MMs03836393 MOE2007 2D CORINA 3.40 0006 02.08.2006 53 55 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 1.4197 -0.4842 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5489 0.5032 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9686 0.0190 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0978 1.0064 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5175 0.5222 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6466 1.5096 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0663 1.0254 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3569 -0.4462 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2277 -1.4336 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8080 -0.9494 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7766 -0.9304 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 11.2608 0.4893 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.2924 -2.3501 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.1963 -1.4146 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.3254 -0.4272 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 13.6360 -1.5863 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0349 1.0444 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7451 -0.9114 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.8743 0.0760 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7392 1.5699 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.1182 2.1601 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 17.3848 3.3301 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.1056 1.0309 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.3369 -0.2571 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.0679 -1.5669 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.5678 -1.5887 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.3365 -0.3007 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.6055 1.0091 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3874 1.1358 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1358 0.3874 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3874 -1.1358 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8410 -1.5354 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3545 -1.2366 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6141 1.2557 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1276 1.5544 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3899 -1.0322 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9034 -0.7334 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4142 2.6869 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9697 1.8153 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4601 -2.6109 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9046 -1.7393 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4287 -2.5918 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2122 1.2769 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8025 2.2217 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8576 0.8120 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1665 -1.9626 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.6799 -1.6638 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.7088 2.1850 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.4529 -2.5973 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.1526 -2.6365 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 21.5364 -0.3181 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.2205 2.0395 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 33 1 0 0 0 0 2 34 1 0 0 0 0 3 4 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 4 5 1 0 0 0 0 4 37 1 0 0 0 0 4 38 1 0 0 0 0 5 6 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 39 1 0 0 0 0 8 9 1 0 0 0 0 8 40 1 0 0 0 0 9 10 2 0 0 0 0 9 12 1 0 0 0 0 10 11 1 0 0 0 0 10 41 1 0 0 0 0 11 42 1 0 0 0 0 12 13 2 0 0 0 0 12 14 2 0 0 0 0 12 15 1 0 0 0 0 15 16 1 0 0 0 0 15 43 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 19 1 0 0 0 0 18 44 1 0 0 0 0 18 45 1 0 0 0 0 18 46 1 0 0 0 0 19 20 1 0 0 0 0 19 47 1 0 0 0 0 19 48 1 0 0 0 0 20 21 2 0 0 0 0 20 25 1 0 0 0 0 21 22 1 0 0 0 0 21 49 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 26 27 1 0 0 0 0 26 50 1 0 0 0 0 27 28 2 0 0 0 0 27 51 1 0 0 0 0 28 29 1 0 0 0 0 28 52 1 0 0 0 0 29 53 1 0 0 0 0 M END