MMs00036339 MOE2007 2D CORINA 3.40 0006 02.08.2006 62 65 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 0.7527 1.2975 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0055 2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2527 1.2943 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -0.0063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 -0.0094 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2527 1.2880 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5054 2.5886 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0054 2.5918 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7527 1.2849 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5000 -0.0157 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0000 -0.0189 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7527 1.2786 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.0054 2.5792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5054 2.5823 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.7582 3.8766 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.2582 3.8735 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 10.6582 4.9127 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1373 2.6581 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5648 3.1186 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.5680 4.6186 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 14.6072 4.0186 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1424 5.0852 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 11.2939 5.9337 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1455 6.5852 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.5731 7.0457 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.4522 5.8303 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 14.7628 6.9894 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.9522 5.8272 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 16.7049 7.1246 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.9577 8.4252 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.2049 7.1215 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.9522 5.8209 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.4522 5.8177 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.1995 4.5171 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.6995 4.5140 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0380 0.6022 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6022 -1.0380 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0380 -0.6022 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0459 3.1959 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5924 3.6386 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0350 2.0003 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3978 -1.0443 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0978 -1.0499 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1076 3.6266 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4076 3.6323 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8978 -1.0537 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5978 -1.0594 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1603 4.9171 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0968 2.0603 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6231 1.5608 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0873 8.1430 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6136 7.6435 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.5500 4.7867 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.9990 8.3037 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.3334 7.5295 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.8237 5.4128 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.1581 4.6387 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.2463 6.9999 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 21.5807 6.2258 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.4467 3.2196 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 21.0446 2.1792 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 1 39 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 3 40 1 0 0 0 0 3 41 1 0 0 0 0 3 42 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 43 1 0 0 0 0 6 7 1 0 0 0 0 6 44 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 45 1 0 0 0 0 9 46 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 47 1 0 0 0 0 12 13 1 0 0 0 0 12 48 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 49 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 23 1 0 0 0 0 19 20 1 0 0 0 0 19 50 1 0 0 0 0 19 51 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 27 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 26 52 1 0 0 0 0 26 53 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 29 30 1 0 0 0 0 29 54 1 0 0 0 0 30 31 2 0 0 0 0 30 32 1 0 0 0 0 32 33 1 0 0 0 0 32 55 1 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 33 58 1 0 0 0 0 34 35 1 0 0 0 0 34 59 1 0 0 0 0 34 60 1 0 0 0 0 35 36 2 0 0 0 0 35 61 1 0 0 0 0 61 62 1 0 0 0 0 M END