D0N1CL Wcorina 10100417263D 1 1.00000 0.00000 CORINA evaluation license 3.40 0067 02.08.2006 31 32 0 0 0 0 0 0 0999 V2000 3.2386 -9.3714 -1.8791 Br 0 0 0 0 0 0 0 0 0 0 0 0 -4.8528 -2.6068 -1.4471 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.9981 -4.7397 0.2024 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0629 0.9317 1.7478 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0872 -0.8256 1.0267 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0748 -2.8205 -0.1114 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1986 -4.8666 -0.1004 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1185 -2.1032 -0.1149 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1778 -0.8299 0.4730 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2538 -2.6412 -0.7047 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1648 -6.2653 -0.0786 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3818 -0.1195 0.4625 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0537 -4.1631 0.0041 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4368 -1.9274 -0.7074 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4998 -0.6709 -0.1225 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0582 -6.9948 -0.8513 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2411 -6.9267 0.7206 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0216 -0.2458 1.0976 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0224 -8.3763 -0.8272 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2102 -8.3072 0.7406 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0973 -9.0317 -0.0343 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9214 -2.3539 -0.1920 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2125 -3.6186 -1.1623 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4351 0.8605 0.9131 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0460 -4.4033 -0.1907 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4291 -0.1208 -0.1297 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7800 -6.4834 -1.4709 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4521 -6.3618 1.3261 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5077 -8.8216 1.3623 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0708 -10.1112 -0.0171 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7508 1.2751 2.1415 H 0 0 0 0 0 0 0 0 0 0 0 0 1 19 1 0 0 0 0 2 14 1 0 0 0 0 3 13 2 0 0 0 0 4 18 1 0 0 0 0 4 31 1 0 0 0 0 5 18 2 0 0 0 0 6 8 1 0 0 0 0 6 13 1 0 0 0 0 6 22 1 0 0 0 0 7 11 1 0 0 0 0 7 13 1 0 0 0 0 7 25 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 9 12 1 0 0 0 0 9 18 1 0 0 0 0 10 14 2 0 0 0 0 10 23 1 0 0 0 0 11 16 2 0 0 0 0 11 17 1 0 0 0 0 12 15 2 0 0 0 0 12 24 1 0 0 0 0 14 15 1 0 0 0 0 15 26 1 0 0 0 0 16 19 1 0 0 0 0 16 27 1 0 0 0 0 17 20 2 0 0 0 0 17 28 1 0 0 0 0 19 21 2 0 0 0 0 20 21 1 0 0 0 0 20 29 1 0 0 0 0 21 30 1 0 0 0 0 M END $$$$