0 0 0 18 38 1 0 0 0 0 18 39 1 0 0 0 0 19 40 1 0 0 0 0 20 41 1 0 0 0 0 21 42 1 0 0 0 0 22 23 2 0 0 0 0 22 55 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 25 43 1 0 0 0 0 25 44 1 0 0 0 0 26 27 1 0 0 0 0 26 45 1 0 0 0 0 26 46 1 0 0 0 0 27 28 1 0 0 0 0 27 47 1 0 0 0 0 27 48 1 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 29 49 1 0 0 0 0 29 50 1 0 0 0 0 30 51 1 0 0 0 0 30 52 1 0 0 0 0 30 56 1 0 0 0 0 31 54 1 0 0 0 0 53 56 1 0 0 0 0 55 58 1 0 0 0 0 56 57 1 0 0 0 0 M END