MMs00028887 MOE2007 2D CORINA 3.40 0006 02.08.2006 55 59 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 0.7460 1.3013 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2460 1.3059 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 0.0092 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2540 -1.2921 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7540 -1.2967 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 0.0138 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2540 -1.2829 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7540 -1.2783 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6394 -2.4891 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0645 -2.0212 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.0599 -0.5212 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.6319 -0.0621 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.2807 -2.8992 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 9.2415 -3.4992 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2853 -4.3992 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7133 -4.8583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.5913 -3.6421 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 13.1913 -4.6813 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7059 -2.4313 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 11.1059 -1.3920 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5838 -1.2151 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.0118 -1.6742 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0164 -3.1742 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 15.0557 -2.5742 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.2327 -4.0521 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 16.6011 -3.4378 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.7533 -1.9456 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 17.8173 -4.3158 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 19.1858 -3.7015 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.3380 -2.2092 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.7064 -1.5949 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.9227 -2.4729 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.7704 -3.9651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.4020 -4.5794 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.9867 -4.8431 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 24.2029 -5.7210 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.0037 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1428 2.3387 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8428 2.3470 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8572 -2.3295 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1572 -2.3378 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1276 -1.6968 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4660 -2.4640 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2720 -3.6315 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0915 -4.2774 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0394 -5.5737 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2577 -0.4997 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.2056 -1.7960 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.1109 -5.2459 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.6956 -5.5096 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.3650 -1.5069 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.8282 -0.4011 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 23.0174 -1.9814 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.2802 -5.7732 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 38 1 0 0 0 0 2 3 2 0 0 0 0 2 39 1 0 0 0 0 3 4 1 0 0 0 0 3 40 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 41 1 0 0 0 0 6 42 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 43 1 0 0 0 0 8 44 1 0 0 0 0 9 10 2 0 0 0 0 9 13 1 0 0 0 0 10 11 1 0 0 0 0 10 45 1 0 0 0 0 11 12 1 0 0 0 0 11 14 1 0 0 0 0 12 13 2 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 20 1 0 0 0 0 16 17 1 0 0 0 0 16 46 1 0 0 0 0 16 47 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 24 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 23 24 1 0 0 0 0 23 48 1 0 0 0 0 23 49 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 26 27 1 0 0 0 0 26 50 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 29 30 1 0 0 0 0 29 51 1 0 0 0 0 30 31 1 0 0 0 0 30 35 2 0 0 0 0 31 32 2 0 0 0 0 31 52 1 0 0 0 0 32 33 1 0 0 0 0 32 53 1 0 0 0 0 33 34 2 0 0 0 0 33 54 1 0 0 0 0 34 35 1 0 0 0 0 34 36 1 0 0 0 0 35 55 1 0 0 0 0 36 37 3 0 0 0 0 M END