MMs01609014 MOE2007 2D CORINA 3.40 0006 02.08.2006 40 42 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 1.3038 0.7416 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3135 2.2416 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6173 2.9832 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9115 2.2249 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9019 0.7249 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 -0.0167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5884 -1.5167 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3692 -2.3905 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8235 -3.8201 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3235 -3.8297 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7962 -2.4062 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0544 -1.9178 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.1755 -2.9143 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5991 -2.4416 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9015 -0.9724 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7203 -3.4381 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.1438 -2.9654 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2650 -3.9619 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6886 -3.4892 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9910 -2.0200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8698 -1.0235 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4463 -1.4962 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.4146 -1.5473 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 5.1960 -0.0335 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5933 1.0431 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0431 -0.5933 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5933 -1.0431 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2782 2.8483 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6251 4.1832 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9546 2.8182 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2347 -3.6592 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7457 -3.9702 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4783 -4.6135 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0231 -5.1373 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5855 -4.2864 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1118 0.1518 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5894 -1.0688 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2314 -0.6401 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8027 1.0019 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 29 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 5 6 2 0 0 0 0 5 31 1 0 0 0 0 6 7 1 0 0 0 0 6 25 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 12 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 11 12 2 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 32 1 0 0 0 0 14 33 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 34 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 35 1 0 0 0 0 20 21 1 0 0 0 0 20 36 1 0 0 0 0 21 22 2 0 0 0 0 21 24 1 0 0 0 0 22 23 1 0 0 0 0 22 37 1 0 0 0 0 25 38 1 0 0 0 0 25 39 1 0 0 0 0 25 40 1 0 0 0 0 M END