MMs01699710 MOE2007 2D CORINA 3.40 0006 02.08.2006 37 40 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 -1.5000 0.0029 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2475 1.3034 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4950 2.6010 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0050 2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7525 1.2976 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2525 1.2947 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1365 2.5065 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5622 2.0402 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 4.5593 0.5402 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1318 0.0794 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.7711 -0.3438 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.1426 0.2636 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3023 1.7551 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.3544 -0.6204 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7259 -0.0130 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9378 -0.8970 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7781 -2.3885 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4066 -2.9959 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.1948 -2.1119 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9899 -3.2725 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 12.3093 -0.2896 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -2.2424 3.9015 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7424 3.9044 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4950 2.6068 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7475 1.3063 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5980 -1.0404 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1020 -1.0352 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6071 3.6361 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7679 3.6485 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6434 -1.5370 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8537 1.1802 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0976 -2.5978 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5318 5.0857 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8693 4.3170 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4127 3.3799 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4157 1.8372 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 27 1 0 0 0 0 2 3 2 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 26 1 0 0 0 0 4 5 2 0 0 0 0 4 23 1 0 0 0 0 5 6 1 0 0 0 0 5 29 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 8 30 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 31 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 32 1 0 0 0 0 17 18 1 0 0 0 0 17 22 1 0 0 0 0 18 19 2 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 20 33 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 24 34 1 0 0 0 0 24 35 1 0 0 0 0 25 26 1 0 0 0 0 25 36 1 0 0 0 0 25 37 1 0 0 0 0 M END