MMs01978684 MOE2007 2D CORINA 3.40 0006 02.08.2006 40 42 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 0.7467 1.3009 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2467 1.3048 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 0.0077 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2533 -1.2933 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7533 -1.2971 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0066 -2.5981 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6202 -3.9668 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4919 -4.9734 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7929 -4.2267 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4848 -2.7587 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4913 -1.6465 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.9577 -1.9621 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9642 -0.8500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5044 0.5778 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.4307 -1.1656 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.4372 -0.0534 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9286 -0.2140 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5422 1.1547 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4300 2.1613 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1291 1.4146 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9934 2.6057 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.0031 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1440 2.3386 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2000 0.0107 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8560 -2.3310 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7946 -4.2133 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3635 -6.1665 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5053 -3.0736 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9737 -2.6006 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7986 -2.3078 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7478 -1.2125 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6761 -1.3872 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.0689 -0.5877 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.5799 0.5521 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.2500 2.1238 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3238 2.9620 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7272 3.1339 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9869 1.0467 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6438 2.5121 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 23 1 0 0 0 0 2 3 2 0 0 0 0 2 24 1 0 0 0 0 3 4 1 0 0 0 0 3 22 1 0 0 0 0 4 5 2 0 0 0 0 4 25 1 0 0 0 0 5 6 1 0 0 0 0 5 26 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 11 1 0 0 0 0 8 9 2 0 0 0 0 8 27 1 0 0 0 0 9 10 1 0 0 0 0 9 28 1 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 29 1 0 0 0 0 13 30 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 31 1 0 0 0 0 17 18 1 0 0 0 0 17 21 1 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 18 34 1 0 0 0 0 19 20 1 0 0 0 0 19 35 1 0 0 0 0 19 36 1 0 0 0 0 20 21 1 0 0 0 0 20 37 1 0 0 0 0 20 38 1 0 0 0 0 21 39 1 0 0 0 0 21 40 1 0 0 0 0 M END