MMs03131705 MOE2007 2D CORINA 3.40 0006 02.08.2006 75 76 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 0.7476 -1.3004 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0047 -2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2476 -1.3031 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -0.0055 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.6000 1.0338 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2524 1.2949 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0047 2.5926 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7524 1.2977 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0047 2.5981 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.2047 2.5981 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7571 3.8957 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0095 5.1961 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4905 5.1989 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2382 6.4993 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4858 7.7969 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0142 7.7942 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7618 6.4938 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4953 2.6008 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2429 3.9012 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2476 1.3031 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.7476 1.3059 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5000 0.0082 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7524 -1.2922 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5047 -2.5899 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0047 -2.5871 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7524 -1.2867 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0000 0.0109 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7571 -3.8848 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 -0.0082 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2476 -1.3086 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4953 -2.6063 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7476 -1.3113 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.1476 -2.3506 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4953 -2.6117 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9953 -2.6145 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7429 -3.9149 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 11.2429 -3.9176 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5000 -0.0137 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.0000 -0.0164 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7523 1.2813 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0403 0.5981 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5981 1.0403 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0403 -0.5981 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3476 -2.3396 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0429 -1.9962 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6066 -3.6362 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0334 -3.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0371 -2.4845 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3745 -1.7156 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4514 0.7786 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6749 3.1227 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6778 4.6654 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7915 4.6798 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4382 6.5015 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0839 8.8373 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6161 8.8324 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9618 6.4916 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6495 0.2628 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5371 2.4873 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8745 1.7183 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5524 -1.2944 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9066 -3.6302 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9524 -1.2846 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5981 1.0512 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1019 1.0299 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3669 -3.0201 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7015 -3.7939 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7890 -1.4323 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1236 -2.2061 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2407 -5.1176 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4429 -3.9198 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2451 -2.7176 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9019 1.0267 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5981 -1.0567 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 42 1 0 0 0 0 1 43 1 0 0 0 0 1 44 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 45 1 0 0 0 0 3 46 1 0 0 0 0 3 47 1 0 0 0 0 3 48 1 0 0 0 0 4 5 1 0 0 0 0 4 49 1 0 0 0 0 4 50 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 30 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 51 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 19 1 0 0 0 0 12 13 1 0 0 0 0 12 52 1 0 0 0 0 12 53 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 54 1 0 0 0 0 15 16 1 0 0 0 0 15 55 1 0 0 0 0 16 17 2 0 0 0 0 16 56 1 0 0 0 0 17 18 1 0 0 0 0 17 57 1 0 0 0 0 18 58 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 59 1 0 0 0 0 22 23 1 0 0 0 0 22 60 1 0 0 0 0 22 61 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 62 1 0 0 0 0 25 26 1 0 0 0 0 25 63 1 0 0 0 0 26 27 2 0 0 0 0 26 29 1 0 0 0 0 27 28 1 0 0 0 0 27 64 1 0 0 0 0 28 65 1 0 0 0 0 30 31 1 0 0 0 0 30 66 1 0 0 0 0 31 32 2 0 0 0 0 31 33 1 0 0 0 0 33 34 1 0 0 0 0 33 35 1 0 0 0 0 33 39 1 0 0 0 0 35 36 1 0 0 0 0 35 67 1 0 0 0 0 35 68 1 0 0 0 0 36 37 1 0 0 0 0 36 69 1 0 0 0 0 36 70 1 0 0 0 0 37 38 1 0 0 0 0 38 71 1 0 0 0 0 38 72 1 0 0 0 0 38 73 1 0 0 0 0 39 40 1 0 0 0 0 39 74 1 0 0 0 0 40 41 2 0 0 0 0 40 75 1 0 0 0 0 M END