MMs00979714 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 1.2960 -0.7553 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2898 -2.2553 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 -0.0106 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8940 -0.7659 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 -0.0213 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.4921 -0.7766 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4859 -2.2766 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7942 -0.0319 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1620 -0.6476 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1702 0.4630 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6387 0.7689 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8016 2.2600 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.4338 2.8757 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.4255 1.7651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9571 1.4592 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 10.1279 4.3442 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7493 -0.2394 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4314 -1.7053 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5420 -2.7136 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9705 -2.2559 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2884 -0.7900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1778 0.2183 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.0811 -3.2641 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.6042 1.0368 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0368 0.6042 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6042 -1.0368 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2567 -1.3553 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0898 -2.2504 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2849 -3.4553 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4898 -2.2602 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8305 0.9118 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3732 0.9055 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1189 -1.6820 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6616 -1.6883 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2010 1.1787 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4067 -1.8224 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3027 4.5889 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8832 5.5190 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9531 4.0995 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2887 -2.0715 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2877 -3.8863 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.4312 -0.4238 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.4321 1.3910 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 28 1 0 0 0 0 3 29 1 0 0 0 0 3 30 1 0 0 0 0 3 31 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 5 34 1 0 0 0 0 5 35 1 0 0 0 0 6 7 1 0 0 0 0 6 36 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 2 0 0 0 0 9 16 1 0 0 0 0 10 11 1 0 0 0 0 10 37 1 0 0 0 0 11 12 1 0 0 0 0 11 15 2 0 0 0 0 12 13 2 0 0 0 0 12 18 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 17 1 0 0 0 0 15 16 1 0 0 0 0 17 38 1 0 0 0 0 17 39 1 0 0 0 0 17 40 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 41 1 0 0 0 0 20 21 1 0 0 0 0 20 42 1 0 0 0 0 21 22 2 0 0 0 0 21 24 1 0 0 0 0 22 23 1 0 0 0 0 22 43 1 0 0 0 0 23 44 1 0 0 0 0 M END