MMs01085436 MOE2007 2D CORINA 3.40 0006 02.08.2006 43 46 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 0.7428 -1.3032 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2428 -1.3115 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -0.0166 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4999 -0.0249 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2427 -1.3280 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4856 -2.6229 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9856 -2.6146 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2284 -3.9095 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2571 1.2700 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7571 1.2617 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.4999 -0.0414 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7427 -1.3363 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4855 -2.6395 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9855 -2.6478 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7427 -1.3529 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9999 -0.0497 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2081 -1.6729 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.1043 -0.8749 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3567 -3.1655 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9830 -3.7680 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.6516 -3.9227 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6433 -5.4226 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9382 -6.1798 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2413 -5.4370 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2496 -3.9370 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9547 -3.1799 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9630 -1.6799 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 16.5362 -6.1942 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.0425 0.5942 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5942 1.0425 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0425 -0.5942 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4057 1.0260 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8427 -1.3313 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0798 -3.6654 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8227 -4.9520 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6629 2.3125 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1427 -1.3330 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8798 -3.6754 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6056 0.9862 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6007 -6.0169 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9315 -7.3798 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.2921 -3.3428 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 5 10 1 0 0 0 0 6 7 2 0 0 0 0 6 34 1 0 0 0 0 7 8 1 0 0 0 0 7 35 1 0 0 0 0 8 9 1 0 0 0 0 9 36 1 0 0 0 0 10 11 2 0 0 0 0 10 37 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 38 1 0 0 0 0 14 15 1 0 0 0 0 14 39 1 0 0 0 0 15 16 2 0 0 0 0 15 21 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 17 40 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 41 1 0 0 0 0 24 25 1 0 0 0 0 24 42 1 0 0 0 0 25 26 2 0 0 0 0 25 29 1 0 0 0 0 26 27 1 0 0 0 0 26 43 1 0 0 0 0 27 28 1 0 0 0 0 M END