MMs01128511 MOE2007 2D CORINA 3.40 0006 02.08.2006 43 45 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 1.3032 0.7427 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 -0.0146 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9013 0.7280 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9097 2.2280 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 -0.0293 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3445 -1.5219 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8099 -1.8421 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 7.5672 -0.5473 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5698 0.5731 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.0598 -0.3989 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9347 -1.6174 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.3169 -2.9842 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4652 -4.4769 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0984 -3.8590 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4273 -1.4690 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0451 -0.1021 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.3021 -2.6875 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.7948 -2.5391 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.4126 -1.1722 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.9052 -1.0238 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.7801 -2.2423 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.1622 -3.6092 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6696 -3.7575 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.0371 -4.8276 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 18.2727 -2.0939 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.5941 1.0426 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0426 -0.5941 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5941 -1.0426 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5371 1.6663 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0798 1.6576 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4482 -2.3198 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7356 0.7565 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1413 0.1211 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4760 -3.2948 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6618 -4.5673 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1684 -5.6396 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2399 -3.0206 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4217 -4.8501 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8079 -3.7809 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7127 -0.1974 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.3995 0.0697 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1753 -4.8510 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 30 1 0 0 0 0 2 31 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 2 0 0 0 0 6 10 1 0 0 0 0 7 8 1 0 0 0 0 7 32 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 33 1 0 0 0 0 11 34 1 0 0 0 0 12 13 1 0 0 0 0 12 16 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 35 1 0 0 0 0 14 15 1 0 0 0 0 14 36 1 0 0 0 0 14 37 1 0 0 0 0 15 38 1 0 0 0 0 15 39 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 40 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 41 1 0 0 0 0 21 22 1 0 0 0 0 21 42 1 0 0 0 0 22 23 2 0 0 0 0 22 26 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 24 43 1 0 0 0 0 M END