MMs01760686 MOE2007 2D CORINA 3.40 0006 02.08.2006 45 47 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 0.7467 -1.3010 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2466 -1.3048 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9933 -2.6058 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2400 -3.9029 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7400 -3.8990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0067 -2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0134 -5.1961 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5134 -5.1923 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.5095 -3.6923 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5172 -6.6923 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0134 -5.1884 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7667 -6.4855 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2667 -6.4816 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0134 -5.1807 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2600 -3.8836 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7600 -3.8874 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5134 -5.1768 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.2667 -6.4739 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -6.9696 -7.2273 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.5638 -5.7206 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.0200 -7.7710 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4135 -9.1429 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5308 -10.1437 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.8279 -9.3904 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.5122 -7.9240 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -12.1998 -9.9970 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 2.9866 -5.2039 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0408 0.5973 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5973 1.0408 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0408 -0.5973 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8493 -0.2671 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1933 -2.6089 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2067 -2.5950 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5839 -6.2369 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1694 -7.5263 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8694 -7.5193 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8573 -2.8428 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1574 -2.8498 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1107 -4.1360 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2403 -9.3954 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4084 -11.3375 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9458 -5.8012 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5839 -6.2446 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0274 -4.6065 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 32 1 0 0 0 0 4 5 1 0 0 0 0 4 33 1 0 0 0 0 5 6 2 0 0 0 0 5 28 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 34 1 0 0 0 0 8 9 1 0 0 0 0 8 35 1 0 0 0 0 9 10 2 0 0 0 0 9 11 2 0 0 0 0 9 12 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 36 1 0 0 0 0 14 15 1 0 0 0 0 14 37 1 0 0 0 0 15 16 2 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 16 38 1 0 0 0 0 17 39 1 0 0 0 0 18 19 1 0 0 0 0 18 40 1 0 0 0 0 19 20 2 0 0 0 0 19 21 2 0 0 0 0 19 22 1 0 0 0 0 22 23 2 0 0 0 0 22 26 1 0 0 0 0 23 24 1 0 0 0 0 23 41 1 0 0 0 0 24 25 2 0 0 0 0 24 42 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 28 43 1 0 0 0 0 28 44 1 0 0 0 0 28 45 1 0 0 0 0 M END