MMs03690654 MOE2007 2D CORINA 3.40 0006 02.08.2006 38 40 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 0.7545 -1.2964 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2545 -1.2912 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 0.0104 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 0.0156 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2545 -1.2809 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5090 -2.5825 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0090 -2.5877 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7545 -1.2757 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 7.6319 -0.0591 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0601 -0.5177 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0653 -2.0177 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.0386 -2.7197 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6403 -2.4861 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1817 -3.9143 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 8.1893 -5.0256 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2706 0.3682 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1086 1.8594 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3191 2.7453 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6915 2.1399 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8535 0.6487 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6430 -0.2372 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0371 0.6036 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6036 1.0371 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0371 -0.6036 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3964 1.0475 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0964 1.0569 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1126 -3.6196 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4126 -3.6290 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2572 1.0809 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3003 -5.8316 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9953 -5.9145 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0783 -4.2195 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0107 2.3437 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1895 3.9383 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6599 2.8486 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9514 0.1644 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7726 -1.4302 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 26 1 0 0 0 0 5 6 1 0 0 0 0 5 27 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 28 1 0 0 0 0 8 29 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 30 1 0 0 0 0 11 12 1 0 0 0 0 11 17 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 16 31 1 0 0 0 0 16 32 1 0 0 0 0 16 33 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 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 20 21 2 0 0 0 0 20 36 1 0 0 0 0 21 22 1 0 0 0 0 21 37 1 0 0 0 0 22 38 1 0 0 0 0 M CHG 1 9 1 M END