MMs01261274 MOE2007 2D CORINA 3.40 0006 02.08.2006 36 38 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 1.4986 0.0640 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3034 -1.2018 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8005 -1.2948 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1747 -2.7473 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9089 -3.5521 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7524 -2.5969 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2.9729 -5.0507 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.3028 -5.7446 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5687 -4.9398 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.5046 -3.4412 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7705 -2.6364 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 8.1003 -3.3303 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3662 -2.5255 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3021 -1.0269 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.6960 -3.2194 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.9619 -2.4146 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8978 -0.9159 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1637 -0.1112 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.4935 -0.8050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5576 -2.3037 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.2917 -3.1084 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3558 -4.6071 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.0512 1.1989 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1989 -0.0512 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0512 -1.1989 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2400 1.2358 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6077 0.5222 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5647 -0.3695 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3541 -6.9435 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3689 -4.2816 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9102 -4.2158 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7473 -4.4183 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8339 -0.3609 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1124 1.0877 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5062 -0.1612 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 27 1 0 0 0 0 2 28 1 0 0 0 0 3 4 2 0 0 0 0 3 7 1 0 0 0 0 4 5 1 0 0 0 0 4 29 1 0 0 0 0 5 6 1 0 0 0 0 5 11 2 0 0 0 0 6 7 1 0 0 0 0 6 8 2 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 30 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 31 1 0 0 0 0 13 32 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 33 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 34 1 0 0 0 0 19 20 1 0 0 0 0 19 35 1 0 0 0 0 20 21 2 0 0 0 0 20 36 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 M END