MMs01469662 MOE2007 2D CORINA 3.40 0006 02.08.2006 57 59 0 0 1 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 -0.7450 -1.3019 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0101 -2.5981 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7349 -3.9000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2349 -3.9058 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9798 -5.2077 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2248 -6.5039 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7248 -6.4981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0202 -5.1961 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5201 -5.1903 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2752 -6.4864 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5302 -7.7884 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7752 -6.4806 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.1752 -5.4414 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5302 -7.7767 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7852 -9.0787 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5403 -10.3748 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0403 -10.3690 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7852 -9.0670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0302 -7.7709 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5201 -5.1787 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0201 -5.1728 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7751 -6.4690 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7651 -3.8709 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0100 -2.5748 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7550 -1.2729 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2550 -1.2670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0100 -2.5632 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2651 -3.8651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5100 -2.5573 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 10.5042 -1.0573 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.5158 -4.0573 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.0100 -2.5515 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.7549 -1.2496 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0415 -0.5960 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5960 1.0415 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0415 0.5960 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6672 -0.5342 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6612 -2.0768 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8389 -2.8689 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1798 -5.2124 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8208 -7.5454 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1208 -7.5349 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1161 -4.1487 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5852 -9.0833 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9443 -11.4163 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6443 -11.4059 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9852 -9.0624 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3282 -7.2501 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8100 -2.5794 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1510 -0.2360 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8509 -0.2255 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8691 -4.9020 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6140 -3.5884 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7965 -1.8455 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3509 -0.2080 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7134 -0.6536 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 2 3 1 0 0 0 0 2 38 1 0 0 0 0 2 39 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 40 1 0 0 0 0 6 7 1 0 0 0 0 6 41 1 0 0 0 0 7 8 2 0 0 0 0 7 42 1 0 0 0 0 8 9 1 0 0 0 0 8 43 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 44 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 21 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 45 1 0 0 0 0 17 18 1 0 0 0 0 17 46 1 0 0 0 0 18 19 2 0 0 0 0 18 47 1 0 0 0 0 19 20 1 0 0 0 0 19 48 1 0 0 0 0 20 49 1 0 0 0 0 21 22 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 50 1 0 0 0 0 26 27 1 0 0 0 0 26 51 1 0 0 0 0 27 28 2 0 0 0 0 27 52 1 0 0 0 0 28 29 1 0 0 0 0 28 30 1 0 0 0 0 29 53 1 0 0 0 0 30 31 2 0 0 0 0 30 32 2 0 0 0 0 30 33 1 0 0 0 0 33 34 1 0 0 0 0 33 54 1 0 0 0 0 34 55 1 0 0 0 0 34 56 1 0 0 0 0 34 57 1 0 0 0 0 M END