MMs02096865 MOE2007 2D CORINA 3.40 0006 02.08.2006 35 36 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 1.5000 -0.0050 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2543 1.2915 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2456 -1.3066 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4913 -2.6031 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7456 -1.3116 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 -0.0151 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0000 -0.0201 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7456 -1.3217 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9913 -2.6182 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4913 -2.6132 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7369 -3.9197 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 8.2369 -3.9248 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9825 -5.2162 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 8.2456 -1.3267 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 8.9999 -0.0302 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4999 -0.0352 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2543 1.2613 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5087 2.5628 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0087 2.5679 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2543 1.2714 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2630 3.8594 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.0040 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 0.0040 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0040 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2916 0.6880 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8578 2.3287 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2171 1.8950 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9035 1.0261 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6034 1.0171 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8878 -3.6504 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0965 -1.0765 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4543 1.2573 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4122 3.6091 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0543 1.2754 0.0000 H 0 0 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 4 1 0 0 0 0 3 26 1 0 0 0 0 3 27 1 0 0 0 0 3 28 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 11 2 0 0 0 0 7 8 2 0 0 0 0 7 29 1 0 0 0 0 8 9 1 0 0 0 0 8 30 1 0 0 0 0 9 10 2 0 0 0 0 9 15 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 11 31 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 32 1 0 0 0 0 18 19 1 0 0 0 0 18 33 1 0 0 0 0 19 20 2 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 20 34 1 0 0 0 0 21 35 1 0 0 0 0 M CHG 1 12 1 M CHG 1 14 -1 M END