MMs00852728 MOE2007 2D CORINA 3.40 0006 02.08.2006 42 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 -1.5000 0.0078 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2432 1.3107 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4865 2.6058 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0135 2.5980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7567 1.2951 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7703 3.8932 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2702 3.8854 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.1456 2.6673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5746 3.1234 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5824 4.6233 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.1582 5.0943 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7021 6.5233 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8005 5.4987 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1676 4.8815 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3166 3.3889 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.3857 5.7568 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.7528 5.1396 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9709 6.0150 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3951 5.5440 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2830 6.7529 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4077 7.9710 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9787 7.5149 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.2297 3.9088 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 0.5946 -1.0423 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1054 -1.0283 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4432 1.3170 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9567 1.2889 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3552 4.3094 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9848 5.0738 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1033 2.0727 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6280 1.5685 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8180 1.9483 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7686 3.2426 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9416 6.3368 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4767 6.4900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2665 6.9509 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0766 4.1483 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6117 4.3015 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7599 4.4008 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.4830 6.7467 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7844 9.1104 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 25 1 0 0 0 0 2 3 2 0 0 0 0 2 26 1 0 0 0 0 3 4 1 0 0 0 0 3 27 1 0 0 0 0 4 5 2 0 0 0 0 4 24 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 28 1 0 0 0 0 7 8 1 0 0 0 0 7 29 1 0 0 0 0 7 30 1 0 0 0 0 8 9 1 0 0 0 0 8 12 1 0 0 0 0 9 10 1 0 0 0 0 9 31 1 0 0 0 0 9 32 1 0 0 0 0 10 11 1 0 0 0 0 10 33 1 0 0 0 0 10 34 1 0 0 0 0 11 12 1 0 0 0 0 11 14 1 0 0 0 0 12 13 2 0 0 0 0 14 15 1 0 0 0 0 14 35 1 0 0 0 0 14 36 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 37 1 0 0 0 0 18 19 1 0 0 0 0 18 38 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 2 0 0 0 0 21 41 1 0 0 0 0 22 23 1 0 0 0 0 22 42 1 0 0 0 0 M END