MMs01726513 MOE2007 2D CORINA 3.40 0006 02.08.2006 45 47 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 1.4177 -0.4902 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0175 0.8847 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 2.6175 1.9239 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5104 0.7390 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8332 -0.7258 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 4.1438 -1.8849 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5398 -1.4855 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 5.2981 -0.4030 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.1466 0.4455 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9753 1.0618 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7828 2.3259 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5622 -1.2106 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.8935 -0.5197 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9609 0.9788 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.1576 -1.3272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8485 -2.6586 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3470 -2.7259 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1546 -1.4619 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4637 -0.1305 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9652 -0.0631 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2579 2.1781 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2421 2.1669 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3373 -1.5308 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3921 1.1341 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1341 0.3921 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3921 -1.1341 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5083 -2.4094 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7036 -3.0180 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0037 -3.8485 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0858 -3.8972 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4551 -3.1866 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0383 -2.2737 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1075 -0.7326 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6086 0.2289 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3085 1.0595 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8571 0.3975 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2264 1.1081 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4952 -0.6665 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5269 -2.3633 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1698 -2.3950 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8262 -2.0181 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.3206 -1.6951 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7724 -3.2169 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9981 3.4827 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 8 1 0 0 0 0 2 24 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 22 1 0 0 0 0 5 6 1 0 0 0 0 5 11 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 9 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 13 1 0 0 0 0 11 12 2 0 0 0 0 13 14 1 0 0 0 0 13 28 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 21 1 0 0 0 0 16 42 1 0 0 0 0 17 18 1 0 0 0 0 17 29 1 0 0 0 0 17 30 1 0 0 0 0 18 19 1 0 0 0 0 18 31 1 0 0 0 0 18 32 1 0 0 0 0 19 20 1 0 0 0 0 19 33 1 0 0 0 0 19 34 1 0 0 0 0 20 21 1 0 0 0 0 20 35 1 0 0 0 0 20 36 1 0 0 0 0 21 37 1 0 0 0 0 21 38 1 0 0 0 0 22 23 2 0 0 0 0 22 45 1 0 0 0 0 24 39 1 0 0 0 0 24 40 1 0 0 0 0 24 41 1 0 0 0 0 42 43 1 0 0 0 0 42 44 1 0 0 0 0 M CHG 1 45 -1 M END