MMs00035997 MOE2007 2D CORINA 3.40 0006 02.08.2006 66 70 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 1.2978 0.7522 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2952 2.2522 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 0.0044 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6006 -1.4956 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9009 -2.2434 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1987 -1.4912 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 0.0088 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8958 0.7566 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4939 0.7609 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.7942 0.0131 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7967 -1.4869 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0920 0.7653 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.3923 0.0175 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 10.3923 1.2175 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5516 -1.4740 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0193 -1.7834 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.7672 -0.4831 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 13.3672 -1.5223 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7616 0.6299 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 11.4510 1.7890 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5094 1.9302 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.9771 1.6208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1364 0.1293 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 14.9850 0.9779 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.4367 -0.6185 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 16.7345 0.1337 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.7320 1.6337 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 18.0298 2.3859 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.3301 1.6381 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.3326 0.1381 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.0348 -0.6141 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 20.6329 -0.6097 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.6354 -2.1097 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.9357 -2.8575 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.2335 -2.1053 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.2310 -0.6053 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.9307 0.1425 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 24.5338 -2.8531 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 25.8316 -2.1010 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 24.5363 -4.3531 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6018 1.0382 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0382 -0.6018 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6018 -1.0382 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5624 -2.0974 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9029 -3.4434 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2389 -2.0895 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8938 1.9566 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4919 1.9609 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3516 -1.4760 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4282 -2.6676 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1006 2.8145 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.1771 1.6229 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.4388 -1.8185 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.0277 3.5859 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.3683 2.2398 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.5972 -2.7115 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 21.9377 -4.0575 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 24.2692 -0.0036 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 21.9286 1.3425 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 26.4333 -3.1392 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 26.8698 -1.4992 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 25.2298 -1.0627 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 23.3363 -4.3552 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 24.5383 -5.5531 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 25.7363 -4.3511 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 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 45 1 0 0 0 0 6 7 1 0 0 0 0 6 46 1 0 0 0 0 7 8 2 0 0 0 0 7 47 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 9 48 1 0 0 0 0 10 11 1 0 0 0 0 10 49 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 20 1 0 0 0 0 16 17 1 0 0 0 0 16 50 1 0 0 0 0 16 51 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 24 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 23 52 1 0 0 0 0 23 53 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 26 27 1 0 0 0 0 26 54 1 0 0 0 0 27 28 1 0 0 0 0 27 32 2 0 0 0 0 28 29 2 0 0 0 0 29 30 1 0 0 0 0 29 55 1 0 0 0 0 30 31 2 0 0 0 0 30 56 1 0 0 0 0 31 32 1 0 0 0 0 31 33 1 0 0 0 0 33 34 1 0 0 0 0 33 38 2 0 0 0 0 34 35 2 0 0 0 0 34 57 1 0 0 0 0 35 36 1 0 0 0 0 35 58 1 0 0 0 0 36 37 2 0 0 0 0 36 39 1 0 0 0 0 37 38 1 0 0 0 0 37 59 1 0 0 0 0 38 60 1 0 0 0 0 39 40 1 0 0 0 0 39 41 1 0 0 0 0 40 61 1 0 0 0 0 40 62 1 0 0 0 0 40 63 1 0 0 0 0 41 64 1 0 0 0 0 41 65 1 0 0 0 0 41 66 1 0 0 0 0 M END