MMs01769979 MOE2007 2D CORINA 3.40 0006 02.08.2006 40 43 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 0.1818 -1.4889 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5622 -2.0759 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7608 -1.1740 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5789 0.3150 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1985 0.9019 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9388 0.9480 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9611 -0.1497 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2330 -1.4611 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7395 -2.5490 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2260 2.4203 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6445 2.9077 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.7760 1.9229 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.1946 2.4103 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4817 3.8826 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.3260 1.4255 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7878 1.7620 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5595 0.4757 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5747 -0.6557 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.1943 -0.0687 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.1653 -0.6861 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0537 0.3440 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9149 1.5722 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.4091 1.4405 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.0421 0.0806 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1810 -1.1475 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6867 -1.0158 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.8140 -2.5074 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 17.5363 -0.0511 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -1.1043 0.4696 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7770 -2.2105 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7077 -3.2671 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0531 2.0931 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1522 -0.0042 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3208 3.2081 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5462 0.7451 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2574 2.8663 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4084 2.6601 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.0980 2.4230 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9978 -1.9984 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 30 1 0 0 0 0 2 3 2 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 3 32 1 0 0 0 0 4 5 2 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 33 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 8 34 1 0 0 0 0 9 10 1 0 0 0 0 11 12 2 0 0 0 0 11 35 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 36 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 2 0 0 0 0 16 20 1 0 0 0 0 17 18 1 0 0 0 0 17 37 1 0 0 0 0 18 19 2 0 0 0 0 18 22 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 38 1 0 0 0 0 24 25 1 0 0 0 0 24 39 1 0 0 0 0 25 26 2 0 0 0 0 25 29 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 27 40 1 0 0 0 0 M END