MMs01822569 MOE2007 2D CORINA 3.40 0006 02.08.2006 44 44 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 1.4152 -0.4973 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5534 0.4796 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9686 -0.0177 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1068 0.9592 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5220 0.4619 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6603 1.4388 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0754 0.9415 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3523 -0.5327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2141 -1.5096 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7989 -1.0123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7675 -1.0300 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9058 -0.0531 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6289 1.4211 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.3209 -0.5504 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.4592 0.4265 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.8744 -0.0708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.1513 -1.5450 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.0126 0.9061 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 18.4278 0.4088 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.5660 1.3858 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.9812 0.8885 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3978 1.1321 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1321 0.3978 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3978 -1.1321 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8268 -1.5432 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3429 -1.2584 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6256 1.2407 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1418 1.5255 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3802 -1.0635 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8964 -0.7788 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4387 2.6182 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9860 1.7231 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4356 -2.6890 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8883 -1.7938 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1791 -2.0758 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6953 -1.7911 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5424 -1.7298 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5314 1.1876 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.0476 1.4724 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.7911 2.0855 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.8394 -0.6370 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.3556 -0.3522 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.2891 2.8600 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 26 1 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 28 1 0 0 0 0 3 29 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 4 31 1 0 0 0 0 5 6 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 32 1 0 0 0 0 8 9 1 0 0 0 0 8 33 1 0 0 0 0 9 10 2 0 0 0 0 9 12 1 0 0 0 0 10 11 1 0 0 0 0 10 34 1 0 0 0 0 11 35 1 0 0 0 0 12 13 1 0 0 0 0 12 36 1 0 0 0 0 12 37 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 38 1 0 0 0 0 16 17 1 0 0 0 0 16 39 1 0 0 0 0 16 40 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 19 41 1 0 0 0 0 20 21 1 0 0 0 0 20 42 1 0 0 0 0 20 43 1 0 0 0 0 21 22 2 0 0 0 0 21 44 1 0 0 0 0 M CHG 1 44 -1 M END