MMs00340873 MOE2007 2D CORINA 3.40 0006 02.08.2006 59 61 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 0.9876 -1.1290 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5037 -2.5488 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4592 -0.8381 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2.7500 -2.3097 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1683 0.6334 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9307 -0.5473 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4146 0.8725 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8861 1.1634 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3899 -1.3854 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9183 -1.6763 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3453 0.3252 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3330 -0.8037 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 9.6435 0.3554 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8045 -0.5129 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7921 -1.6419 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.2637 -1.3510 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7476 0.0688 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2191 0.3596 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.2067 -0.7694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7228 -2.1892 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2513 -2.4800 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.6783 -0.4785 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.1622 0.9413 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.6337 1.2321 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.6213 0.1032 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.1374 -1.3166 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.6659 -1.6075 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8491 -2.2235 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.6392 -3.1267 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9032 0.7901 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7901 0.9032 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9032 -0.7901 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6321 -2.1617 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1166 -3.6846 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6396 -2.9359 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2288 1.0565 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3899 2.0723 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4526 2.2823 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9128 1.7846 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4146 -2.5852 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5757 -1.5694 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8917 -2.2975 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3519 -2.7952 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3720 0.9465 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9118 1.4442 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3709 0.6060 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8311 0.1084 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9574 0.9719 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.6062 1.4955 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.5129 -3.0923 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8642 -3.6158 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.3720 1.8445 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.0208 2.3680 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 21.7986 0.3358 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.9276 -2.2198 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.2788 -2.7433 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8738 0.0344 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 7.1844 1.1935 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 3 34 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 4 5 2 0 0 0 0 4 6 2 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 8 37 1 0 0 0 0 8 38 1 0 0 0 0 9 39 1 0 0 0 0 9 40 1 0 0 0 0 9 58 1 0 0 0 0 10 11 1 0 0 0 0 10 41 1 0 0 0 0 10 42 1 0 0 0 0 10 58 1 0 0 0 0 11 43 1 0 0 0 0 11 44 1 0 0 0 0 12 13 1 0 0 0 0 12 45 1 0 0 0 0 12 46 1 0 0 0 0 12 58 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 29 1 0 0 0 0 15 16 1 0 0 0 0 15 47 1 0 0 0 0 15 48 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 49 1 0 0 0 0 19 20 1 0 0 0 0 19 50 1 0 0 0 0 20 21 2 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 21 51 1 0 0 0 0 22 52 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 53 1 0 0 0 0 25 26 1 0 0 0 0 25 54 1 0 0 0 0 26 27 2 0 0 0 0 26 55 1 0 0 0 0 27 28 1 0 0 0 0 27 56 1 0 0 0 0 28 57 1 0 0 0 0 29 30 1 0 0 0 0 58 59 1 0 0 0 0 M CHG 1 58 1 M END