MMs01421065 MOE2007 2D CORINA 3.40 0006 02.08.2006 50 52 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 1.3041 0.7411 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.3041 -0.4589 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 -0.0177 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5878 -1.5176 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8817 -2.2765 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3143 2.2411 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6184 2.9823 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9123 2.2234 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6286 4.4822 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9327 5.2234 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9429 6.7233 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6490 7.4822 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3449 6.7410 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3347 5.2410 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0306 4.4999 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0204 2.9999 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2837 2.2588 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.5776 3.0176 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.6168 3.6176 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5674 4.5176 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8817 2.2765 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8919 0.7765 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1756 3.0353 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.4797 2.2941 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4899 0.7942 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7940 0.0530 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0880 0.8118 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0778 2.3118 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7736 3.0529 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -10.3921 0.0707 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.5929 1.0433 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0433 -0.5929 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5929 -1.0433 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0161 1.1071 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7783 -0.2341 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2747 -3.3116 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9168 -2.8835 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4888 -1.2413 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9679 4.6163 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9862 7.3163 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6572 8.6821 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3098 7.3481 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3674 4.5094 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5592 5.7175 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7674 4.5257 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1675 4.2352 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4548 0.1871 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8022 -1.1470 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.1129 2.9189 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 7 1 0 0 0 0 4 5 1 0 0 0 0 4 35 1 0 0 0 0 4 36 1 0 0 0 0 5 6 1 0 0 0 0 6 37 1 0 0 0 0 6 38 1 0 0 0 0 6 39 1 0 0 0 0 7 8 1 0 0 0 0 7 17 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 40 1 0 0 0 0 12 13 1 0 0 0 0 12 41 1 0 0 0 0 13 14 2 0 0 0 0 13 42 1 0 0 0 0 14 15 1 0 0 0 0 14 43 1 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 22 1 0 0 0 0 21 44 1 0 0 0 0 21 45 1 0 0 0 0 21 46 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 24 47 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 26 48 1 0 0 0 0 27 28 1 0 0 0 0 27 49 1 0 0 0 0 28 29 2 0 0 0 0 28 31 1 0 0 0 0 29 30 1 0 0 0 0 29 50 1 0 0 0 0 M END