MMs01361392 MOE2007 2D CORINA 3.40 0006 02.08.2006 52 54 0 0 1 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 0.7594 -1.2935 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0189 -2.5980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7784 -3.8916 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2783 -3.8806 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0188 -2.5762 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2594 -1.2826 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0378 -5.1742 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 4.3313 -4.4147 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7442 -5.9336 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7972 -6.4677 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.1971 -7.8424 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3191 -8.8380 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6126 -8.0786 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2901 -6.6136 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.4492 -6.9242 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2856 -5.4916 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8117 -4.0685 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7551 -5.7928 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.7506 -4.6708 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 9.3506 -3.6316 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2767 -3.2477 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2201 -4.9720 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2156 -3.8500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.6940 -6.3952 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.1634 -6.6964 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6373 -8.1195 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1068 -8.4207 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1023 -7.2987 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6284 -5.8755 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1590 -5.5744 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 16.5718 -7.5999 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 11.6418 -9.2415 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.0348 0.6076 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6076 1.0348 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0348 -0.6076 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1811 -2.6067 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1859 -4.9351 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2188 -2.5674 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8518 -0.2391 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1535 -7.2500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4988 -8.8184 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4332 -9.6474 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0315 -9.8037 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1087 -9.1712 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7512 -7.6994 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4153 -2.8685 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8976 -2.1091 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1382 -3.6268 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8975 -7.2928 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.4859 -9.5592 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.4249 -4.9779 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 1 36 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 37 1 0 0 0 0 4 5 1 0 0 0 0 4 38 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 39 1 0 0 0 0 7 40 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 15 1 0 0 0 0 12 13 1 0 0 0 0 12 41 1 0 0 0 0 12 42 1 0 0 0 0 13 14 1 0 0 0 0 13 43 1 0 0 0 0 13 44 1 0 0 0 0 14 15 1 0 0 0 0 14 45 1 0 0 0 0 14 46 1 0 0 0 0 15 16 1 0 0 0 0 15 17 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 22 1 0 0 0 0 20 23 1 0 0 0 0 22 47 1 0 0 0 0 22 48 1 0 0 0 0 22 49 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 25 50 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 33 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 M END