MMs02790352 MOE2007 2D CORINA 3.40 0006 02.08.2006 58 61 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 1.5000 -0.0006 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2505 1.2981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7505 1.2975 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 -0.0019 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0000 -0.0025 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7495 -1.3019 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9989 -2.6006 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7484 -3.9000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4989 -2.6000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.1479 -4.9389 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7495 -1.3006 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2495 -1.3000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2495 -1.3025 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0000 -0.0038 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.2505 1.2956 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0011 2.5943 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2516 3.8936 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0022 5.1924 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5022 5.1917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2516 3.8924 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.5011 2.5936 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5000 -0.0044 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2505 1.2943 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 11.2495 -1.3038 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.7495 -1.3044 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 13.9495 -1.3044 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5000 -0.0057 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4989 -2.6038 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7484 -3.9025 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4978 -5.2019 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9978 -5.2025 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7484 -3.9038 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9989 -2.6044 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0005 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 0.0005 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0005 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6510 2.3376 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3510 2.3364 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6004 1.0364 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6490 -2.3390 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0406 -2.4842 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3769 -1.7134 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3310 0.5246 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3316 2.0673 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0516 3.8941 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4026 6.2318 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1026 6.2307 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8009 2.0739 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6490 -2.3428 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5390 -0.6061 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1004 1.0333 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4610 0.5947 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5484 -3.9020 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8974 -6.2408 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5974 -6.2420 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.9484 -3.9043 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5993 -1.5654 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 13 2 0 0 0 0 3 4 2 0 0 0 0 3 38 1 0 0 0 0 4 5 1 0 0 0 0 4 39 1 0 0 0 0 5 6 1 0 0 0 0 5 12 2 0 0 0 0 6 7 2 0 0 0 0 6 40 1 0 0 0 0 7 8 1 0 0 0 0 7 14 1 0 0 0 0 8 9 1 0 0 0 0 8 10 2 0 0 0 0 9 11 1 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 13 41 1 0 0 0 0 14 15 1 0 0 0 0 14 42 1 0 0 0 0 14 43 1 0 0 0 0 15 16 1 0 0 0 0 15 23 1 0 0 0 0 16 17 1 0 0 0 0 16 44 1 0 0 0 0 16 45 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 46 1 0 0 0 0 19 20 1 0 0 0 0 19 47 1 0 0 0 0 20 21 2 0 0 0 0 20 48 1 0 0 0 0 21 22 1 0 0 0 0 22 49 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 25 50 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 26 29 1 0 0 0 0 28 51 1 0 0 0 0 28 52 1 0 0 0 0 28 53 1 0 0 0 0 29 30 1 0 0 0 0 29 34 2 0 0 0 0 30 31 2 0 0 0 0 30 54 1 0 0 0 0 31 32 1 0 0 0 0 31 55 1 0 0 0 0 32 33 2 0 0 0 0 32 56 1 0 0 0 0 33 34 1 0 0 0 0 33 57 1 0 0 0 0 34 58 1 0 0 0 0 M END