MMs02205646 MOE2007 2D CORINA 3.40 0006 02.08.2006 84 84 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 1.2934 -0.7596 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 -0.0193 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8914 -0.7790 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8803 -2.2789 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1960 -0.0387 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4894 -0.7983 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.7940 -0.0580 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8052 1.4420 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0874 -0.8176 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0986 0.6823 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1098 2.1822 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4142 2.9224 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.4254 4.4224 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7300 5.1627 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0235 4.4030 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.3280 5.1433 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6214 4.3837 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.9036 2.1241 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8925 0.6242 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5880 -0.1161 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.5768 -1.6160 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2722 -2.3563 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9787 -1.5967 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.6742 -2.3369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3809 -1.5773 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.9148 3.6241 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.2082 2.8644 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.1971 1.3645 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 19.5128 3.6047 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 20.8062 2.8451 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.1108 3.5854 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.4042 2.8257 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 22.1220 5.0853 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 23.4266 5.8257 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.4377 7.3256 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6077 1.0347 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0347 0.6077 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6077 -1.0347 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5153 -1.6731 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0579 -1.6846 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4315 0.8863 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9742 0.8748 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4805 -1.9983 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3093 -1.7311 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8519 -1.7426 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9184 0.8995 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6798 -0.4423 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9265 1.9826 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7078 3.3128 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2421 4.2228 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0234 5.5530 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9656 6.0877 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5082 6.0762 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5636 6.0683 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.1062 6.0568 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.0402 5.5083 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.8015 4.1666 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.0838 1.9069 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.3224 3.2487 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.0757 0.8238 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.2945 -0.5065 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.7601 -1.4164 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.9788 -2.7467 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.0367 -3.2813 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4940 -3.2698 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4387 -3.2619 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8961 -3.2504 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9621 -2.7019 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2007 -1.3602 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.6930 4.5375 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.1503 4.5490 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.5217 4.8047 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.0281 1.9316 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 21.5707 1.9201 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 23.8286 4.6950 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 24.6098 6.0252 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 24.6377 7.3167 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 23.4466 8.5256 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 22.2378 7.3345 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3920 -0.0773 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 11.4312 0.5227 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.6102 2.8837 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 14.5710 2.2837 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 40 1 0 0 0 0 2 41 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 42 1 0 0 0 0 6 43 1 0 0 0 0 7 8 1 0 0 0 0 7 44 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 45 1 0 0 0 0 10 46 1 0 0 0 0 10 81 1 0 0 0 0 11 12 1 0 0 0 0 11 47 1 0 0 0 0 11 48 1 0 0 0 0 11 81 1 0 0 0 0 12 13 1 0 0 0 0 12 49 1 0 0 0 0 12 50 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 51 1 0 0 0 0 14 52 1 0 0 0 0 15 16 1 0 0 0 0 15 53 1 0 0 0 0 15 54 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 55 1 0 0 0 0 17 56 1 0 0 0 0 18 57 1 0 0 0 0 18 58 1 0 0 0 0 18 83 1 0 0 0 0 19 20 1 0 0 0 0 19 59 1 0 0 0 0 19 60 1 0 0 0 0 19 83 1 0 0 0 0 20 21 1 0 0 0 0 20 61 1 0 0 0 0 20 62 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 22 63 1 0 0 0 0 22 64 1 0 0 0 0 23 24 1 0 0 0 0 23 65 1 0 0 0 0 23 66 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 25 67 1 0 0 0 0 25 68 1 0 0 0 0 26 69 1 0 0 0 0 26 70 1 0 0 0 0 26 81 1 0 0 0 0 27 28 1 0 0 0 0 27 71 1 0 0 0 0 27 72 1 0 0 0 0 27 83 1 0 0 0 0 28 29 2 0 0 0 0 28 30 1 0 0 0 0 30 31 1 0 0 0 0 30 73 1 0 0 0 0 31 32 1 0 0 0 0 31 74 1 0 0 0 0 31 75 1 0 0 0 0 32 33 2 0 0 0 0 32 34 1 0 0 0 0 34 35 1 0 0 0 0 35 36 1 0 0 0 0 35 76 1 0 0 0 0 35 77 1 0 0 0 0 36 78 1 0 0 0 0 36 79 1 0 0 0 0 36 80 1 0 0 0 0 81 82 1 0 0 0 0 83 84 1 0 0 0 0 M CHG 1 81 1 M CHG 1 83 1 M END