MMs03421079 MOE2007 2D CORINA 3.40 0006 02.08.2006 44 46 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 -1.2959 -0.7554 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2896 -2.2554 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0125 -3.0000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3084 -2.2446 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3022 -0.7446 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9065 -2.2337 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 4.6619 -3.5296 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1511 -0.9378 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2024 -1.4783 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 0.0217 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4920 0.7771 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7942 0.0326 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8004 -1.4674 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5045 -2.2228 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0901 0.7880 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.3922 0.0434 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3985 -1.4565 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.6881 0.7989 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9903 0.0543 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2862 0.8097 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2799 2.3097 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5758 3.0651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8779 2.3206 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8842 0.8206 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5883 0.0652 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.1738 3.0760 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.0050 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3376 -0.1598 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3263 -2.8597 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3389 -0.1402 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1544 0.6174 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4870 1.9771 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8422 -2.0631 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5096 -3.4228 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0850 1.9880 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6831 1.9989 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9953 -1.1457 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2382 2.9054 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5708 4.2651 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.9259 0.2249 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5933 -1.1348 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6106 -2.9891 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6156 -4.1891 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 28 1 0 0 0 0 2 3 2 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 30 1 0 0 0 0 4 5 2 0 0 0 0 5 6 1 0 0 0 0 5 43 1 0 0 0 0 6 31 1 0 0 0 0 7 8 2 0 0 0 0 7 9 2 0 0 0 0 7 10 1 0 0 0 0 7 43 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 32 1 0 0 0 0 12 13 1 0 0 0 0 12 33 1 0 0 0 0 13 14 2 0 0 0 0 13 16 1 0 0 0 0 14 15 1 0 0 0 0 14 34 1 0 0 0 0 15 35 1 0 0 0 0 16 17 1 0 0 0 0 16 36 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 2 0 0 0 0 19 37 1 0 0 0 0 20 21 1 0 0 0 0 20 38 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 39 1 0 0 0 0 23 24 1 0 0 0 0 23 40 1 0 0 0 0 24 25 2 0 0 0 0 24 27 1 0 0 0 0 25 26 1 0 0 0 0 25 41 1 0 0 0 0 26 42 1 0 0 0 0 43 44 1 0 0 0 0 M END