MMs01907194 MOE2007 2D CORINA 3.40 0006 02.08.2006 58 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 1.3456 0.6628 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4444 2.1596 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7899 2.8224 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0368 1.9885 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9380 0.4918 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5924 -0.1710 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3824 2.6514 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4811 4.1481 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6292 1.8175 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.6875 0.3186 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1310 -0.0892 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6495 -1.4967 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9649 1.1577 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.0367 2.3361 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 9.1959 2.6466 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4445 3.7796 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3983 4.8545 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8061 6.2980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2601 6.6666 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3063 5.5917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8985 4.1482 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7603 5.9603 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.4637 1.2159 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2636 -0.0530 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5624 -1.2637 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0612 -1.2055 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7602 0.1217 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.9603 1.3906 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4615 1.3324 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5091 -0.6095 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5303 1.0765 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0765 -0.5303 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5303 -1.0765 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4469 2.8267 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8690 4.0198 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9355 -0.1753 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5134 -1.3684 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2351 4.5596 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9691 7.1579 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5863 7.8214 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7355 3.2882 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0866 7.1151 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2096 2.3887 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5746 1.6698 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1528 -0.5069 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5177 -1.2258 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8165 -2.4365 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4515 -1.7176 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.8989 -2.3944 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.2039 -1.5718 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.0712 1.8445 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.7062 2.5634 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6238 2.5214 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3188 1.6987 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5900 1.2175 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7625 0.0052 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 12.1625 -1.0340 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 35 1 0 0 0 0 4 5 1 0 0 0 0 4 36 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 37 1 0 0 0 0 7 38 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 15 1 0 0 0 0 10 56 1 0 0 0 0 11 12 1 0 0 0 0 11 31 2 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 24 1 0 0 0 0 15 16 1 0 0 0 0 15 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 39 1 0 0 0 0 19 20 1 0 0 0 0 19 40 1 0 0 0 0 20 21 2 0 0 0 0 20 41 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 22 42 1 0 0 0 0 23 43 1 0 0 0 0 24 25 1 0 0 0 0 24 44 1 0 0 0 0 24 45 1 0 0 0 0 25 46 1 0 0 0 0 25 47 1 0 0 0 0 25 57 1 0 0 0 0 26 27 1 0 0 0 0 26 48 1 0 0 0 0 26 49 1 0 0 0 0 26 57 1 0 0 0 0 27 28 1 0 0 0 0 27 50 1 0 0 0 0 27 51 1 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 29 52 1 0 0 0 0 29 53 1 0 0 0 0 30 54 1 0 0 0 0 30 55 1 0 0 0 0 30 57 1 0 0 0 0 57 58 1 0 0 0 0 M CHG 1 57 1 M END