MMs02748828 MOE2007 2D CORINA 3.40 0006 02.08.2006 54 56 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 -0.7557 1.2957 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0115 2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4885 2.6047 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2443 1.3089 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5000 0.0066 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2328 3.9070 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7328 3.9136 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4771 5.2159 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9770 5.2226 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 5.9836 3.7226 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9704 6.7225 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4770 5.2292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2327 3.9334 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7327 3.9401 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4770 5.2424 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7213 6.5381 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2213 6.5315 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9770 5.2490 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.7212 6.5513 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2212 6.5579 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9769 5.2622 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.9655 7.8603 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 16.4655 7.8669 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2097 9.1692 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.4540 10.4649 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.1983 11.7673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.6983 11.7739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.4540 10.4782 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.7097 9.1758 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.4655 7.8801 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.5954 -1.0419 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9557 1.2904 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6160 3.6346 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4442 1.3142 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1046 -1.0300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1034 4.3124 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4360 5.0897 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5296 2.7309 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8622 3.5082 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8725 6.2525 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6373 2.8916 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3373 2.9035 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3167 7.5800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6167 7.5681 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5918 6.9568 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9244 7.7340 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3609 8.8969 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.2623 6.6842 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.5949 7.4614 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.2540 10.4597 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.5937 12.8038 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.2937 12.8158 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.6540 10.4835 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 32 1 0 0 0 0 2 3 2 0 0 0 0 2 33 1 0 0 0 0 3 4 1 0 0 0 0 3 34 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 35 1 0 0 0 0 6 36 1 0 0 0 0 7 8 1 0 0 0 0 7 37 1 0 0 0 0 7 38 1 0 0 0 0 8 9 1 0 0 0 0 8 39 1 0 0 0 0 8 40 1 0 0 0 0 9 10 1 0 0 0 0 9 41 1 0 0 0 0 10 11 2 0 0 0 0 10 12 2 0 0 0 0 10 13 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 42 1 0 0 0 0 15 16 1 0 0 0 0 15 43 1 0 0 0 0 16 17 2 0 0 0 0 16 19 1 0 0 0 0 17 18 1 0 0 0 0 17 44 1 0 0 0 0 18 45 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 46 1 0 0 0 0 20 47 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 48 1 0 0 0 0 24 25 1 0 0 0 0 24 49 1 0 0 0 0 24 50 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 26 51 1 0 0 0 0 27 28 1 0 0 0 0 27 52 1 0 0 0 0 28 29 2 0 0 0 0 28 53 1 0 0 0 0 29 30 1 0 0 0 0 29 54 1 0 0 0 0 30 31 1 0 0 0 0 M END