MMs02204953 MOE2007 2D CORINA 3.40 0006 02.08.2006 57 57 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 1.5000 0.0089 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 0.9000 1.0482 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2577 -1.2856 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 2.8577 -2.3248 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5155 -2.5891 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0155 -2.5980 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2732 -3.8836 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5309 -5.1871 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7577 -1.2767 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4999 0.0268 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7422 1.3214 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9999 0.0358 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 7.1999 0.0358 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7576 -1.2588 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2576 -1.2498 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0153 -2.5444 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5153 -2.5355 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2730 -3.8300 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.7730 -3.8211 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5152 -2.5176 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.5307 -5.1156 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.0307 -5.1067 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7884 -6.4012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0462 -7.7047 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.8039 -8.9992 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.3039 -8.9903 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.0461 -7.6868 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2884 -6.3923 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2422 1.3124 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0072 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.0072 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0072 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4882 -4.5933 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9371 -6.2299 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5737 -5.7809 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3639 -2.3123 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6325 -1.6759 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9730 -2.4393 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0422 -0.0693 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3828 -0.8327 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8902 -2.9615 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2307 -3.7249 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2999 -1.3549 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6405 -2.1183 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6792 -4.8728 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.8153 -3.9262 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.1559 -4.6895 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8462 -7.7118 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.2101 -10.0420 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.9101 -10.0259 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.2461 -7.6797 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.8822 -5.3495 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9421 1.3464 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6360 2.3481 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7421 1.3392 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.1360 2.3749 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 30 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 10 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 9 34 1 0 0 0 0 9 35 1 0 0 0 0 9 36 1 0 0 0 0 10 11 1 0 0 0 0 10 37 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 15 1 0 0 0 0 13 56 1 0 0 0 0 15 16 1 0 0 0 0 15 38 1 0 0 0 0 15 39 1 0 0 0 0 16 17 1 0 0 0 0 16 40 1 0 0 0 0 16 41 1 0 0 0 0 17 18 1 0 0 0 0 17 42 1 0 0 0 0 17 43 1 0 0 0 0 18 19 1 0 0 0 0 18 44 1 0 0 0 0 18 45 1 0 0 0 0 19 20 1 0 0 0 0 19 46 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 23 47 1 0 0 0 0 23 48 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 25 49 1 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 30 55 1 0 0 0 0 54 56 1 0 0 0 0 56 57 1 0 0 0 0 M END