MMs02735953 MOE2007 2D CORINA 3.40 0006 02.08.2006 67 69 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 1.5000 -0.0064 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2444 -1.3086 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.0444 -1.3086 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4889 -2.6044 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7444 -1.3150 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.1444 -0.2758 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 -0.0192 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7555 1.2831 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9999 -0.0255 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.7444 -1.3278 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2444 -1.3341 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9999 -0.0383 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.2555 1.2639 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 7.6555 2.3031 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7555 1.2703 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0110 2.5597 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4999 -0.0447 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2444 -1.3469 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.2554 1.2511 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.7554 1.2448 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4999 -0.0575 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9999 -0.0639 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7554 1.2320 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0109 2.5342 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5109 2.5406 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4889 -2.6172 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.6889 -2.6223 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7334 -3.9130 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2334 -3.9067 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4778 -5.2153 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7737 -5.9708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4715 -6.7152 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0051 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 0.0051 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0051 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2966 1.1763 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6294 0.3992 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4523 -2.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8845 -3.6411 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5256 -3.2089 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6150 -1.7334 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9478 -2.5104 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0310 -2.5150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3703 -1.7494 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6296 1.6855 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9689 2.4512 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0476 1.9553 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6154 3.5964 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9743 3.1642 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6599 2.2929 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1554 2.2840 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3705 -0.4631 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7032 -1.2401 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.7865 -1.2447 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.1257 -0.4791 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.6713 0.4567 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.6779 1.9994 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.1403 2.9398 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.8076 3.7168 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3851 2.9558 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7243 3.7215 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4386 -5.8153 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5489 -5.0548 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5411 -6.8933 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2888 -6.9186 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8771 -7.8446 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 3 5 1 0 0 0 0 3 6 1 0 0 0 0 5 39 1 0 0 0 0 5 40 1 0 0 0 0 5 41 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 27 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 16 1 0 0 0 0 11 12 1 0 0 0 0 11 42 1 0 0 0 0 11 43 1 0 0 0 0 12 13 1 0 0 0 0 12 44 1 0 0 0 0 12 45 1 0 0 0 0 13 14 1 0 0 0 0 13 18 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 17 1 0 0 0 0 16 46 1 0 0 0 0 16 47 1 0 0 0 0 17 48 1 0 0 0 0 17 49 1 0 0 0 0 17 50 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 51 1 0 0 0 0 21 22 1 0 0 0 0 21 26 1 0 0 0 0 21 52 1 0 0 0 0 22 23 1 0 0 0 0 22 53 1 0 0 0 0 22 54 1 0 0 0 0 23 24 1 0 0 0 0 23 55 1 0 0 0 0 23 56 1 0 0 0 0 24 25 1 0 0 0 0 24 57 1 0 0 0 0 24 58 1 0 0 0 0 25 26 1 0 0 0 0 25 59 1 0 0 0 0 25 60 1 0 0 0 0 26 61 1 0 0 0 0 26 62 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 29 30 2 0 0 0 0 29 31 1 0 0 0 0 31 32 1 0 0 0 0 31 33 1 0 0 0 0 31 63 1 0 0 0 0 32 33 1 0 0 0 0 32 64 1 0 0 0 0 32 65 1 0 0 0 0 33 66 1 0 0 0 0 33 67 1 0 0 0 0 M END