MMs01437227 MOE2007 2D CORINA 3.40 0006 02.08.2006 53 55 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 1.1995 0.9006 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4268 0.0381 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9857 -1.3956 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4859 -1.4191 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8459 0.5239 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9762 -0.4621 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3954 0.0237 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 5.9095 1.4429 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8812 -1.3954 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8145 0.5096 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9448 -0.4765 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3640 0.0094 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6528 1.4813 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5224 2.4674 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1033 1.9815 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0719 1.9672 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3607 3.4391 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.2022 0.9811 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.6214 1.4669 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7517 0.4809 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.4629 -0.9911 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.1708 0.9667 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 18.3012 -0.0194 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.7203 0.4665 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.8506 -0.5196 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.2698 -0.0337 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.4001 -1.0198 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.1113 -2.4917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.6922 -2.9776 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.5618 -1.9915 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 24.2416 -3.4778 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -1.1469 0.3529 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1807 2.1005 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2042 -2.4009 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2660 1.5745 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7798 1.2775 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7452 -1.6397 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7138 -1.6540 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2682 -0.7795 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7535 3.6449 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1990 2.7704 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0414 2.5175 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5553 2.2205 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.4019 2.1443 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.3673 -0.7729 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.8811 -1.0699 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.1404 1.5171 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.6542 1.2200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 22.5008 1.1438 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 24.5354 -0.6311 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 21.4611 -4.1551 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.4265 -2.3802 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 5 2 0 0 0 0 1 33 1 0 0 0 0 2 3 2 0 0 0 0 2 34 1 0 0 0 0 3 4 1 0 0 0 0 3 6 1 0 0 0 0 4 5 1 0 0 0 0 5 35 1 0 0 0 0 6 7 1 0 0 0 0 6 36 1 0 0 0 0 6 37 1 0 0 0 0 7 8 1 0 0 0 0 7 38 1 0 0 0 0 8 9 2 0 0 0 0 8 10 2 0 0 0 0 8 11 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 39 1 0 0 0 0 13 14 1 0 0 0 0 13 40 1 0 0 0 0 14 15 2 0 0 0 0 14 17 1 0 0 0 0 15 16 1 0 0 0 0 15 41 1 0 0 0 0 16 42 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 43 1 0 0 0 0 20 44 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 45 1 0 0 0 0 24 25 1 0 0 0 0 24 46 1 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 25 49 1 0 0 0 0 26 27 1 0 0 0 0 26 31 2 0 0 0 0 27 28 2 0 0 0 0 27 50 1 0 0 0 0 28 29 1 0 0 0 0 28 51 1 0 0 0 0 29 30 2 0 0 0 0 29 32 1 0 0 0 0 30 31 1 0 0 0 0 30 52 1 0 0 0 0 31 53 1 0 0 0 0 M END