MMs01982698 MOE2007 2D CORINA 3.40 0006 02.08.2006 43 45 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 -0.0087 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2575 1.2859 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7575 1.2771 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5151 2.5718 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7727 3.8752 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2727 3.8839 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5151 2.5893 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4999 -0.0262 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9999 -0.0350 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 5.9911 -1.5350 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0086 1.4650 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4999 -0.0437 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2423 -1.3471 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7423 -1.3559 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4998 -0.0612 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7574 1.2421 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2574 1.2509 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9998 -0.0700 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.7422 -1.3734 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9846 -2.6680 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.2422 -1.3821 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9846 -2.6855 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.4846 -2.6943 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2421 -1.3996 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.4997 -0.0962 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9997 -0.0875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2573 1.1984 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 17.2270 -3.9977 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.0070 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 0.0070 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0070 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3787 4.9109 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6788 4.9266 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8939 -1.0620 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6362 -2.3829 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3362 -2.3986 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3635 2.2779 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6635 2.2936 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6058 0.9657 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3785 -3.7212 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.4421 -1.4066 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.4058 0.9552 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 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 9 1 0 0 0 0 5 6 1 0 0 0 0 6 7 2 0 0 0 0 6 33 1 0 0 0 0 7 8 1 0 0 0 0 7 34 1 0 0 0 0 9 10 1 0 0 0 0 9 35 1 0 0 0 0 10 11 2 0 0 0 0 10 12 2 0 0 0 0 10 13 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 36 1 0 0 0 0 15 16 1 0 0 0 0 15 37 1 0 0 0 0 16 17 2 0 0 0 0 16 19 1 0 0 0 0 17 18 1 0 0 0 0 17 38 1 0 0 0 0 18 39 1 0 0 0 0 19 20 1 0 0 0 0 19 40 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 41 1 0 0 0 0 24 25 1 0 0 0 0 24 29 1 0 0 0 0 25 26 2 0 0 0 0 25 42 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 27 43 1 0 0 0 0 M END