MMs00333493 MOE2007 2D CORINA 3.40 0006 02.08.2006 51 53 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 1.3015 -0.7458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 0.0084 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 2.5981 -1.1916 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5932 1.5084 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8995 -0.7374 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 0.0168 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1913 1.5168 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4976 -0.7289 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.4584 -1.3289 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5025 -2.2289 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8039 -2.9747 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1005 -2.2205 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0957 -0.7205 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.7942 0.0253 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3923 0.0337 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 9.6380 1.3303 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.1465 -1.2629 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.6889 0.7879 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6840 2.2879 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9806 3.0421 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2821 2.2963 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2869 0.7963 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9903 0.0421 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5787 3.0505 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 15.7306 4.5428 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.1968 4.8594 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 17.9510 3.5628 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 16.9509 2.4449 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5966 1.0412 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0412 0.5966 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5966 -1.0412 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5331 -1.6675 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0758 -1.6625 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7932 1.5123 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5893 2.7084 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3932 1.5045 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9034 -1.9374 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3200 -2.0244 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0957 -3.3579 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0356 -3.8965 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5782 -3.8915 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5146 -3.3468 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2816 -2.0083 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0199 0.9420 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5625 0.9470 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6428 2.8845 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9767 4.2421 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3281 0.1997 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9942 -1.1579 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.8362 5.3429 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 5 1 0 0 0 0 3 6 1 0 0 0 0 5 35 1 0 0 0 0 5 36 1 0 0 0 0 5 37 1 0 0 0 0 6 7 1 0 0 0 0 6 38 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 11 1 0 0 0 0 9 15 1 0 0 0 0 11 12 1 0 0 0 0 11 39 1 0 0 0 0 11 40 1 0 0 0 0 12 13 1 0 0 0 0 12 41 1 0 0 0 0 12 42 1 0 0 0 0 13 14 1 0 0 0 0 13 43 1 0 0 0 0 13 44 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 15 45 1 0 0 0 0 15 46 1 0 0 0 0 16 17 2 0 0 0 0 16 18 2 0 0 0 0 16 19 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 47 1 0 0 0 0 21 22 1 0 0 0 0 21 48 1 0 0 0 0 22 23 2 0 0 0 0 22 25 1 0 0 0 0 23 24 1 0 0 0 0 23 49 1 0 0 0 0 24 50 1 0 0 0 0 25 26 1 0 0 0 0 25 29 1 0 0 0 0 26 27 2 0 0 0 0 26 51 1 0 0 0 0 27 28 1 0 0 0 0 28 29 2 0 0 0 0 M END