MMs01727057 MOE2007 2D CORINA 3.40 0006 02.08.2006 77 81 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 -0.7567 -1.2952 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5134 -2.5903 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5385 -2.0518 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5307 -3.5518 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8259 -4.3085 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1288 -3.5652 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1365 -2.0652 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8414 -1.3086 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8491 0.1914 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1520 0.9347 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1597 2.4347 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 4.1989 1.8347 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4626 3.1780 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4703 4.6780 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7732 5.4213 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0684 4.6646 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0606 3.1646 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7578 2.4213 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3558 2.4079 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6587 3.1512 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9538 2.3945 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9461 0.8945 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2413 0.1378 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5441 0.8811 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.8393 0.1244 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.1422 0.8677 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.1499 2.3677 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.8548 3.1244 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5519 2.3811 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2567 3.1378 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 17.4528 3.1110 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.8646 3.1914 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 1.8723 4.6914 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5771 5.4481 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6176 4.5411 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8057 6.0292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6433 6.5032 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2625 7.9541 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1844 8.3498 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0518 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9.9038 0.2999 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2351 -1.0622 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.8331 -1.0756 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.1783 0.2624 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.8610 4.3244 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0530 4.4769 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0804 5.2541 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0690 3.4738 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7639 4.1861 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5399 7.1994 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0043 6.0877 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9849 6.0100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7334 7.0048 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0942 -1.1331 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3286 9.0093 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0240 10.1700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 42 1 0 0 0 0 1 43 1 0 0 0 0 1 44 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 41 1 0 0 0 0 3 45 1 0 0 0 0 3 46 1 0 0 0 0 3 47 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 48 1 0 0 0 0 6 7 1 0 0 0 0 6 49 1 0 0 0 0 7 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