MMs01037708 MOE2007 2D CORINA 3.40 0006 02.08.2006 43 46 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 -0.7545 -1.2964 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0091 -2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4909 -2.6033 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2454 -1.3069 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5000 -0.0052 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7454 -1.3122 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6314 -0.1017 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.0563 -0.5702 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0511 -2.0702 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6229 -2.5288 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2729 0.3072 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6411 -0.3077 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8577 0.5697 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7061 2.0620 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3379 2.6769 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1213 1.7995 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9227 2.9395 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.2909 2.3246 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4425 0.8323 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.5075 3.2020 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.8757 2.5871 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 16.1773 3.3326 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2885 2.3250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.6736 0.9568 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1824 1.1188 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 18.7568 2.6317 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 19.2253 4.0567 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 19.7566 1.5135 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 2.2364 -3.9050 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 -0.5964 1.0413 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9545 -1.2922 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6127 -3.6352 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1036 1.0319 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7623 -1.5016 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9522 0.0778 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2167 3.8708 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0268 2.2914 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8015 4.1333 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6472 4.0386 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1820 4.1945 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.3069 4.5255 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.2700 -0.0845 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 31 1 0 0 0 0 2 3 2 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 33 1 0 0 0 0 4 5 2 0 0 0 0 4 30 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 34 1 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 12 1 0 0 0 0 10 11 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 35 1 0 0 0 0 14 15 1 0 0 0 0 14 36 1 0 0 0 0 15 16 2 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 16 37 1 0 0 0 0 17 38 1 0 0 0 0 18 19 1 0 0 0 0 18 39 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 40 1 0 0 0 0 21 41 1 0 0 0 0 22 23 1 0 0 0 0 22 26 1 0 0 0 0 23 24 2 0 0 0 0 23 42 1 0 0 0 0 24 25 1 0 0 0 0 24 27 1 0 0 0 0 25 26 2 0 0 0 0 25 43 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 M CHG 1 27 1 M CHG 1 29 -1 M END