5 3 0 0 0 0 0 0 0 0 1 V2000 -0.0027 1.5759 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2960 0.8257 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0027 3.6027 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2961 0.8257 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4339 -3.6027 0.0000 Bi 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 3 2 0 0 0 0 1 4 1 0 0 0 0 M END > (C) 2008 SIGMA-ALDRICH CO. > MFCD00015629 > ALDRICH > 401587 > - > - > - > - > 16244042 $$$$ 17 12 0 0 0 0 0 0 0 0 1 V2000 -5.7849 -0.6200 0.0000 Mo 0 0 0 0 0 0 0 0 0 0 0 0 -4.2849 -0.6200 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 -7.2849 -0.6200 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 -5.7849 -2.1199 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.7849 0.8799 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0649 -0.7500 0.0000 Mo 0 0 0 0 0 0 0 0 0 0 0 0 1.5649 -0.7500 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.4349 -0.7500 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 0.0649 -2.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0649 0.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1549 -0.8100 0.0000 Mo 0 0 0 0 0 0 0 0 0 0 0 0 6.6549 -0.8100 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 3.6549 -0.8100 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 5.1549 -2.3099 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1549 0.6899 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1549 1.5799 0.0000 Bi 0 1 0 0 0 0 0 0 0 0 0 0 3.1649 1.7199 0.0000 Bi 0 1 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 3 1 0 0 0 0 1 4 2 0 0 0 0 1 5 2 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 9 2 0 0 0 0 6 10 2 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 14 2 0 0 0 0 11 15 2 0 0 0 0 M END > (C) 2008 SIGMA-ALDRICH CO. > MFCD00064784 > ALDRICH > 520136 > - > - > - > - > 16244042 $$$$ 14 9 0 0 0 0 0 0 0 0 1 V2000 -1.0338 0.0079 0.0000 Zr 0 0 0 0 0 0 0 0 0 0 0 0 -1.0338 0.8329 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3218 -0.4032 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.7458 -0.4032 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.1627 -2.1835 0.0000 Zr 0 0 0 0 0 0 0 0 0 0 0 0 -1.1627 -1.3585 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4507 -2.5946 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.8747 -2.5946 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.0338 1.7696 0.0000 Zr 0 0 0 0 0 0 0 0 0 0 0 0 -1.0338 2.5946 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3218 1.3585 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.7458 1.3585 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 1.1442 1.6493 0.0000 Bi 0 1 0 0 0 0 0 0 0 0 0 0 1.8747 -0.2843 0.0000 Bi 0 1 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 1 3 1 0 0 0 1 4 1 0 0 0 5 6 2 0 0 0 5 7 1 0 0 0 5 8 1 0 0 0 9 10 2 0 0 0 9 11 1 0 0 0 9 12 1 0 0 0 M END > (C) 2008 SIGMA-ALDRICH CO. > MFCD00049720 > ALDRICH > 403660 > - > - > - > - > 16244042 $$$$ 8 6 0 0 0 0 0 0 0 0 1 V2000 -3.7799 0.8599 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4809 0.1099 0.0000 Bi 0 0 0 0 0 0 0 0 0 0 0 0 -1.1820 0.8599 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1170 0.1099 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.4159 0.8599 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1169 -1.3899 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1170 1.6100 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2500 -0.0199 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 2 0 0 0 0 4 7 2 0 0 0 0 M END > (C) 2008 SIGMA-ALDRICH CO. > MFCD01321385 > ALDRICH > 483273 > - > - > - > - > 16244042 $$$$ 5 3 0 0 0 0 0 0 0 0 1 V2000 1.7417 -2.8750 0.0000 Na 0 3 0 0 0 0 0 0 0 0 0 0 0.5875 -2.4958 0.0000 Bi 0 0 0 0 0 0 0 0 0 0 0 0 0.5833 -1.9083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0750 -2.7875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0958 -2.7875 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 2 3 2 0 0 0 0 2 4 2 0 0 0 0 2 5 1 0 0 0 0 M CHG 2 1 1 5 -1 M END > (C) 2008 SIGMA-ALDRICH CO. > MFCD00003474 > SIGMA-ALDRICH > 383139 > - > - > - > - > 16244042 $$$$ 27 29 0 0 0 0 0 0 0 0 1 V2000 5.7108 -3.4871 0.0000 Bi 0 0 0 0 0 0 0 0 0 0 0 0 5.7239 -2.8872 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2220 -3.7973 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1866 -3.7747 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2500 -2.5986 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2630 -1.9988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7501 -1.6875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2241 -1.9761 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2110 -2.5760 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6737 -3.4634 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1312 -3.7354 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1346 -4.3519 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6788 -4.6631 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1937 -4.3292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2250 -4.3604 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7531 -4.7084 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2792 -4.4198 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2875 -3.7979 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7480 -3.5087 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9236 -2.9136 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5540 -2.9282 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3236 -2.9136 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1540 -2.9282 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4530 -2.4104 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4530 -3.4460 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0246 -2.3958 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0246 -3.4314 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 3 1 0 0 0 0 1 4 1 0 0 0 0 2 5 2 0 0 0 0 5 6 1 0 0 0 0 6 7 2 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 9 2 1 0 0 0 0 4 10 2 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 14 4 1 0 0 0 0 3 15 2 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 19 3 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 20 22 1 0 0 0 0 21 23 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 22 26 2 0 0 0 0 22 27 1 0 0 0 0 M END > (C) 2008 SIGMA-ALDRICH CO. > MFCD00092697 > ALDRICH > 485721 > - > - > - > - > 16244042 $$$$ 40 39 0 0 0 0 0 0 0 0 1 V2000 7.1052 -3.3021 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5052 -3.3021 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4052 -3.8217 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1052 -4.3413 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5052 -4.3413 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3989 -2.7933 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 7.3989 -4.8501 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.3180 -1.8983 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3187 -2.4983 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7980 -1.5990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2788 -1.8996 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2795 -2.4996 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8264 -1.6040 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 4.7696 -1.6064 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 4.3739 -3.3312 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9739 -3.3312 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0739 -3.8509 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3739 -4.3705 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9739 -4.3705 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0802 -2.8225 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 4.0802 -4.8793 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.7552 -3.4675 0.0000 Bi 0 0 0 0 0 0 0 0 0 0 0 0 4.3739 -2.3137 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4927 -2.8225 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6625 -2.4042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4927 -4.8793 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3739 -5.3881 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7833 -5.3875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1052 -5.3589 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9864 -4.8501 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6875 -5.3583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9864 -2.7933 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1052 -2.2845 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8083 -2.3750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3356 -1.8971 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8257 -1.0165 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3916 -1.4458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7689 -1.0189 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2612 -1.9008 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3500 -1.1875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10 11 2 0 0 0 0 19 22 1 0 0 0 0 12 22 1 0 0 0 0 5 22 1 0 0 0 0 11 12 1 0 0 0 0 20 23 1 0 0 0 0 1 2 2 0 0 0 0 20 24 1 0 0 0 0 8 13 1 0 0 0 0 20 25 1 0 0 0 0 4 7 1 0 0 0 0 21 26 1 0 0 0 0 11 14 1 0 0 0 0 21 27 1 0 0 0 0 1 3 1 0 0 0 0 21 28 1 0 0 0 0 3 4 2 0 0 0 0 7 29 1 0 0 0 0 4 5 1 0 0 0 0 7 30 1 0 0 0 0 7 31 1 0 0 0 0 1 6 1 0 0 0 0 6 32 1 0 0 0 0 15 16 2 0 0 0 0 6 33 1 0 0 0 0 15 17 1 0 0 0 0 6 34 1 0 0 0 0 17 18 2 0 0 0 0 13 35 1 0 0 0 0 18 19 1 0 0 0 0 13 36 1 0 0 0 0 8 9 2 0 0 0 0 13 37 1 0 0 0 0 15 20 1 0 0 0 0 14 38 1 0 0 0 0 8 10 1 0 0 0 0 14 39 1 0 0 0 0 18 21 1 0 0 0 0 14 40 1 0 0 0 0 M END > (C) 2008 SIGMA-ALDRICH CO. > MFCD00064763 > ALDRICH > 373788 > - > - > - > - > 16244042 $$$$ 10 6 0 0 0 0 0 0 0 0 1 V2000 -2.4829 0.4426 0.0000 Al 0 0 0 0 0 0 0 0 0 0 0 0 -2.4829 1.2676 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7710 0.0315 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.3775 0.5285 0.0000 Al 0 0 0 0 0 0 0 0 0 0 0 0 -0.3775 1.3535 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3345 0.1174 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 1.7710 0.4426 0.0000 Al 0 0 0 0 0 0 0 0 0 0 0 0 1.7710 1.2676 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4829 0.0315 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.1761 -1.3535 0.0000 Bi 0 1 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 1 3 1 0 0 0 4 5 2 0 0 0 4 6 1 0 0 0 7 8 2 0 0 0 7 9 1 0 0 0 M END > (C) 2008 SIGMA-ALDRICH CO. > MFCD00672141 > ALDRICH > 510289 > - > - > - > - > 16244042 $$$$ 6 4 0 0 0 0 0 0 0 0 1 V2000 -0.7949 0.1229 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 2.5940 0.1529 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 -2.4900 -2.8129 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 0.8999 -2.8129 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 -2.4949 3.0669 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8049 -1.5970 0.0000 Bi 0 1 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 3 1 0 0 0 0 1 4 1 0 0 0 0 1 5 2 0 0 0 0 M END > (C) 2008 SIGMA-ALDRICH CO. > MFCD00049721 > ALDRICH > 483311 > - > - > - > - > 16244042 $$$$ 23 24 0 0 0 0 0 0 0 0 1 V2000 -2.2129 -0.8236 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4984 -0.4111 0.0000 Bi 0 2 0 0 0 0 0 0 0 0 0 0 -0.7839 -0.8236 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4984 0.4111 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9274 -0.4111 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6418 -0.8236 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6418 -1.6486 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9274 -2.0611 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2129 -1.6486 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7839 -1.6486 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0695 -2.0611 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6450 -1.6486 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6450 -0.8236 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0695 -0.4111 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7839 0.8236 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7839 1.6486 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4984 2.0611 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2129 1.6486 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2129 0.8236 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2129 -0.1361 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 2.9274 0.2764 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6418 -0.1361 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 2.9274 1.0986 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2 1 1 0 0 0 3 2 1 0 0 0 2 4 1 0 0 0 1 5 1 0 0 0 5 6 2 0 0 0 6 7 1 0 0 0 7 8 2 0 0 0 8 9 1 0 0 0 9 1 2 0 0 0 3 10 1 0 0 0 10 11 2 0 0 0 11 12 1 0 0 0 12 13 2 0 0 0 13 14 1 0 0 0 14 3 2 0 0 0 4 15 1 0 0 0 15 16 2 0 0 0 16 17 1 0 0 0 17 18 2 0 0 0 18 19 1 0 0 0 19 4 2 0 0 0 21 20 1 0 0 0 22 21 1 0 0 0 21 23 2 0 0 0 M END > (C) 2008 SIGMA-ALDRICH CO. > MFCD00209622 > ALDRICH > 427411 > - > - > - > - > 16244042 $$$$ 4 3 0 0 0 0 0 0 0 0 1 V2000 4.7167 -2.8013 0.0000 Bi 0 0 0 0 0 0 0 0 0 0 0 0 4.7167 -1.9792 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 5.4287 -3.2124 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 4.0047 -3.2124 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 3 1 0 0 0 0 1 4 1 0 0 0 0 G 1 0 BiBr3 M STY 1 1 SUP M SLB 1 1 1 M SAL 1 4 1 2 3 4 M SDI 1 4 3.3700 -3.7200 3.3700 -1.5700 M SMT 1 BiBr3 M SDS EXP 1 1 M END > (C) 2008 SIGMA-ALDRICH CO. > MFCD00014195 > ALDRICH > 401072 > - > - > - > - > 16244042 $$$$ 6 5 0 0 0 0 0 0 0 0 1 V2000 0.3404 0.0249 0.0000 Bi 0 0 0 0 0 0 0 0 0 0 0 0 1.6394 0.7749 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 -0.9585 0.7749 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 0.3404 -1.4750 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 0.3404 1.5249 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 -0.9585 -0.7249 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 3 1 0 0 0 0 1 4 1 0 0 0 0 1 5 1 0 0 0 0 1 6 1 0 0 0 0 M END > (C) 2008 SIGMA-ALDRICH CO. > MFCD00015967 > ALDRICH > 515914 > - > - > - > - > 16244042 $$$$ 3 2 0 0 0 0 0 0 0 0 1 V2000 0.0000 0.3745 0.0000 Bi 0 0 0 0 0 0 0 0 0 0 0 0 -1.2996 -0.3744 0.0000 I 0 0 0 0 0 0 0 0 0 0 0 0 1.2995 -0.3744 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 3 2 0 0 0 0 M END > (C) 2008 SIGMA-ALDRICH CO. > MFCD00015969 > ALDRICH > 335371 > - > - > - > - > 16244042 $$$$ 4 3 0 0 0 0 0 0 0 0 1 V2000 0.0000 -0.2878 0.0000 Bi 0 0 0 0 0 0 0 0 0 0 0 0 1.2981 -1.0394 0.0000 I 0 0 0 0 0 0 0 0 0 0 0 0 -1.2980 -1.0394 0.0000 I 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 1.0394 0.0000 I 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 3 1 0 0 0 0 1 4 1 0 0 0 0 M END > (C) 2008 SIGMA-ALDRICH CO. > MFCD00010894 > ALDRICH > 341010 > - > - > - > - > 16244042 $$$$ 4 3 0 0 0 0 0 0 0 0 1 V2000 0.0000 -0.2878 0.0000 Bi 0 0 0 0 0 0 0 0 0 0 0 0 1.2981 -1.0394 0.0000 I 0 0 0 0 0 0 0 0 0 0 0 0 -1.2980 -1.0394 0.0000 I 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 1.0394 0.0000 I 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 3 1 0 0 0 0 1 4 1 0 0 0 0 M END > (C) 2008 SIGMA-ALDRICH CO. > MFCD00010894 > ALDRICH > 229474 > - > - > - > - > 16244042 $$$$ 14 15 0 0 0 0 0 0 0 0 1 V2000 0.7833 -0.8855 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8296 0.6541 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5711 -1.6110 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2304 -1.3949 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4785 1.4722 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3076 1.0862 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8831 -0.8083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1681 -0.1755 0.0000 Bi 0 0 0 0 0 0 0 0 0 0 0 0 -1.8368 0.7312 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4360 3.0118 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2376 -1.5416 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7078 -0.2218 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6736 -3.0118 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7078 -1.1016 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 3 1 0 0 0 0 1 4 1 0 0 0 0 2 5 1 0 0 0 0 2 6 1 0 0 0 0 3 7 2 0 0 0 0 4 8 1 0 0 0 0 5 9 2 0 0 0 0 5 10 1 0 0 0 0 6 8 1 0 0 0 0 7 11 1 0 0 0 0 7 9 1 0 0 0 0 8 12 1 0 0 0 0 11 13 1 0 0 0 0 11 14 2 0 0 0 0 M END > (C) 2008 SIGMA-ALDRICH CO. > MFCD00044980 > FLUKA > 15102 > - > - > - > - > 16244042 $$$$ 14 12 0 0 0 0 0 0 0 0 1 V2000 -0.3805 0.2649 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3805 0.9948 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4104 1.9548 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4104 2.6849 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4004 -1.4049 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4004 -2.2649 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4794 0.2649 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 0.3442 -0.9749 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 0.3342 1.5248 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 2.1194 0.2450 0.0000 Bi 0 1 0 0 0 0 0 0 0 0 0 0 -1.2603 0.2649 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0051 -0.1650 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2603 1.5348 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2603 -0.8849 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 7 1 0 0 0 0 1 11 1 0 0 0 0 3 4 2 0 0 0 0 3 9 1 0 0 0 0 3 13 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 5 14 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 14 1 0 0 0 0 M END > (C) 2008 SIGMA-ALDRICH CO. > MFCD00050817 > ALDRICH > 480746 > - > - > - > - > 16244042 $$$$ 12 13 0 0 0 0 0 0 0 0 1 V2000 -0.4099 1.5824 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9899 1.5824 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6899 0.3725 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6899 1.1825 0.0000 Bi 0 0 0 0 0 0 0 0 0 0 0 0 0.9899 -0.0324 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2899 0.3725 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2899 1.1825 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9899 -0.8374 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2899 -1.2474 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4099 -0.8374 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4099 -0.0374 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4199 1.6024 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 7 2 0 0 0 0 2 4 1 0 0 0 0 2 7 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 4 12 1 0 0 0 0 5 8 2 0 0 0 0 5 6 1 0 0 0 0 6 11 2 0 0 0 0 6 7 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 11 1 0 0 0 0 M END > (C) 2008 SIGMA-ALDRICH CO. > MFCD00085368 > ALDRICH > 480789 > FLUKA > 80267 > - > - > 16244042 $$$$ 11 10 0 0 0 0 0 0 0 0 1 V2000 -2.0366 0.2062 0.0000 Bi 0 0 0 0 0 0 0 0 0 0 0 0 -1.3222 0.6187 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6077 0.2062 0.0000 Ti 0 0 0 0 0 0 0 0 0 0 0 0 0.1068 0.6187 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8212 0.2062 0.0000 Ti 0 0 0 0 0 0 0 0 0 0 0 0 1.5357 0.6187 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2502 0.2062 0.0000 Bi 0 0 0 0 0 0 0 0 0 0 0 0 -2.2502 -0.5906 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6077 -0.6187 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8212 -0.6159 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2502 -0.6187 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2 1 1 0 0 0 3 2 1 0 0 0 4 3 1 0 0 0 5 4 1 0 0 0 6 5 1 0 0 0 7 6 1 0 0 0 1 8 2 0 0 0 3 9 2 0 0 0 5 10 2 0 0 0 7 11 2 0 0 0 M END > (C) 2008 SIGMA-ALDRICH CO. > MFCD00136014 > ALDRICH > 403687 > - > - > - > - > 16244042 $$$$ 37 36 0 0 0 0 0 0 0 0 1 V2000 -0.4505 -0.9649 0.0000 Bi 0 0 0 0 0 0 0 0 0 0 0 0 0.8484 -1.7149 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7495 -1.7149 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4505 0.5349 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0485 -0.9649 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3475 -1.7149 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1475 -0.9649 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4464 -1.7149 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1475 0.5349 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0485 0.5349 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.6465 -0.9649 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3475 -3.2149 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3475 -0.2149 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7454 -0.9649 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4464 -3.2149 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4464 -0.2149 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0444 -1.7149 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3434 -0.9649 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6424 -1.7149 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9414 -0.9649 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2405 -1.7149 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9455 -1.7149 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2445 -0.9649 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5434 -1.7149 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.8425 -0.9649 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.1415 -1.7149 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2994 1.8339 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7994 1.8339 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5494 3.1329 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4505 3.1329 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0984 1.0839 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0494 3.1329 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0494 3.1329 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7994 1.8339 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2994 1.8339 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0494 0.5349 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5494 0.5349 0.0000 C 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 2 7 1 0 0 0 0 3 5 1 0 0 0 0 4 27 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 11 1 0 0 0 0 6 12 1 0 0 0 0 6 13 1 0 0 0 0 7 8 1 0 0 0 0 7 9 2 0 0 0 0 8 14 1 0 0 0 0 8 15 1 0 0 0 0 8 16 1 0 0 0 0 11 22 1 0 0 0 0 14 17 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 27 28 1 0 0 0 0 27 30 2 0 0 0 0 28 29 1 0 0 0 0 28 31 1 0 0 0 0 28 32 1 0 0 0 0 29 33 1 0 0 0 0 33 34 1 0 0 0 0 34 35 1 0 0 0 0 35 36 1 0 0 0 0 36 37 1 0 0 0 0 M END > (C) 2008 SIGMA-ALDRICH CO. > MFCD00070469 > ALDRICH > 544132 > - > - > - > - > 16244042 $$$$ 4 3 0 0 0 0 0 0 0 0 1 V2000 -0.2055 0.0000 0.0000 Bi 0 0 0 0 0 0 0 0 0 0 0 0 -0.6166 -0.7120 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 -0.6166 0.7120 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 0.6166 0.0000 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 1 3 1 0 0 0 1 4 1 0 0 0 M STY 1 1 SUP M SLB 1 1 1 M SAL 1 4 1 2 3 4 M SMT 1 BiF3 M END > (C) 2008 SIGMA-ALDRICH CO. > MFCD00010893 > ALDRICH > 401528 > RIEDEL > 01260 > - > - > 16244042 $$$$ 4 3 0 0 0 0 0 0 0 0 1 V2000 0.0000 -0.2878 0.0000 Bi 0 0 0 0 0 0 0 0 0 0 0 0 1.2981 -1.0394 0.0000 I 0 0 0 0 0 0 0 0 0 0 0 0 -1.2980 -1.0394 0.0000 I 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 1.0394 0.0000 I 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 3 1 0 0 0 0 1 4 1 0 0 0 0 M END > (C) 2008 SIGMA-ALDRICH CO. > MFCD00010894 > ALDRICH > 456837 > - > - > - > - > 16244042 $$$$ 7 6 0 0 0 0 0 0 0 0 1 V2000 -0.1929 -1.0417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1041 -0.2884 0.0000 Bi 0 0 0 0 0 0 0 0 0 0 0 0 -1.3026 -0.4024 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 2.4085 -1.0417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1041 1.0417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3026 0.9314 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4085 -1.0417 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 3 1 0 0 0 0 2 4 1 0 0 0 0 2 5 1 0 0 0 0 3 6 2 0 0 0 0 3 7 1 0 0 0 0 M END > (C) 2008 SIGMA-ALDRICH CO. > MFCD00191816 > ALDRICH > 342408 > - > - > - > - > 16244042 $$$$ 5 4 0 0 0 0 0 0 0 0 1 V2000 3.7708 -5.3375 0.0000 Bi 0 0 0 0 0 0 0 0 0 0 0 0 4.4833 -4.9208 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1958 -5.3333 0.0000 Bi 0 0 0 0 0 0 0 0 0 0 0 0 5.9083 -4.9167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0542 -4.9250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2 3 1 0 0 0 0 1 2 1 0 0 0 0 3 4 2 0 0 0 0 1 5 2 0 0 0 0 M END > (C) 2008 SIGMA-ALDRICH CO. > MFCD00003462 > ALDRICH > 223891 > FLUKA > 95381 > - > - > 16244042 $$$$ 18 9 0 0 0 0 0 0 0 0 1 V2000 -2.2729 1.8534 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.5584 2.2659 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.8439 1.8534 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.5584 3.0880 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4018 -0.6388 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.6873 -0.2263 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.9728 -0.6388 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.6873 0.5958 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4018 -3.0880 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.6873 -2.6755 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.9728 -3.0880 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.6873 -1.8534 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0653 1.4753 0.0000 Bi 0 1 0 0 0 0 0 0 0 0 0 0 2.0151 -0.3294 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1010 -1.1458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8861 -2.1341 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4018 0.5299 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6713 -3.0365 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2 1 1 0 0 0 3 2 1 0 0 0 2 4 2 0 0 0 6 5 1 0 0 0 7 6 1 0 0 0 6 8 2 0 0 0 10 9 1 0 0 0 11 10 1 0 0 0 10 12 2 0 0 0 M END > (C) 2008 SIGMA-ALDRICH CO. > MFCD00149157 > SIGMA-ALDRICH > 383074 > ALDRICH > 248592 > RIEDEL > 10324 > 16244042 $$$$ 25 21 0 0 0 0 0 0 0 0 1 V2000 6.0819 -6.4958 0.0000 S 0 0 3 0 0 0 0 0 0 0 0 0 6.0819 -5.6708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0819 -7.3208 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9069 -6.4958 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 5.2569 -6.4958 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 4.8375 -5.7792 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 4.6667 -7.0792 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 4.4292 -6.4958 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 2.3042 -6.7125 0.0000 Bi 0 1 0 0 0 0 0 0 0 0 0 0 -0.0514 -6.5958 0.0000 S 0 0 3 0 0 0 0 0 0 0 0 0 -0.0514 -5.7708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0514 -7.4208 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7736 -6.5958 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.8764 -6.5958 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.2958 -5.8792 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 -1.4667 -7.1792 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 -1.7042 -6.5958 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 2.9903 -9.0208 0.0000 S 0 0 3 0 0 0 0 0 0 0 0 0 2.9903 -8.1958 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9903 -9.8458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8153 -9.0208 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 2.1653 -9.0208 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.7458 -8.3042 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 1.5750 -9.6042 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 1.3375 -9.0208 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 10 12 2 0 0 0 0 10 13 1 0 0 0 0 10 14 1 0 0 0 0 5 6 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 5 7 1 0 0 0 0 14 17 1 0 0 0 0 5 8 1 0 0 0 0 1 2 2 0 0 0 0 1 3 2 0 0 0 0 18 19 2 0 0 0 0 18 20 2 0 0 0 0 18 21 1 0 0 0 0 18 22 1 0 0 0 0 1 4 1 0 0 0 0 1 5 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 10 11 2 0 0 0 0 22 25 1 0 0 0 0 M CHG 4 4 -1 9 3 13 -1 21 -1 M END > (C) 2008 SIGMA-ALDRICH CO. > MFCD02093669 > ALDRICH > 633305 > - > - > - > - > 16244042 $$$$ 8 5 0 0 0 0 0 0 0 0 1 V2000 4.9715 -3.1437 0.0000 Bi 0 0 0 0 0 0 0 0 0 0 0 0 4.9715 -2.5437 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9715 -3.7437 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5715 -3.1437 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 6.2872 -3.0500 0.0000 Na 0 3 0 0 0 0 0 0 0 0 0 0 5.1083 -4.4000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5792 -4.8083 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7042 -4.7458 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 3 2 0 0 0 0 1 4 1 0 0 0 0 6 7 1 0 0 0 0 1 2 2 0 0 0 0 6 8 1 0 0 0 0 M CHG 2 4 -1 5 1 M END > (C) 2008 SIGMA-ALDRICH CO. > MFCD02684285 > SIGMA > S1881 > - > - > - > - > 16244042 $$$$ 3 2 0 0 0 0 0 0 0 0 1 V2000 -0.3560 -0.2070 0.0000 Bi 0 0 0 0 0 0 0 0 0 0 0 0 -0.3560 0.6180 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3560 -0.6180 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 1 3 1 0 0 0 M END > (C) 2008 SIGMA-ALDRICH CO. > MFCD00010895 > FLUKA > 95374 > - > - > - > - > 16244042 $$$$ 5 4 0 0 0 0 0 0 0 0 1 V2000 3.7708 -5.3375 0.0000 Bi 0 0 0 0 0 0 0 0 0 0 0 0 4.4833 -4.9208 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1958 -5.3333 0.0000 Bi 0 0 0 0 0 0 0 0 0 0 0 0 5.9083 -4.9167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0542 -4.9250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2 3 1 0 0 0 0 1 2 1 0 0 0 0 3 4 2 0 0 0 0 1 5 2 0 0 0 0 M END > (C) 2008 SIGMA-ALDRICH CO. > MFCD00003462 > ALDRICH > 637017 > FLUKA > 95381 > - > - > 16244042 $$$$ 4 3 0 0 0 0 0 0 0 0 1 V2000 -0.2055 0.0000 0.0000 Bi 0 0 0 0 0 0 0 0 0 0 0 0 -0.6166 -0.7120 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 -0.6166 0.7120 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 0.6166 0.0000 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 1 3 1 0 0 0 1 4 1 0 0 0 M STY 1 1 SUP M SLB 1 1 1 M SAL 1 4 1 2 3 4 M SMT 1 BiF3 M END > (C) 2008 SIGMA-ALDRICH CO. > MFCD00010893 > ALDRICH > 316962 > RIEDEL > 01260 > - > - > 16244042 $$$$ 1 0 0 0 0 0 0 0 0 0 1 V2000 4.7708 -2.5042 0.0000 Bi 0 0 0 0 0 15 0 0 0 0 0 0 M END > (C) 2008 SIGMA-ALDRICH CO. > MFCD00134033 > FLUKA > 95372 > - > - > - > - > 16244042 $$$$ 8 7 0 0 0 0 0 0 0 0 1 V2000 0.0000 -0.6402 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2975 -1.3930 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2975 -1.3930 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 1.3930 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2858 -0.2470 0.0000 Bi 0 0 0 0 0 0 0 0 0 0 0 0 -3.2914 -0.2414 0.0000 Bi 0 0 0 0 0 0 0 0 0 0 0 0 5.2741 -1.3930 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2741 -1.3930 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 3 1 0 0 0 0 1 4 2 0 0 0 0 2 5 1 0 0 0 0 3 6 1 0 0 0 0 5 7 2 0 0 0 0 6 8 2 0 0 0 0 M END > (C) 2008 SIGMA-ALDRICH CO. > MFCD00010877 > ALDRICH > 278947 > - > - > - > - > 16244042 $$$$ 4 3 0 0 0 0 0 0 0 0 1 V2000 0.0016 -0.2030 0.0000 Bi 0 0 0 0 0 0 0 0 0 0 0 0 1.2997 -0.9544 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -1.2997 -0.9544 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.0016 0.9544 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 3 1 0 0 0 0 1 4 1 0 0 0 0 M END > (C) 2008 SIGMA-ALDRICH CO. > MFCD00003461 > SIGMA-ALDRICH > 224839 > ALDRICH > 470279 > - > - > 16244042 $$$$ 5 4 0 0 0 0 0 0 0 0 1 V2000 3.7708 -5.3375 0.0000 Bi 0 0 0 0 0 0 0 0 0 0 0 0 4.4833 -4.9208 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1958 -5.3333 0.0000 Bi 0 0 0 0 0 0 0 0 0 0 0 0 5.9083 -4.9167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0542 -4.9250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2 3 1 0 0 0 0 1 2 1 0 0 0 0 3 4 2 0 0 0 0 1 5 2 0 0 0 0 M END > (C) 2008 SIGMA-ALDRICH CO. > MFCD00003462 > ALDRICH > 202827 > FLUKA > 95381 > - > - > 16244042 $$$$