MMs03652538 MOE2007 2D CORINA 3.40 0006 02.08.2006 43 44 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 1.2971 0.7533 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 0.0066 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8952 0.7599 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 0.0131 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4933 0.7664 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4895 2.2664 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7866 3.0197 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0875 2.2730 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0913 0.7730 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7942 0.0197 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3847 3.0263 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 11.1380 1.7291 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.6314 4.3234 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.6818 3.7796 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.9828 3.0328 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9865 1.5328 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2875 0.7861 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5846 1.5394 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5808 3.0394 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2799 3.7861 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2761 5.2861 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8855 0.7927 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.6026 1.0377 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0377 -0.6026 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6026 -1.0377 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5235 1.6706 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0662 1.6745 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8290 -0.9146 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3717 -0.9107 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1215 1.6772 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6642 1.6811 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4487 2.8638 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7836 4.2197 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1321 0.1756 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7972 -1.1803 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6788 4.9795 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9488 0.9302 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2905 -0.4139 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.6185 3.6420 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.4761 5.2892 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2731 6.4861 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0761 5.2831 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 27 1 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 3 30 1 0 0 0 0 4 5 1 0 0 0 0 4 31 1 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 33 1 0 0 0 0 8 9 1 0 0 0 0 8 34 1 0 0 0 0 9 10 2 0 0 0 0 9 12 1 0 0 0 0 10 11 1 0 0 0 0 10 35 1 0 0 0 0 11 36 1 0 0 0 0 12 13 2 0 0 0 0 12 14 2 0 0 0 0 12 15 1 0 0 0 0 15 16 1 0 0 0 0 15 37 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 38 1 0 0 0 0 18 19 1 0 0 0 0 18 39 1 0 0 0 0 19 20 2 0 0 0 0 19 23 1 0 0 0 0 20 21 1 0 0 0 0 20 40 1 0 0 0 0 21 22 1 0 0 0 0 22 41 1 0 0 0 0 22 42 1 0 0 0 0 22 43 1 0 0 0 0 M END