MMs02246172 MOE2007 2D CORINA 3.40 0006 02.08.2006 52 54 0 0 0 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 -0.0767 -1.4980 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4125 -2.1806 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1822 -2.3135 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5179 -1.6310 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1055 -3.8116 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1516 -4.6300 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2383 -6.0784 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7364 -6.1552 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2723 -4.7542 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5548 -7.4122 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8754 -8.7495 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6938 -10.0066 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1917 -9.9263 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8711 -8.5890 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0527 -7.3320 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7321 -5.9946 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9137 -4.7376 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2299 -5.9144 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9094 -4.5771 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4072 -4.4968 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2256 -5.7539 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5462 -7.0912 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0484 -7.1714 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0101 -11.1834 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.7043 -7.2452 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1861 -7.0123 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.1287 -8.1792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5895 -9.5789 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6105 -7.9462 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1984 -0.0614 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0614 1.1984 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1984 0.0614 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9585 -1.1120 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4810 -2.7266 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8664 -3.2492 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6771 -8.8137 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1503 -11.0764 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0694 -8.5248 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2546 -3.5714 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9507 -3.4270 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4239 -5.6897 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2010 -8.0968 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5048 -8.2413 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3460 -7.8258 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0936 -8.3803 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6174 -5.8925 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2211 -6.8112 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6607 -7.3657 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7386 -8.9267 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5531 -9.1131 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.1218 -10.2329 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 10 2 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 8 26 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 37 1 0 0 0 0 13 14 1 0 0 0 0 13 38 1 0 0 0 0 14 15 2 0 0 0 0 14 25 1 0 0 0 0 15 16 1 0 0 0 0 15 39 1 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 40 1 0 0 0 0 21 22 1 0 0 0 0 21 41 1 0 0 0 0 22 23 2 0 0 0 0 22 42 1 0 0 0 0 23 24 1 0 0 0 0 23 43 1 0 0 0 0 24 44 1 0 0 0 0 26 27 1 0 0 0 0 26 45 1 0 0 0 0 26 46 1 0 0 0 0 27 28 1 0 0 0 0 27 47 1 0 0 0 0 28 29 2 0 0 0 0 28 30 1 0 0 0 0 30 48 1 0 0 0 0 30 49 1 0 0 0 0 30 51 1 0 0 0 0 50 51 1 0 0 0 0 51 52 1 0 0 0 0 M END