MMs01458897 MOE2007 2D CORINA 3.40 0006 02.08.2006 44 45 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 1.3720 0.6063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5831 -0.2788 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9551 0.3275 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1160 1.8188 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1662 -0.5576 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.5382 0.0487 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6991 1.5401 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7492 -0.8363 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1212 -0.2300 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.4182 -0.9837 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5708 -2.4759 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.5357 0.0169 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 10.9294 1.3889 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.4372 1.2363 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4366 2.3538 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.6072 -1.0328 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9615 0.4827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2711 1.9504 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6970 2.4162 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.8133 1.4142 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5037 -0.0535 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0778 -0.5192 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2391 1.8800 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.3554 0.8781 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.0458 -0.5896 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 19.7813 1.3438 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 -0.4850 1.0976 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0976 -0.4850 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4850 -1.0976 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7038 1.6030 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2375 1.4375 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0374 -1.7506 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8837 -1.6675 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4175 -1.8330 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5323 2.4265 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7675 -1.8900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0358 -1.4526 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4470 -0.1755 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3781 2.7520 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.9446 3.5903 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.3967 -0.8550 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9540 -1.1063 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.2039 0.0295 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 31 1 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 33 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 34 1 0 0 0 0 9 35 1 0 0 0 0 10 11 1 0 0 0 0 10 15 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 17 1 0 0 0 0 13 18 1 0 0 0 0 14 15 1 0 0 0 0 14 36 1 0 0 0 0 15 16 2 0 0 0 0 17 37 1 0 0 0 0 17 38 1 0 0 0 0 17 39 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 40 1 0 0 0 0 20 21 1 0 0 0 0 20 41 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 42 1 0 0 0 0 23 43 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 25 44 1 0 0 0 0 M END