MMs01412728 MOE2007 2D CORINA 3.40 0006 02.08.2006 41 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 -0.7572 1.2948 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2572 1.2865 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0000 -0.0167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4999 -0.0250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2427 -1.3282 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4855 -2.6231 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9855 -2.6147 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2427 -1.3115 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7428 -1.3032 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7427 -1.3365 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4999 -0.0417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.4854 -2.6397 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.9854 -2.6481 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7282 -3.9513 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9710 -5.2461 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.2282 -3.9596 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -11.9709 -5.2628 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.4709 -5.2711 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.2281 -3.9763 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.7281 -3.9846 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.4709 -5.2878 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.7137 -6.5826 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.2137 -6.5743 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -17.9708 -5.2961 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.2000 0.0067 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1630 2.3374 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8630 2.3224 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1057 1.0109 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0797 -3.6656 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3797 -3.6506 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1370 -2.3391 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7836 -1.4652 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.1153 -2.2439 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.8339 -2.9237 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.8410 -5.6669 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.1727 -6.4457 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.6339 -2.9337 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.3339 -2.9487 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.3079 -7.6252 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.6079 -7.6102 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 10 2 0 0 0 0 1 26 1 0 0 0 0 2 3 2 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 28 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 29 1 0 0 0 0 6 7 1 0 0 0 0 6 11 1 0 0 0 0 7 8 2 0 0 0 0 7 30 1 0 0 0 0 8 9 1 0 0 0 0 8 31 1 0 0 0 0 9 10 1 0 0 0 0 10 32 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 33 1 0 0 0 0 14 34 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 35 1 0 0 0 0 18 19 1 0 0 0 0 18 36 1 0 0 0 0 18 37 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 38 1 0 0 0 0 21 22 1 0 0 0 0 21 39 1 0 0 0 0 22 23 2 0 0 0 0 22 25 1 0 0 0 0 23 24 1 0 0 0 0 23 40 1 0 0 0 0 24 41 1 0 0 0 0 M END