MMs00828807 MOE2007 2D CORINA 3.40 0006 02.08.2006 54 56 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 1.2986 0.7507 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 0.0015 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8967 0.7522 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8958 2.2522 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1962 0.0030 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1970 -1.4970 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4965 -2.2463 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7951 -1.4955 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7942 0.0045 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4948 0.7537 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0946 -2.2448 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.3932 -1.4940 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3923 0.0060 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.6926 -2.2433 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9912 -1.4925 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 12.9912 -2.6925 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1472 -0.0006 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0319 1.0024 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.6142 0.3121 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 15.3650 -0.9865 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8568 -1.1425 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.3619 -2.1018 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.6746 -3.5689 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.1015 -4.0316 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.4142 -5.4986 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2235 1.6827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.7152 1.8404 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.3245 3.2111 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.4422 4.4241 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9505 4.2664 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3412 2.8958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6006 1.0389 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0389 -0.6006 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6006 -1.0389 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5267 1.6696 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0694 1.6704 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1581 -2.0976 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4972 -3.4463 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8331 0.6051 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4941 1.9537 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0953 -3.4448 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9218 -3.1630 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4645 -3.1621 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4754 -3.6114 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5083 -4.7573 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.9928 -3.2281 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5229 -6.3021 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.5557 -5.8688 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.4211 0.8700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.5179 3.3372 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.9296 5.5206 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2446 5.2368 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1478 2.7696 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 2 36 1 0 0 0 0 2 37 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 11 2 0 0 0 0 7 8 2 0 0 0 0 7 38 1 0 0 0 0 8 9 1 0 0 0 0 8 39 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 40 1 0 0 0 0 11 41 1 0 0 0 0 12 13 1 0 0 0 0 12 42 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 43 1 0 0 0 0 15 44 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 23 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 27 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 24 45 1 0 0 0 0 24 46 1 0 0 0 0 25 26 2 0 0 0 0 25 47 1 0 0 0 0 26 48 1 0 0 0 0 26 49 1 0 0 0 0 27 28 1 0 0 0 0 27 32 2 0 0 0 0 28 29 2 0 0 0 0 28 50 1 0 0 0 0 29 30 1 0 0 0 0 29 51 1 0 0 0 0 30 31 2 0 0 0 0 30 52 1 0 0 0 0 31 32 1 0 0 0 0 31 53 1 0 0 0 0 32 54 1 0 0 0 0 M END