MMs03365095 MOE2007 2D CORINA 3.40 0006 02.08.2006 76 79 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 -0.7547 -1.2963 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.3547 -0.2571 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2546 -1.2910 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0000 0.0108 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5000 0.0162 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7453 1.3233 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4906 2.6250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9906 2.6304 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0093 -2.5981 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.1684 -2.9086 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6243 -3.9662 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4868 -4.9739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7885 -4.2285 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.7885 -5.4285 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4819 -2.7602 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 2.6002 -1.7605 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.4487 -0.9120 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0251 -2.2292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3317 -3.6975 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.1802 -2.8490 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2134 -4.6972 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 4.2526 -5.2972 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5200 -6.1655 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9449 -6.6342 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0632 -5.6345 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.3738 -6.7936 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7566 -4.1661 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.8749 -3.1665 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2998 -3.6351 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6064 -5.1034 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 9.4550 -4.2549 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4881 -6.1031 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0313 -5.5721 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1815 -4.6348 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2936 -0.2922 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0485 -1.3242 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0371 -0.6037 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6037 1.0371 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0371 0.6037 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0505 -2.4735 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3837 -1.6973 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8709 0.4171 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2041 1.1933 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2958 -1.1664 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6291 -0.3902 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8744 0.9169 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5412 0.1408 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6614 -3.3625 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3332 -4.9345 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4079 -5.7736 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1886 -5.9472 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1964 -1.0415 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2245 -2.1916 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3206 -6.2031 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3487 -7.3532 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3777 -7.6917 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8879 -7.3763 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9320 -2.4243 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4421 -2.1089 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4711 -2.4474 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4993 -3.5975 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9210 -7.1606 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4311 -6.8453 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2766 -6.7467 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8066 -5.7747 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7515 -4.8222 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5564 -3.4949 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1882 0.5076 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1973 -0.9775 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7018 -0.1754 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1003 -1.6709 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2453 1.3179 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.6416 2.3549 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7360 3.9213 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.3322 4.9627 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 38 1 0 0 0 0 1 39 1 0 0 0 0 1 40 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 10 1 0 0 0 0 4 5 1 0 0 0 0 4 41 1 0 0 0 0 4 42 1 0 0 0 0 5 6 1 0 0 0 0 5 43 1 0 0 0 0 5 44 1 0 0 0 0 6 45 1 0 0 0 0 6 46 1 0 0 0 0 6 73 1 0 0 0 0 7 8 1 0 0 0 0 7 47 1 0 0 0 0 7 48 1 0 0 0 0 7 73 1 0 0 0 0 8 9 2 0 0 0 0 8 75 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 16 1 0 0 0 0 12 13 1 0 0 0 0 12 49 1 0 0 0 0 12 50 1 0 0 0 0 13 14 1 0 0 0 0 13 51 1 0 0 0 0 13 52 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 22 1 0 0 0 0 16 17 1 0 0 0 0 16 37 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 36 1 0 0 0 0 19 20 1 0 0 0 0 19 53 1 0 0 0 0 19 54 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 28 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 24 55 1 0 0 0 0 24 56 1 0 0 0 0 25 26 1 0 0 0 0 25 57 1 0 0 0 0 25 58 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 26 33 1 0 0 0 0 28 29 1 0 0 0 0 28 35 1 0 0 0 0 29 30 1 0 0 0 0 29 59 1 0 0 0 0 29 60 1 0 0 0 0 30 31 1 0 0 0 0 30 61 1 0 0 0 0 30 62 1 0 0 0 0 31 32 1 0 0 0 0 31 33 1 0 0 0 0 31 34 1 0 0 0 0 33 63 1 0 0 0 0 33 64 1 0 0 0 0 34 65 1 0 0 0 0 35 66 1 0 0 0 0 35 67 1 0 0 0 0 35 68 1 0 0 0 0 36 69 1 0 0 0 0 37 70 1 0 0 0 0 37 71 1 0 0 0 0 37 72 1 0 0 0 0 73 74 1 0 0 0 0 75 76 1 0 0 0 0 M END