MMs01456191 MOE2007 2D CORINA 3.40 0006 02.08.2006 49 51 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 1.2947 0.7575 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 0.0150 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2860 2.2575 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.2139 2.2488 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7860 2.2661 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2774 3.7574 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5721 4.5149 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5634 6.0149 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2600 6.7574 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0346 5.9999 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0260 4.4999 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3380 6.7424 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3466 8.2424 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6327 5.9849 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6240 4.4849 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9187 3.7274 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2220 4.4699 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.2307 5.9699 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9360 6.7274 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5167 3.7124 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -5.7592 2.4178 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.2742 5.0071 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.8114 2.9549 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1852 3.5571 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.1825 2.4366 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.4250 1.1420 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9596 1.4623 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 1.2514 8.2574 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.6060 1.0357 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0357 -0.6060 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6060 -1.0357 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0040 -1.0277 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6407 -0.5790 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1920 1.0577 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6147 3.9209 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5991 6.6209 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0617 3.8939 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4435 4.7001 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2071 3.3597 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1421 2.8127 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6847 2.8037 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4113 5.7547 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6476 7.0951 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1700 7.6511 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7127 7.6422 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4415 4.7294 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.3766 2.5552 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9067 0.0429 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 4 5 2 0 0 0 0 4 6 2 0 0 0 0 4 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 36 1 0 0 0 0 9 10 1 0 0 0 0 9 37 1 0 0 0 0 10 11 2 0 0 0 0 10 29 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 12 38 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 20 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 1 0 0 0 0 17 41 1 0 0 0 0 17 42 1 0 0 0 0 18 19 1 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 19 43 1 0 0 0 0 19 44 1 0 0 0 0 20 45 1 0 0 0 0 20 46 1 0 0 0 0 21 22 2 0 0 0 0 21 23 2 0 0 0 0 21 24 1 0 0 0 0 24 25 2 0 0 0 0 24 28 1 0 0 0 0 25 26 1 0 0 0 0 25 47 1 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 M END