15 9 0 0 0 0 0 0 0 0 1 V2000 -1.2200 0.2750 0.0000 Lu 0 1 0 0 0 0 0 0 0 0 0 0 1.3780 0.2749 0.0000 Lu 0 1 0 0 0 0 0 0 0 0 0 0 -3.2799 1.3149 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9809 2.0650 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 -4.5790 2.0649 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2799 -0.1850 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 3.7200 0.0149 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 3.7199 1.5149 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4209 2.2649 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 5.0190 2.2650 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1899 -1.7249 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 0.1090 -2.4749 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4079 -1.7249 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 0.1089 -3.9749 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1799 0.8949 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3 4 1 0 0 0 0 3 5 2 0 0 0 0 3 6 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 10 2 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 14 2 0 0 0 0 M END > (C) 2008 SIGMA-ALDRICH CO. > MFCD00799559 > ALDRICH > 467308 > - > - > - > - > 16251866 $$$$ 1 0 0 0 0 0 0 0 0 0 1 V2000 0.0000 0.0000 0.0000 Lu 0 0 0 0 0 0 0 0 0 0 0 0 M END > (C) 2008 SIGMA-ALDRICH CO. > MFCD00011098 > ALDRICH > 693650 > - > - > - > - > 16251866 $$$$ 17 12 0 0 0 0 0 0 0 0 1 V2000 5.3005 -1.3097 0.0000 S 0 0 3 0 0 0 0 0 0 0 0 0 5.9366 -0.7004 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8879 -1.8891 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7211 -1.8971 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 4.7195 -0.7253 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 5.3123 -3.8013 0.0000 S 0 0 3 0 0 0 0 0 0 0 0 0 5.9541 -3.1980 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8941 -4.3862 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7274 -4.3832 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 4.7368 -3.2114 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 5.3297 -5.7722 0.0000 S 0 0 3 0 0 0 0 0 0 0 0 0 5.9658 -5.1629 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9170 -6.3516 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7503 -6.3596 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 4.7487 -5.1878 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 3.2375 -2.4667 0.0000 Lu 0 1 0 0 0 0 0 0 0 0 0 0 3.1458 -4.8375 0.0000 Lu 0 1 0 0 0 0 0 0 0 0 0 0 6 7 2 0 0 0 0 6 8 2 0 0 0 0 6 9 1 0 0 0 0 1 2 2 0 0 0 0 6 10 1 0 0 0 0 1 3 2 0 0 0 0 1 4 1 0 0 0 0 1 5 1 0 0 0 0 11 12 2 0 0 0 0 11 13 2 0 0 0 0 11 14 1 0 0 0 0 11 15 1 0 0 0 0 M CHG 8 4 -1 5 -1 9 -1 10 -1 14 -1 15 -1 16 3 17 3 M END > (C) 2008 SIGMA-ALDRICH CO. > MFCD00011499 > ALDRICH > 575070 > - > - > - > - > 16251866 $$$$ 4 3 0 0 0 0 0 0 0 0 1 V2000 0.0000 -0.2878 0.0000 Lu 0 0 0 0 0 0 0 0 0 0 0 0 1.2981 -1.0394 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 -1.2980 -1.0394 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 1.0394 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 3 1 0 0 0 0 1 4 1 0 0 0 0 M END > (C) 2008 SIGMA-ALDRICH CO. > MFCD00016191 > ALDRICH > 432113 > - > - > - > - > 16251866 $$$$ 4 3 0 0 0 0 0 0 0 0 1 V2000 -1.4189 -1.5599 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.1199 -0.8100 0.0000 Lu 0 0 0 0 0 0 0 0 0 0 0 0 1.1789 -1.5599 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.1199 0.6899 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 M END > (C) 2008 SIGMA-ALDRICH CO. > MFCD00011099 > ALDRICH > 450960 > - > - > - > - > 16251866 $$$$ 10 3 0 0 0 0 0 0 0 0 1 V2000 -3.3686 -0.6316 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -2.6541 -0.2191 0.0000 Lu 0 0 0 0 0 0 0 0 0 0 0 0 -1.9396 -0.6316 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -2.6541 0.6030 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.7475 1.0957 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9623 0.0215 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9194 -1.2246 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1537 1.2246 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2397 0.1074 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3686 -1.0527 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2 1 1 0 0 0 3 2 1 0 0 0 2 4 1 0 0 0 M END > (C) 2008 SIGMA-ALDRICH CO. > MFCD00149775 > ALDRICH > 542075 > - > - > - > - > 16251866 $$$$ 10 3 0 0 0 0 0 0 0 0 1 V2000 -3.3686 -0.6316 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -2.6541 -0.2191 0.0000 Lu 0 0 0 0 0 0 0 0 0 0 0 0 -1.9396 -0.6316 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -2.6541 0.6030 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.7475 1.0957 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9623 0.0215 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9194 -1.2246 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1537 1.2246 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2397 0.1074 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3686 -1.0527 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2 1 1 0 0 0 3 2 1 0 0 0 2 4 1 0 0 0 M END > (C) 2008 SIGMA-ALDRICH CO. > MFCD00149775 > ALDRICH > 298131 > - > - > - > - > 16251866 $$$$ 1 0 0 0 0 0 0 0 0 0 1 V2000 0.0000 0.0000 0.0000 Lu 0 0 0 0 0 0 0 0 0 0 0 0 M END > (C) 2008 SIGMA-ALDRICH CO. > MFCD00011098 > ALDRICH > 457949 > - > - > - > - > 16251866 $$$$ 1 0 0 0 0 0 0 0 0 0 1 V2000 0.0000 0.0000 0.0000 Lu 0 0 0 0 0 0 0 0 0 0 0 0 M END > (C) 2008 SIGMA-ALDRICH CO. > MFCD00011098 > ALDRICH > 263125 > - > - > - > - > 16251866 $$$$ 1 0 0 0 0 0 0 0 0 0 1 V2000 0.0000 0.0000 0.0000 Lu 0 0 0 0 0 0 0 0 0 0 0 0 M END > (C) 2008 SIGMA-ALDRICH CO. > MFCD00011098 > ALDRICH > 261149 > - > - > - > - > 16251866 $$$$ 4 3 0 0 0 0 0 0 0 0 1 V2000 -0.2055 0.0000 0.0000 Lu 0 0 0 0 0 0 0 0 0 0 0 0 -0.6166 -0.7120 0.0000 I 0 0 0 0 0 0 0 0 0 0 0 0 -0.6166 0.7120 0.0000 I 0 0 0 0 0 0 0 0 0 0 0 0 0.6166 0.0000 0.0000 I 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 1 3 1 0 0 0 1 4 1 0 0 0 M STY 1 1 SUP M SLB 1 1 1 M SAL 1 4 1 2 3 4 M SMT 1 LuI3 M END > (C) 2008 SIGMA-ALDRICH CO. > MFCD00049970 > ALDRICH > 649872 > - > - > - > - > 16251866 $$$$ 4 3 0 0 0 0 0 0 0 0 1 V2000 -0.2055 0.0000 0.0000 Lu 0 0 0 0 0 0 0 0 0 0 0 0 -0.6166 -0.7120 0.0000 I 0 0 0 0 0 0 0 0 0 0 0 0 -0.6166 0.7120 0.0000 I 0 0 0 0 0 0 0 0 0 0 0 0 0.6166 0.0000 0.0000 I 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 1 3 1 0 0 0 1 4 1 0 0 0 M STY 1 1 SUP M SLB 1 1 1 M SAL 1 4 1 2 3 4 M SMT 1 LuI3 M END > (C) 2008 SIGMA-ALDRICH CO. > MFCD00049970 > ALDRICH > 460575 > - > - > - > - > 16251866 $$$$ 16 11 0 0 0 0 0 0 0 0 1 V2000 1.8880 -0.1977 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6025 0.2148 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3144 -0.1962 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0996 0.8436 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 -2.3851 1.2561 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.6707 0.8436 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 -2.3851 2.0783 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3144 -2.0783 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 -2.6000 -1.6658 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.8855 -2.0783 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 -2.6000 -0.8436 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0684 0.6288 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 1.7828 1.0413 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 2.4973 0.6288 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 1.7828 1.8634 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6997 -1.2046 0.0000 Lu 0 1 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 2 3 1 0 0 0 5 4 1 0 0 0 6 5 1 0 0 0 5 7 2 0 0 0 9 8 1 0 0 0 10 9 1 0 0 0 9 11 2 0 0 0 13 12 1 0 0 0 14 13 1 0 0 0 13 15 2 0 0 0 M STY 1 1 SUP M SLB 1 1 1 M SAL 1 3 1 2 3 M SMT 1 • xH2O M STY 1 2 SUP M SLB 1 2 2 M SAL 2 13 4 5 6 7 8 9 10 11 12 13 14 15 16 M SMT 2 Lu(NO3)3 M END > (C) 2008 SIGMA-ALDRICH CO. > MFCD00150421 > ALDRICH > 542067 > - > - > - > - > 16251866 $$$$ 23 21 0 0 0 0 0 0 0 0 1 V2000 -0.8299 -0.7517 0.0000 Lu 0 0 0 0 0 0 0 0 0 0 0 0 -2.3599 0.1308 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3799 0.1308 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8899 -0.7517 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3799 -1.6347 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3599 -1.6347 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0528 0.7779 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0528 1.7979 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8299 2.3080 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7129 1.7979 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7129 0.7779 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6996 -1.6347 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7196 -1.6347 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2296 -0.7517 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7196 0.1308 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6996 0.1308 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4349 2.5188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7746 2.5188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8899 1.0149 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8899 -2.5181 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2296 -2.5189 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2296 1.0149 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8899 -0.6710 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 6 1 0 0 0 0 1 11 1 0 0 0 0 1 16 1 0 0 0 0 2 3 2 0 0 0 0 3 4 1 0 0 0 0 3 19 1 0 0 0 0 4 5 2 0 0 0 0 5 6 1 0 0 0 0 5 20 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 8 18 1 0 0 0 0 9 10 2 0 0 0 0 10 11 1 0 0 0 0 10 17 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 13 21 1 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 15 22 1 0 0 0 0 M END > (C) 2008 SIGMA-ALDRICH CO. > MFCD00078030 > ALDRICH > 517658 > - > - > - > - > 16251866 $$$$ 4 3 0 0 0 0 0 0 0 0 1 V2000 0.2055 -0.0000 0.0000 Lu 0 0 0 0 0 0 0 0 0 0 0 0 0.6166 0.7120 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 0.6166 -0.7120 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 -0.6166 -0.0000 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 1 3 1 0 0 0 1 4 1 0 0 0 M STY 1 1 SUP M SLB 1 1 1 M SAL 1 4 1 2 3 4 M SMT 1 LuBr3 M END > (C) 2008 SIGMA-ALDRICH CO. > MFCD00049965 > ALDRICH > 587133 > - > - > - > - > 16251866 $$$$ 25 21 0 0 0 0 0 0 0 0 1 V2000 -0.3924 0.0645 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 0.4326 0.0645 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.3924 0.8895 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3924 -0.7605 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2174 0.0645 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2174 -0.7577 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 -2.0396 0.0645 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 -1.2174 0.8866 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 2.0826 0.0645 0.0000 Lu 0 1 0 0 0 0 0 0 0 0 0 0 -0.3924 -2.5137 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 0.4326 -2.5137 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.3924 -1.6887 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3924 -3.3387 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2174 -2.5137 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2174 -3.3358 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 -2.0396 -2.5137 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 -1.2174 -1.6915 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 -0.4354 2.5137 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 0.3896 2.5137 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.4354 3.3387 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4354 1.6887 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2604 2.5137 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2604 1.6915 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 -2.0826 2.5137 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 -1.2604 3.3358 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 1 3 2 0 0 0 1 4 2 0 0 0 1 5 1 0 0 0 5 6 1 0 0 0 5 7 1 0 0 0 5 8 1 0 0 0 10 11 1 0 0 0 10 12 2 0 0 0 10 13 2 0 0 0 10 14 1 0 0 0 14 15 1 0 0 0 14 16 1 0 0 0 14 17 1 0 0 0 18 19 1 0 0 0 18 20 2 0 0 0 18 21 2 0 0 0 18 22 1 0 0 0 22 23 1 0 0 0 22 24 1 0 0 0 22 25 1 0 0 0 M STY 1 1 SUP M SLB 1 1 1 M SAL 1 4 5 6 7 8 M SBL 1 1 4 M SMT 1 ^CF3 M SBV 1 4 -8.3503 5.2207 M STY 1 2 SUP M SLB 1 2 2 M SAL 2 4 14 15 16 17 M SBL 2 1 11 M SMT 2 ^CF3 M SBV 2 11 -8.3503 5.2207 M STY 1 3 SUP M SLB 1 3 3 M SAL 3 4 22 23 24 25 M SBL 3 1 18 M SMT 3 ^CF3 M SBV 3 18 -8.3503 5.2207 M END > (C) 2008 SIGMA-ALDRICH CO. > MFCD00192254 > ALDRICH > 405345 > FLUKA > 62710 > - > - > 16251866 $$$$ 16 11 0 0 0 0 0 0 0 0 1 V2000 1.8880 -0.1977 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6025 0.2148 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3144 -0.1962 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0996 0.8436 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 -2.3851 1.2561 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.6707 0.8436 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 -2.3851 2.0783 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3144 -2.0783 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 -2.6000 -1.6658 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.8855 -2.0783 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 -2.6000 -0.8436 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0684 0.6288 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 1.7828 1.0413 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 2.4973 0.6288 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 1.7828 1.8634 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6997 -1.2046 0.0000 Lu 0 1 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 2 3 1 0 0 0 5 4 1 0 0 0 6 5 1 0 0 0 5 7 2 0 0 0 9 8 1 0 0 0 10 9 1 0 0 0 9 11 2 0 0 0 13 12 1 0 0 0 14 13 1 0 0 0 13 15 2 0 0 0 M STY 1 1 SUP M SLB 1 1 1 M SAL 1 3 1 2 3 M SMT 1 • xH2O M STY 1 2 SUP M SLB 1 2 2 M SAL 2 13 4 5 6 7 8 9 10 11 12 13 14 15 16 M SMT 2 Lu(NO3)3 M END > (C) 2008 SIGMA-ALDRICH CO. > MFCD00150421 > ALDRICH > 436429 > - > - > - > - > 16251866 $$$$ 5 4 0 0 0 0 0 0 0 0 1 V2000 -0.7145 0.6187 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7145 -0.2062 0.0000 Lu 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -0.6187 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7145 -0.2062 0.0000 Lu 0 0 0 0 0 0 0 0 0 0 0 0 0.7145 0.6187 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2 1 2 0 0 0 3 2 1 0 0 0 4 3 1 0 0 0 5 4 2 0 0 0 M END > (C) 2008 SIGMA-ALDRICH CO. > MFCD00011100 > ALDRICH > 203661 > FLUKA > 62700 > - > - > 16251866 $$$$ 5 4 0 0 0 0 0 0 0 0 1 V2000 -0.7145 0.6187 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7145 -0.2062 0.0000 Lu 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -0.6187 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7145 -0.2062 0.0000 Lu 0 0 0 0 0 0 0 0 0 0 0 0 0.7145 0.6187 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2 1 2 0 0 0 3 2 1 0 0 0 4 3 1 0 0 0 5 4 2 0 0 0 M END > (C) 2008 SIGMA-ALDRICH CO. > MFCD00011100 > ALDRICH > 289191 > FLUKA > 62700 > - > - > 16251866 $$$$ 5 3 0 0 0 0 0 0 0 0 1 V2000 -2.0750 -0.7049 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 -0.7760 0.0449 0.0000 Lu 0 0 0 0 0 0 0 0 0 0 0 0 0.5229 -0.7049 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 -0.7760 1.5449 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 1.7949 0.6750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 M END > (C) 2008 SIGMA-ALDRICH CO. > MFCD00150435 > ALDRICH > 545066 > - > - > - > - > 16251866 $$$$ 18 12 0 0 0 0 0 0 0 0 1 V2000 -3.0750 1.7304 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.5749 1.7304 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0750 3.2304 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5748 1.7304 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 -3.0750 0.2304 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 1.8149 1.7304 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 0.3149 1.7304 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 1.8149 3.2304 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3149 1.7304 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8149 0.2304 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.6449 -2.1693 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.7059 -1.1085 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 0.1759 -1.1085 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 0.4158 -3.2304 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7059 -3.2304 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6948 0.0804 0.0000 Lu 0 1 0 0 0 0 0 0 0 0 0 0 -0.0151 0.0804 0.0000 Lu 0 1 0 0 0 0 0 0 0 0 0 0 4.5749 -0.3095 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 3 2 0 0 0 0 1 4 1 0 0 0 0 1 5 1 0 0 0 0 6 7 1 0 0 0 0 6 8 2 0 0 0 0 6 9 2 0 0 0 0 6 10 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 14 2 0 0 0 0 11 15 2 0 0 0 0 M END > (C) 2008 SIGMA-ALDRICH CO. > MFCD00149953 > ALDRICH > 325791 > - > - > - > - > 16251866 $$$$ 21 15 0 0 0 0 0 0 0 0 1 V2000 -3.1849 -3.0340 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4349 -1.7350 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9350 -1.7350 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 -3.1849 -0.4360 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4349 0.8629 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 -4.6849 -0.4360 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5949 4.5529 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8449 3.2539 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5949 1.9549 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 0.6549 3.2539 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4049 1.9549 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 1.4049 4.5529 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4329 -0.4570 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9329 -0.4570 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1829 0.8420 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 2.1829 -1.7559 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6829 -1.7559 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 2.9329 -3.0549 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1229 0.0049 0.0000 Lu 0 1 0 0 0 0 0 0 0 0 0 0 0.8770 0.0549 0.0000 Lu 0 1 0 0 0 0 0 0 0 0 0 0 4.3369 2.0550 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 4 6 2 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 12 2 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 18 2 0 0 0 0 M END > (C) 2008 SIGMA-ALDRICH CO. > MFCD01632696 > ALDRICH > 480916 > - > - > - > - > 16251866 $$$$ 14 12 0 0 0 0 0 0 0 0 1 V2000 -2.8837 -0.3165 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1692 0.0960 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4548 -0.3165 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1692 0.9181 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3720 -0.3165 0.0000 Lu 0 0 0 0 0 0 0 0 0 0 0 0 -2.8407 -2.9375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1262 -2.5250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4118 -2.9375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1262 -1.7029 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7118 1.7029 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9973 2.1154 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2829 1.7029 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9973 2.9375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8837 0.7776 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2 1 1 0 0 0 3 2 1 0 0 0 2 4 2 0 0 0 7 6 1 0 0 0 8 7 1 0 0 0 7 9 2 0 0 0 11 10 1 0 0 0 12 11 1 0 0 0 11 13 2 0 0 0 3 5 1 0 0 0 12 5 1 0 0 0 8 5 1 0 0 0 M END > (C) 2008 SIGMA-ALDRICH CO. > MFCD00150119 > ALDRICH > 325783 > - > - > - > - > 16251866 $$$$