MMs02457581 MOE2007 2D CORINA 3.40 0006 02.08.2006 68 71 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 -1.3050 -0.7397 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5980 0.0206 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5861 1.5206 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2811 2.2602 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0119 1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3169 2.2396 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3288 3.7396 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6099 1.4793 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9149 2.2190 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.9149 1.0190 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9268 3.7189 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2317 4.4586 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2436 5.9585 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9506 6.7188 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2079 1.4587 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1960 -0.0413 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9029 -0.7190 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.1960 0.0413 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5009 -0.6984 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.4617 -1.2984 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5129 -2.1983 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8178 -2.9380 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.1108 -2.1777 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0989 -0.6778 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.3920 0.0825 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.3801 1.5825 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.6969 -0.6571 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -12.7314 -0.0489 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.7088 -2.1571 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.4158 -2.9174 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -13.0138 -2.8967 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.7940 0.0619 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.7821 1.5619 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4771 2.3015 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1841 1.5412 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8791 2.2809 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.3619 1.9768 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8672 3.7808 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5623 4.5205 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1602 4.5411 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.1507 5.7411 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4652 3.8015 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7582 4.5618 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0344 -0.6082 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3145 -1.9396 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1033 1.8247 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2716 3.4602 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6004 0.2794 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7434 3.5199 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5253 4.8498 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6332 3.3277 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4151 4.6576 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9125 -1.9190 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4174 0.9544 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9600 0.9666 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3295 -1.9994 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1114 -3.3292 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8273 -4.1380 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.0482 -2.2885 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.0233 -4.0967 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9655 1.3629 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1835 2.6927 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1888 0.9412 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5486 6.6982 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5129 2.1983 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5473 1.5901 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5581 7.8982 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 45 1 0 0 0 0 2 3 2 0 0 0 0 2 46 1 0 0 0 0 3 4 1 0 0 0 0 3 18 1 0 0 0 0 4 5 2 0 0 0 0 4 47 1 0 0 0 0 5 6 1 0 0 0 0 5 48 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 49 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 16 1 0 0 0 0 12 13 1 0 0 0 0 12 50 1 0 0 0 0 12 51 1 0 0 0 0 13 14 1 0 0 0 0 13 52 1 0 0 0 0 13 53 1 0 0 0 0 14 15 2 0 0 0 0 14 65 1 0 0 0 0 16 17 2 0 0 0 0 16 66 1 0 0 0 0 18 19 1 0 0 0 0 18 54 1 0 0 0 0 19 20 1 0 0 0 0 19 55 1 0 0 0 0 19 56 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 33 1 0 0 0 0 22 23 1 0 0 0 0 22 57 1 0 0 0 0 22 58 1 0 0 0 0 23 24 1 0 0 0 0 23 59 1 0 0 0 0 24 25 2 0 0 0 0 24 31 1 0 0 0 0 25 26 1 0 0 0 0 25 33 1 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 28 29 1 0 0 0 0 28 30 1 0 0 0 0 30 31 2 0 0 0 0 30 32 1 0 0 0 0 32 60 1 0 0 0 0 32 61 1 0 0 0 0 33 34 1 0 0 0 0 34 35 1 0 0 0 0 34 62 1 0 0 0 0 34 63 1 0 0 0 0 35 36 2 0 0 0 0 35 43 1 0 0 0 0 36 37 1 0 0 0 0 36 64 1 0 0 0 0 37 38 1 0 0 0 0 37 39 1 0 0 0 0 39 40 2 0 0 0 0 39 41 1 0 0 0 0 41 42 1 0 0 0 0 41 43 1 0 0 0 0 43 44 2 0 0 0 0 65 68 1 0 0 0 0 66 67 1 0 0 0 0 M END