MMs03167697 MOE2007 2D CORINA 3.40 0006 02.08.2006 66 69 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 1.3776 0.5935 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5804 -0.3028 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9580 0.2907 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1328 1.7805 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5103 2.3740 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7131 1.4778 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5383 -0.0120 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1607 -0.6055 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0907 2.0713 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.2935 1.1750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1187 -0.3148 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.6711 1.7685 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8739 0.8722 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 11.8739 2.0722 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8558 -0.6277 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6317 -1.4946 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.2767 -1.1084 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.1729 0.0944 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6728 0.0763 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 13.3060 1.3185 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.7867 2.7394 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2576 3.0335 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.2477 1.9067 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.7186 2.2009 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.1993 3.6217 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2092 4.7485 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7383 4.4544 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.7229 -2.5405 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7058 -3.6430 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1521 -5.0750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6154 -5.4046 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6325 -4.3021 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1863 -2.8700 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0617 -6.8367 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.5250 -7.1663 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.0446 -7.9392 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.4909 -9.3713 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4738 -10.4738 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4748 1.1021 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1021 -0.4748 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4748 -1.1021 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7186 1.5964 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2508 1.4166 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1705 2.4975 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6502 3.5659 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5006 -0.7290 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0209 -1.7973 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2306 3.2631 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0121 2.7714 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5443 2.5916 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6005 2.9207 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7593 3.9391 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.8632 0.7700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.5107 1.2995 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.3760 3.8570 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.5938 5.8852 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5351 -3.3793 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3384 -5.9571 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.8032 -4.5658 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.9999 -1.9880 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5571 -8.8208 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.2182 -10.3258 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5918 -9.6601 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6601 -11.3558 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3558 -11.2875 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 40 1 0 0 0 0 1 41 1 0 0 0 0 1 42 1 0 0 0 0 2 3 1 0 0 0 0 2 43 1 0 0 0 0 2 44 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 45 1 0 0 0 0 6 7 1 0 0 0 0 6 46 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 47 1 0 0 0 0 9 48 1 0 0 0 0 10 11 1 0 0 0 0 10 49 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 50 1 0 0 0 0 13 51 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 21 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 29 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 22 52 1 0 0 0 0 22 53 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 54 1 0 0 0 0 25 26 1 0 0 0 0 25 55 1 0 0 0 0 26 27 2 0 0 0 0 26 56 1 0 0 0 0 27 28 1 0 0 0 0 27 57 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 58 1 0 0 0 0 31 32 1 0 0 0 0 31 59 1 0 0 0 0 32 33 2 0 0 0 0 32 35 1 0 0 0 0 33 34 1 0 0 0 0 33 60 1 0 0 0 0 34 61 1 0 0 0 0 35 36 2 0 0 0 0 35 37 1 0 0 0 0 37 38 1 0 0 0 0 38 39 1 0 0 0 0 38 62 1 0 0 0 0 38 63 1 0 0 0 0 39 64 1 0 0 0 0 39 65 1 0 0 0 0 39 66 1 0 0 0 0 M END