MMs00115617 MOE2007 2D CORINA 3.40 0006 02.08.2006 39 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 -0.0014 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2512 1.2970 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2488 -1.3011 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7488 -1.3025 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 -0.0041 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0000 -0.0055 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7488 -1.3052 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9976 -2.6036 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4976 -2.6022 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2488 -1.3066 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0000 -0.0083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9976 -2.6063 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.4976 -2.6077 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2488 -1.3094 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 11.2464 -3.9074 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.7464 -3.9088 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4952 -5.2085 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9952 -5.2099 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7464 -3.9116 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9976 -2.6119 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4976 -2.6105 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 17.2464 -3.9130 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.0011 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 0.0011 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0011 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9000 1.0379 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2899 0.6960 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8521 2.3356 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2125 1.8979 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9010 1.0356 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6010 1.0332 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5967 -3.6434 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8967 -3.6409 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3967 -3.6450 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6455 -4.9461 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8943 -6.2472 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5943 -6.2497 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5986 -1.5732 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 4 1 0 0 0 0 2 27 1 0 0 0 0 3 28 1 0 0 0 0 3 29 1 0 0 0 0 3 30 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 31 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 11 1 0 0 0 0 9 10 1 0 0 0 0 9 33 1 0 0 0 0 10 34 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 13 35 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 36 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 37 1 0 0 0 0 19 20 1 0 0 0 0 19 38 1 0 0 0 0 20 21 2 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 21 39 1 0 0 0 0 M END