MMs02821502 MOE2007 2D CORINA 3.40 0006 02.08.2006 61 65 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 -0.7543 1.2966 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0086 2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4914 2.6030 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2457 1.3064 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5000 0.0049 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2371 3.9045 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.6225 5.2728 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7339 6.2802 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0354 5.5345 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7284 4.0662 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7358 2.9548 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 6.2020 3.2715 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2093 2.1601 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7505 0.7320 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.6755 2.4768 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.6829 1.3654 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3758 -0.1028 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.6773 -0.8485 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7887 0.1588 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1741 1.5271 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 13.2570 -0.1482 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7252 -1.5733 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7252 -2.6913 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1934 -4.1163 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6617 -4.4234 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6617 -3.3053 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1934 -1.8803 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1299 -5.8484 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 0.1543 5.5798 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8457 4.4618 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3140 4.7689 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7822 6.1939 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7822 7.3119 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3139 7.0049 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5966 -1.0412 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9543 1.2926 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6120 3.6353 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4457 1.3104 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1034 -1.0323 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7488 4.3826 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2175 3.9108 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0426 3.6193 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8067 -2.0416 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2949 1.0512 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.4447 0.0227 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5506 -2.4457 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3934 -5.0107 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.8363 -3.5510 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.9935 -0.9859 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7543 6.6191 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1740 3.8293 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2916 3.3477 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3519 3.5694 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5017 4.5979 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8399 5.6270 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5241 7.1371 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8019 7.9445 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3363 8.4260 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8738 7.1758 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2760 8.2043 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 36 1 0 0 0 0 2 3 2 0 0 0 0 2 37 1 0 0 0 0 3 4 1 0 0 0 0 3 38 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 39 1 0 0 0 0 6 40 1 0 0 0 0 7 8 1 0 0 0 0 7 11 1 0 0 0 0 8 9 2 0 0 0 0 8 30 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 41 1 0 0 0 0 13 42 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 43 1 0 0 0 0 17 18 2 0 0 0 0 17 21 1 0 0 0 0 18 19 1 0 0 0 0 19 20 2 0 0 0 0 19 44 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 45 1 0 0 0 0 22 46 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 47 1 0 0 0 0 25 26 1 0 0 0 0 25 48 1 0 0 0 0 26 27 2 0 0 0 0 26 29 1 0 0 0 0 27 28 1 0 0 0 0 27 49 1 0 0 0 0 28 50 1 0 0 0 0 30 31 1 0 0 0 0 30 35 1 0 0 0 0 30 51 1 0 0 0 0 31 32 1 0 0 0 0 31 52 1 0 0 0 0 31 53 1 0 0 0 0 32 33 1 0 0 0 0 32 54 1 0 0 0 0 32 55 1 0 0 0 0 33 34 1 0 0 0 0 33 56 1 0 0 0 0 33 57 1 0 0 0 0 34 35 1 0 0 0 0 34 58 1 0 0 0 0 34 59 1 0 0 0 0 35 60 1 0 0 0 0 35 61 1 0 0 0 0 M END