MMs01188519 MOE2007 2D CORINA 3.40 0006 02.08.2006 47 50 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 -1.2943 0.7582 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2848 2.2582 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0190 2.9999 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3132 2.2417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3038 0.7418 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 -0.0164 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9018 0.7254 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9113 2.2253 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 5.1960 -0.0328 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.4998 0.7089 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7941 -0.0493 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9414 -1.5420 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.4067 -1.8631 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1484 -3.1669 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6484 -3.1764 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4066 -1.8821 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6648 -0.5783 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1649 -0.5689 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1682 0.5522 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.4894 2.0174 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9188 2.4719 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3841 2.1508 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9296 3.5803 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3902 -4.4801 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6320 -5.7744 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5791 3.0164 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.0076 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3373 0.1648 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0265 4.1999 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3562 2.8352 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5904 -1.2164 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1885 -1.2328 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7343 1.6331 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2769 1.6233 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5419 -4.2023 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6066 -1.8897 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2714 0.4571 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2904 2.0669 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3299 3.2068 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3188 3.5111 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3346 0.9518 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5734 2.3103 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1968 4.5305 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9926 4.1369 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8901 -4.4896 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.4836 -5.5326 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 28 1 0 0 0 0 2 3 2 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 27 1 0 0 0 0 4 5 2 0 0 0 0 4 30 1 0 0 0 0 5 6 1 0 0 0 0 5 31 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 32 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 33 1 0 0 0 0 11 12 1 0 0 0 0 11 34 1 0 0 0 0 11 35 1 0 0 0 0 12 13 2 0 0 0 0 12 20 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 36 1 0 0 0 0 16 17 1 0 0 0 0 16 25 1 0 0 0 0 17 18 2 0 0 0 0 17 37 1 0 0 0 0 18 19 1 0 0 0 0 18 38 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 21 39 1 0 0 0 0 21 40 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 41 1 0 0 0 0 23 24 1 0 0 0 0 23 42 1 0 0 0 0 23 43 1 0 0 0 0 24 44 1 0 0 0 0 24 45 1 0 0 0 0 25 26 2 0 0 0 0 25 46 1 0 0 0 0 46 47 1 0 0 0 0 M END