MMs03763768 MOE2007 2D CORINA 3.40 0006 02.08.2006 63 67 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 0.7426 -1.3033 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2426 -1.3118 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9852 -2.6151 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2278 -3.9098 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4852 -2.6236 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2425 -1.3288 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7425 -1.3373 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.4851 -2.6406 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7278 -3.9354 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.7251 -5.0558 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4049 -6.5212 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0989 -4.4534 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3936 -5.2108 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6969 -4.4682 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8622 -2.9773 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3311 -2.6738 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0738 -3.9771 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0638 -5.0861 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.5646 -4.1423 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.1669 -5.5161 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.6578 -5.6813 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.5464 -4.4728 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.9440 -3.0991 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.4532 -2.9338 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.8326 -1.8906 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.3235 -2.0558 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 20.0372 -4.6381 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 8.9506 -2.9608 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 5.2278 -3.9268 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 4.0278 -3.9268 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4704 -5.2216 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9705 -5.2131 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2131 -6.5079 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9557 -7.8111 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4557 -7.8196 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2131 -6.5249 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7130 -6.5334 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4556 -7.8367 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4999 -0.0255 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0426 0.5941 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5941 1.0426 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0426 -0.5941 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3873 -1.7073 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9443 -2.4862 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3868 -6.4108 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9750 -2.1693 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8254 -1.5803 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.4561 -6.4829 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.1397 -6.7803 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.9713 -1.8348 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6734 -4.6918 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0131 -6.5010 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3498 -8.8469 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0498 -8.8623 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4130 -8.4308 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0497 -8.8793 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4983 -7.2426 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5425 0.5686 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9058 1.0171 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4573 -0.6196 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.2303 -0.5168 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.9411 0.4500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 41 1 0 0 0 0 1 42 1 0 0 0 0 1 43 1 0 0 0 0 2 3 1 0 0 0 0 2 44 1 0 0 0 0 2 45 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 2 0 0 0 0 6 30 1 0 0 0 0 7 8 1 0 0 0 0 7 40 1 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 9 29 1 0 0 0 0 10 11 1 0 0 0 0 10 30 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 2 0 0 0 0 13 29 1 0 0 0 0 14 15 1 0 0 0 0 14 46 1 0 0 0 0 15 16 2 0 0 0 0 15 19 1 0 0 0 0 16 17 1 0 0 0 0 16 47 1 0 0 0 0 17 18 2 0 0 0 0 17 48 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 49 1 0 0 0 0 22 23 1 0 0 0 0 22 50 1 0 0 0 0 23 24 2 0 0 0 0 23 28 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 25 51 1 0 0 0 0 26 27 2 0 0 0 0 26 62 1 0 0 0 0 30 31 1 0 0 0 0 30 32 1 0 0 0 0 32 33 1 0 0 0 0 32 37 2 0 0 0 0 33 34 2 0 0 0 0 33 52 1 0 0 0 0 34 35 1 0 0 0 0 34 53 1 0 0 0 0 35 36 2 0 0 0 0 35 54 1 0 0 0 0 36 37 1 0 0 0 0 36 55 1 0 0 0 0 37 38 1 0 0 0 0 38 39 1 0 0 0 0 39 56 1 0 0 0 0 39 57 1 0 0 0 0 39 58 1 0 0 0 0 40 59 1 0 0 0 0 40 60 1 0 0 0 0 40 61 1 0 0 0 0 62 63 1 0 0 0 0 M END