MMs02528458 MOE2007 2D CORINA 3.40 0006 02.08.2006 62 64 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 0.6646 -1.3448 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1614 -1.4416 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8260 -2.7863 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9937 -4.0343 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3229 -2.8832 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2811 -1.7291 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6747 -2.2838 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5779 -3.7807 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1244 -4.1511 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6806 -5.2661 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7320 -4.7389 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9427 -1.4823 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2707 -2.1796 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6155 -1.5150 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 11.7746 -1.2045 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6631 -2.5886 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.9658 -3.9167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6303 -5.2614 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.4872 -3.6639 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4136 -4.7115 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.1474 -2.3721 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0770 -3.5493 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.4909 -4.5100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.1160 -1.9392 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8683 -0.0365 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8207 1.0371 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5180 2.3651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9965 2.1124 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2130 0.6281 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.0701 3.1599 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8825 0.0165 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9106 -0.2756 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0758 0.5317 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5317 1.0758 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0758 -0.5317 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4872 -1.6815 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7962 -2.5375 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9654 -5.6621 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6552 -5.5054 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4985 -3.8156 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7706 -1.2328 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2040 -1.8033 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0204 -4.1182 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.4537 -4.6887 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5492 -5.2537 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.2346 -5.4518 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.4327 -3.7663 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.2309 -2.3829 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.5597 -0.8242 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.0010 -1.4954 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6332 0.8639 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9863 3.4409 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9082 2.3011 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9290 3.9980 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2320 4.0188 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8201 0.5743 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0734 0.0208 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6142 0.8872 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7478 -0.5720 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5613 -3.3328 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 16.7204 -3.0223 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 2 3 1 0 0 0 0 2 37 1 0 0 0 0 2 38 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 2 0 0 0 0 6 10 1 0 0 0 0 7 8 1 0 0 0 0 7 33 1 0 0 0 0 8 9 2 0 0 0 0 8 13 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 10 11 1 0 0 0 0 12 39 1 0 0 0 0 12 40 1 0 0 0 0 12 41 1 0 0 0 0 13 14 2 0 0 0 0 13 32 1 0 0 0 0 14 15 1 0 0 0 0 14 20 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 26 1 0 0 0 0 17 18 1 0 0 0 0 17 22 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 2 0 0 0 0 22 23 1 0 0 0 0 22 42 1 0 0 0 0 22 43 1 0 0 0 0 23 44 1 0 0 0 0 23 45 1 0 0 0 0 23 61 1 0 0 0 0 24 46 1 0 0 0 0 24 47 1 0 0 0 0 24 48 1 0 0 0 0 24 61 1 0 0 0 0 25 49 1 0 0 0 0 25 50 1 0 0 0 0 25 51 1 0 0 0 0 25 61 1 0 0 0 0 26 27 2 0 0 0 0 26 30 1 0 0 0 0 27 28 1 0 0 0 0 27 52 1 0 0 0 0 28 29 2 0 0 0 0 28 53 1 0 0 0 0 29 30 1 0 0 0 0 29 31 1 0 0 0 0 31 54 1 0 0 0 0 31 55 1 0 0 0 0 31 56 1 0 0 0 0 32 57 1 0 0 0 0 33 58 1 0 0 0 0 33 59 1 0 0 0 0 33 60 1 0 0 0 0 61 62 1 0 0 0 0 M CHG 1 61 1 M END