MMs00668300 MOE2007 2D CORINA 3.40 0006 02.08.2006 42 43 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 1.2958 -0.7556 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2893 -2.2556 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 -0.0112 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6045 1.4887 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3088 2.2444 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9068 2.2331 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2026 1.4775 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5049 2.2219 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5114 3.7219 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2156 4.4775 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9133 3.7331 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6175 4.4887 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 7.8006 1.4663 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.1029 2.2106 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1094 3.7106 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 10.3987 1.4550 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.7010 2.1994 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7075 3.6994 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.9967 1.4438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2990 2.1882 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5948 1.4326 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5883 -0.0674 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2860 -0.8118 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9903 -0.0562 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6045 1.0366 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0366 0.6045 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6045 -1.0366 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2566 -1.3556 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0893 -2.2504 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2841 -3.4556 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4893 -2.2608 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1974 0.2775 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5532 4.3174 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2208 5.6775 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7955 0.2663 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3935 0.2550 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3042 3.3882 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.6366 2.0281 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.6249 -0.6719 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2809 -2.0118 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9484 -0.6517 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 29 1 0 0 0 0 3 30 1 0 0 0 0 3 31 1 0 0 0 0 3 32 1 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 9 14 1 0 0 0 0 10 11 2 0 0 0 0 10 34 1 0 0 0 0 11 12 1 0 0 0 0 11 35 1 0 0 0 0 12 13 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 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 37 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 38 1 0 0 0 0 22 23 1 0 0 0 0 22 39 1 0 0 0 0 23 24 2 0 0 0 0 23 40 1 0 0 0 0 24 25 1 0 0 0 0 24 41 1 0 0 0 0 25 42 1 0 0 0 0 M END