MMs01030518 MOE2007 2D CORINA 3.40 0006 02.08.2006 40 43 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 -0.0097 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2415 -1.3136 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7415 -1.3233 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4999 -0.0292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7583 1.2747 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2584 1.2844 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7692 2.3829 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1356 1.7639 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9691 0.2732 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.1769 -0.6163 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5511 -0.0151 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.7176 1.4756 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.5098 2.3651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6763 3.8559 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.0918 2.0768 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2996 1.1873 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1332 -0.3034 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3410 -1.1930 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7152 -0.5918 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8817 0.8990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6739 1.7885 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2559 1.5002 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 7.0104 -2.1071 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0078 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 0.0078 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0078 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6348 -2.3489 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3348 -2.3664 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6651 2.3275 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5274 3.5583 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4273 3.0760 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9604 2.9048 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0338 -0.7844 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2078 -2.3856 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6814 -1.3034 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8070 2.9811 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8179 -1.9739 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8773 -3.2997 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2030 -2.2402 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 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 28 1 0 0 0 0 4 5 1 0 0 0 0 4 29 1 0 0 0 0 5 6 2 0 0 0 0 5 10 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 30 1 0 0 0 0 8 9 2 0 0 0 0 8 31 1 0 0 0 0 9 10 1 0 0 0 0 9 14 1 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 11 24 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 16 1 0 0 0 0 14 15 2 0 0 0 0 16 17 1 0 0 0 0 16 32 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 21 23 1 0 0 0 0 22 37 1 0 0 0 0 24 38 1 0 0 0 0 24 39 1 0 0 0 0 24 40 1 0 0 0 0 M END