3 2 0 0 0 0 0 0 0 0 1 V2000 0.0005 0.0000 0.0000 Cd 0 0 0 0 0 0 0 0 0 0 0 0 -1.2984 0.7500 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.2996 0.7499 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 M END > (C) 2008 SIGMA-ALDRICH CO. > 16244158 > MFCD00010916 > A > 202908 > - > - > - > - $$$$ 21 20 0 0 0 0 0 0 0 0 1 V2000 3.3838 -1.8999 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0958 -2.3110 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3838 -1.0778 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8078 -1.8999 0.0000 Cd 0 0 0 0 0 0 0 0 0 0 0 0 5.6959 2.3110 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9839 1.8999 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2719 2.3110 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5600 1.8999 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8480 2.3110 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1360 1.8999 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4240 2.3110 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7120 1.8999 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0000 2.3110 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7120 1.8999 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4240 2.3110 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1360 1.8999 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8480 2.3110 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5600 1.8999 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2719 2.3110 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9839 1.8999 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6959 2.3110 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 1 3 2 0 0 0 2 4 1 0 0 0 1 5 1 0 0 0 5 6 1 0 0 0 6 7 1 0 0 0 7 8 1 0 0 0 8 9 1 0 0 0 9 10 1 0 0 0 10 11 1 0 0 0 11 12 1 0 0 0 12 13 1 0 0 0 13 14 1 0 0 0 14 15 1 0 0 0 15 16 1 0 0 0 16 17 1 0 0 0 17 18 1 0 0 0 18 19 1 0 0 0 19 20 1 0 0 0 20 21 1 0 0 0 M STY 1 1 SUP M SLB 1 1 1 M SAL 1 15 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 M SAL 1 2 20 21 M SBL 1 1 4 M SMT 1 ^CH2(CH2)15CH3 M SBV 1 4 -5.2236 8.3438 M END > (C) 2008 SIGMA-ALDRICH CO. > 16244158 > F______06925 > F > 06925 > - > - > - > - $$$$ 9 6 0 0 0 0 0 0 0 0 1 V2000 3.7083 -6.7750 0.0000 Cd 0 2 0 0 0 0 0 0 0 0 0 0 6.5792 -5.8667 0.0000 I 0 0 0 0 0 0 0 0 0 0 0 0 7.2954 -5.4542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8630 -5.4542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5792 -6.6917 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 1.6167 -5.9292 0.0000 I 0 0 0 0 0 0 0 0 0 0 0 0 2.3329 -5.5167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9005 -5.5167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6167 -6.7542 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 2 4 2 0 0 0 0 2 5 1 0 0 0 0 2 3 2 0 0 0 0 6 7 2 0 0 0 0 6 8 2 0 0 0 0 6 9 1 0 0 0 0 M CHG 3 1 2 5 -1 9 -1 M END > (C) 2008 SIGMA-ALDRICH CO. > 16244158 > MFCD00049409 > A > 589241 > - > - > - > - $$$$ 43 50 0 0 0 0 0 0 0 0 1 V2000 -2.0912 -1.5599 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5120 -2.1292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7298 -1.6992 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8576 -0.9144 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.7052 -0.7706 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4882 2.0726 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0874 1.4628 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7184 0.7406 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9036 0.8988 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7294 1.7165 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1044 -0.0487 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1133 1.5599 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5340 2.1292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7516 1.7294 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9101 0.8844 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.6970 0.7704 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0228 2.1160 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5709 -2.1023 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1402 -1.5230 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7402 -0.7104 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8955 -0.8991 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7514 -1.7165 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0295 -2.1157 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1267 0.0185 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8959 1.7770 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0993 2.5633 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5200 3.1325 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7374 2.9155 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7166 2.8964 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5443 3.1104 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1435 2.5007 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9151 1.6769 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7880 -2.8849 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5743 -3.0882 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1435 -2.5090 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9265 -1.7263 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8739 -1.7770 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0772 -2.5633 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4979 -3.1325 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7153 -2.9155 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3203 0.3155 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3121 -0.3157 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1379 0.0516 0.0000 Cd 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 2 3 1 0 3 4 2 0 4 5 1 0 1 5 1 0 5 11 2 0 3 23 1 0 6 7 1 0 7 8 2 0 8 9 1 0 9 10 1 0 6 10 2 0 10 17 1 0 8 11 1 0 12 13 2 0 13 14 1 0 14 15 1 0 15 16 2 0 12 16 1 0 16 24 1 0 14 17 2 0 18 19 2 0 19 20 1 0 20 21 1 0 21 22 1 0 18 22 1 0 22 23 2 0 20 24 2 0 12 25 1 0 25 26 2 0 26 27 1 0 27 28 2 0 28 13 1 0 6 29 1 0 29 30 2 0 30 31 1 0 31 32 2 0 32 7 1 0 18 33 1 0 33 34 2 0 34 35 1 0 35 36 2 0 36 19 1 0 1 37 1 0 37 38 2 0 38 39 1 0 39 40 2 0 40 2 1 0 9 41 1 0 21 42 1 0 M END > (C) 2008 SIGMA-ALDRICH CO. > 16244158 > MFCD00143894 > A > 556211 > - > - > - > - $$$$ 7 4 0 0 0 0 0 0 0 0 1 V2000 0.0000 2.9820 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 0.7516 4.2802 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7516 4.2802 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2096 2.2867 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2096 2.2867 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3135 -0.7395 0.0000 Cd 0 0 0 0 0 0 0 0 0 0 0 0 1.1614 -4.2802 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 3 2 0 0 0 0 1 4 1 0 0 0 0 1 5 1 0 0 0 0 M END > (C) 2008 SIGMA-ALDRICH CO. > 16244158 > MFCD00010923 > 1 > 383082 > A > 481882 > - > - $$$$ 3 2 0 0 0 0 0 0 0 0 1 V2000 2.6458 -2.6833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2375 -2.2792 0.0000 Cd 0 0 0 0 0 0 0 0 0 0 0 0 4.0708 -2.6833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 M END > (C) 2008 SIGMA-ALDRICH CO. > 16244158 > MFCD00015995 > A > 401560 > - > - > - > - $$$$ 15 14 0 0 0 0 0 0 0 0 1 V2000 -1.4504 -2.3621 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7360 -1.9496 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0215 -2.3621 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6930 -1.9496 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4075 -2.3621 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7360 -1.1275 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6930 -1.1275 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2721 -0.0280 0.0000 Cd 0 0 0 0 0 0 0 0 0 0 0 0 -1.4075 2.3621 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6930 1.9496 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0215 2.3621 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7360 1.9496 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4504 2.3621 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6930 1.1275 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7360 1.1275 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2 1 1 0 0 0 3 2 1 0 0 0 4 3 2 0 0 0 5 4 1 0 0 0 2 6 2 0 0 0 4 7 1 0 0 0 10 9 1 0 0 0 11 10 1 0 0 0 12 11 2 0 0 0 13 12 1 0 0 0 10 14 2 0 0 0 12 15 1 0 0 0 8 15 1 0 0 0 8 7 1 0 0 0 M END > (C) 2008 SIGMA-ALDRICH CO. > 16244158 > MFCD00040412 > A > 517585 > - > - > - > - $$$$ 6 3 0 0 0 0 0 0 0 0 1 V2000 -0.3107 4.0367 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9881 3.2864 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3107 6.0634 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6040 3.2864 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6039 -1.1420 0.0000 Cd 0 0 0 0 0 0 0 0 0 0 0 0 1.6039 -6.0634 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 3 2 0 0 0 0 1 4 1 0 0 0 0 M END > (C) 2008 SIGMA-ALDRICH CO. > 16244158 > MFCD00150021 > A > 229490 > - > - > - > - $$$$ 21 14 0 0 0 0 0 0 0 0 1 V2000 -0.9292 1.8667 0.0000 Cd 0 0 0 0 0 0 0 0 0 0 0 0 -1.2292 2.3833 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.3333 1.8667 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.9458 1.9000 0.0000 Cd 0 0 0 0 0 0 0 0 0 0 0 0 1.6458 2.4167 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 2.5417 1.9000 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.3833 -1.3750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1375 -1.0750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6542 -1.3708 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4458 -0.4042 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0750 -0.1042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5917 -0.4042 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9292 -1.3125 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4500 -1.0125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9667 -1.3083 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8667 -0.3417 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3875 -0.0417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9042 -0.3417 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4583 -0.3083 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9792 -0.0083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4958 -0.3083 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 3 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 G 1 0 CdCl2 • \n2\n\S1\S/\s2\s H2O M STY 1 1 SUP M SLB 1 1 1 M SAL 1 15 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 M SAL 1 6 16 17 18 19 20 21 M SMT 1 CdCl2 • \n2\n\S1\S/\s2\s H2O M END > (C) 2008 SIGMA-ALDRICH CO. > 16244158 > MFCD00799071 > 1 > 239208 > S > C3141 > - > - $$$$ 4 2 0 0 0 0 0 0 0 0 1 V2000 0.0016 1.5783 0.0000 Cd 0 0 0 0 0 0 0 0 0 0 0 0 -1.2987 0.8306 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.2987 0.8306 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.9249 -1.5783 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 3 1 0 0 0 0 M END > (C) 2008 SIGMA-ALDRICH CO. > 16244158 > MFCD00149627 > A > 208299 > R > 11709 > - > - $$$$ 6 6 0 0 0 0 0 0 0 0 1 V2000 0.0001 0.0000 0.0000 Mo 0 0 0 0 0 0 0 0 0 0 0 0 -1.4998 0.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0001 1.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4998 0.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0001 -1.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4998 -1.5000 0.0000 Cd 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 3 2 0 0 0 0 1 4 1 0 0 0 0 1 5 1 0 0 0 0 4 6 1 0 0 0 0 5 6 1 0 0 0 0 M END > (C) 2008 SIGMA-ALDRICH CO. > 16244158 > MFCD00015997 > A > 401137 > - > - > - > - $$$$ 7 4 0 0 0 0 0 0 0 0 1 V2000 0.0000 2.7809 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -1.2996 2.0321 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6864 3.9668 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6864 3.9668 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2995 2.0321 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2555 -0.7323 0.0000 Cd 0 0 0 0 0 0 0 0 0 0 0 0 1.2555 -3.9668 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 3 2 0 0 0 0 1 4 2 0 0 0 0 1 5 1 0 0 0 0 M END > (C) 2008 SIGMA-ALDRICH CO. > 16244158 > MFCD00191894 > A > 401374 > - > - > - > - $$$$ 9 6 0 0 0 0 0 0 0 0 1 V2000 -4.1090 -1.2049 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8100 -0.4549 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5110 -1.2049 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 -2.8100 1.0449 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0109 -0.0749 0.0000 Cd 0 2 0 0 0 0 0 0 0 0 0 0 1.6409 -1.2649 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 2.9399 -0.5149 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2389 -1.2649 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9399 0.9849 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 2 4 2 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 9 2 0 0 0 0 M END > (C) 2008 SIGMA-ALDRICH CO. > 16244158 > MFCD00050827 > A > 522481 > - > - > - > - $$$$ 2 1 0 0 0 0 0 0 0 0 1 V2000 5.4633 -3.1729 0.0000 Cd 0 0 0 0 0 0 0 0 0 0 0 0 6.0465 -3.1729 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 M END > (C) 2008 SIGMA-ALDRICH CO. > 16244158 > MFCD00010922 > A > 208183 > F > 20930 > - > - $$$$ 9 6 0 0 0 0 0 0 0 0 1 V2000 0.0417 -1.3542 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 1.0687 -1.3500 0.0000 S 0 0 3 0 0 0 0 0 0 0 0 0 1.8873 -1.3583 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 1.0625 -0.5208 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0709 -2.1375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4167 -0.2292 0.0000 Cd 0 2 0 0 0 0 0 0 0 0 0 0 0.2334 -3.6792 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9478 -3.2667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6623 -3.6792 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2 3 1 0 0 0 0 2 4 2 0 0 0 0 2 5 2 0 0 0 0 1 2 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 M CHG 3 1 -1 3 -1 6 2 M END > (C) 2008 SIGMA-ALDRICH CO. > 16244158 > MFCD00149629 > A > 202924 > - > - > - > - $$$$ 6 6 0 0 0 0 0 0 0 0 1 V2000 -0.0000 -0.0001 0.0000 W 0 0 0 0 0 0 0 0 0 0 0 0 -1.4999 -0.0001 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0000 1.4998 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4999 -0.0001 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0000 -1.4998 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4999 -1.4998 0.0000 Cd 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 3 2 0 0 0 0 1 4 1 0 0 0 0 1 5 1 0 0 0 0 4 6 1 0 0 0 0 5 6 1 0 0 0 0 M END > (C) 2008 SIGMA-ALDRICH CO. > 16244158 > MFCD00016002 > A > 401129 > - > - > - > - $$$$ 2 1 0 0 0 0 0 0 0 0 1 V2000 -0.7500 0.0000 0.0000 Cd 0 0 0 0 0 0 0 0 0 0 0 0 0.7500 0.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 M END > (C) 2008 SIGMA-ALDRICH CO. > 16244158 > MFCD00010921 > A > 202894 > - > - > - > - $$$$ 21 16 0 0 0 0 0 0 0 0 1 V2000 5.7708 -7.0167 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 2.5042 -6.9625 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 3.2167 -7.3750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0625 -7.4292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1750 -6.8042 0.0000 Cd 0 0 0 0 0 0 0 0 0 0 0 0 6.4833 -7.4292 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 1.7917 -7.3750 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 2.5042 -6.1417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7708 -6.1958 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8542 -8.1792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8250 -9.2042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3250 -8.2125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2917 -9.2417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1417 -8.5917 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5375 -9.6167 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6125 -8.6250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5667 -8.5875 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0375 -8.6167 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5792 -9.6542 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1125 -9.6167 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0042 -9.6500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2 3 1 0 0 0 0 3 5 1 0 0 0 0 4 1 1 0 0 0 0 5 4 1 0 0 0 0 6 1 1 0 0 0 0 7 2 1 0 0 0 0 8 2 2 0 0 0 0 9 1 2 0 0 0 0 14 10 1 0 0 0 0 15 11 1 0 0 0 0 16 12 1 0 0 0 0 17 10 1 0 0 0 0 18 12 1 0 0 0 0 19 13 1 0 0 0 0 20 11 1 0 0 0 0 21 13 1 0 0 0 0 M CHG 4 1 1 2 1 6 -1 7 -1 M END > (C) 2008 SIGMA-ALDRICH CO. > 16244158 > MFCD00149626 > A > 229520 > - > - > - > - $$$$ 3 2 0 0 0 0 0 0 0 0 1 V2000 0.2917 -0.0643 0.0000 Cd 0 0 0 0 0 0 0 0 0 0 0 0 -0.1194 0.6477 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 -0.2917 -0.6477 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 1 3 1 0 0 0 M END > (C) 2008 SIGMA-ALDRICH CO. > 16244158 > MFCD00010919 > A > 229512 > - > - > - > - $$$$ 9 6 0 0 0 0 0 0 0 0 1 V2000 -0.8689 -0.1015 0.0000 Cd 0 0 0 0 0 0 0 0 0 0 0 0 -1.6935 -0.1015 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.5873 0.6740 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.2668 -0.8724 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9814 -0.4598 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6935 -0.8709 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1809 0.4598 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8954 0.8724 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6075 0.4612 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2 1 1 0 3 1 1 0 4 5 1 0 5 6 1 0 7 8 1 0 8 9 1 0 M END > (C) 2008 SIGMA-ALDRICH CO. > 16244158 > MFCD00149628 > F > 20906 > R > 11732 > - > - $$$$ 5 3 0 0 0 0 0 0 0 0 1 V2000 4.9260 -3.3104 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 5.6332 -3.0479 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1528 -3.3479 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 5.6332 -2.4500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4195 -3.9042 0.0000 Cd 0 2 0 0 0 0 0 0 0 0 0 0 2 1 1 0 0 0 0 3 2 1 0 0 0 0 2 4 2 0 0 0 0 M CHG 3 1 -1 3 -1 5 2 M END > (C) 2008 SIGMA-ALDRICH CO. > 16244158 > MFCD00010918 > A > 229504 > R > 11706 > - > - $$$$ 6 4 0 0 0 0 0 0 0 0 1 V2000 4.6167 -5.6333 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3292 -5.2208 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0417 -5.6333 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8417 -5.3444 0.0000 Cd 0 0 0 0 0 0 0 0 0 0 0 0 3.5538 -5.7556 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 2.1296 -5.7556 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 G 4 0 CdBr2 M STY 1 1 SUP M SLB 1 1 1 M SAL 1 3 4 5 6 M SMT 1 CdBr2 M END > (C) 2008 SIGMA-ALDRICH CO. > 16244158 > MFCD00150204 > A > 336718 > - > - > - > - $$$$ 15 12 0 0 0 0 0 0 0 0 1 V2000 -0.9208 0.6792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9208 0.0792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4042 -0.2167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4399 -0.2218 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1104 0.0829 0.0000 Cd 0 0 0 0 0 0 0 0 0 0 0 0 0.6270 -0.2130 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1416 0.0866 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6582 -0.2093 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1394 0.6819 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4917 -0.2083 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0083 0.0917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5292 -0.2042 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4292 0.7625 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9458 1.0625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4667 0.7625 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7 8 1 0 0 0 0 2 4 1 0 0 0 0 7 9 2 0 0 0 0 3 5 1 0 0 0 0 1 2 2 0 0 0 0 5 6 1 0 0 0 0 2 3 1 0 0 0 0 6 7 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 G 10 0 • \n2\nH2O M STY 1 1 SUP M SLB 1 1 1 M SAL 1 6 10 11 12 13 14 15 M SMT 1 • \n2\nH2O M END > (C) 2008 SIGMA-ALDRICH CO. > 16244158 > MFCD00150020 > 1 > 289159 > F > 20904 > R > 25028 $$$$ 1 0 0 0 0 0 0 0 0 0 1 V2000 0.0000 0.0000 0.0000 Cd 0 0 0 0 0 0 0 0 0 0 0 0 M END > (C) 2008 SIGMA-ALDRICH CO. > 16244158 > MFCD00010914 > A > 265330 > F > 00623 > - > - $$$$ 3 2 0 0 0 0 0 0 0 0 1 V2000 0.0016 0.3738 0.0000 Cd 0 0 0 0 0 0 0 0 0 0 0 0 -1.2987 -0.3738 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 1.2987 -0.3738 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 3 1 0 0 0 0 M END > (C) 2008 SIGMA-ALDRICH CO. > 16244158 > MFCD00015996 > A > 413623 > - > - > - > - $$$$ 42 28 0 0 0 0 0 0 0 0 1 V2000 0.0292 -1.3584 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 1.0562 -1.3542 0.0000 S 0 0 3 0 0 0 0 0 0 0 0 0 1.8748 -1.3625 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 1.0500 -0.5250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0584 -2.1417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5625 -1.3667 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 4.5895 -1.3625 0.0000 S 0 0 3 0 0 0 0 0 0 0 0 0 5.4081 -1.3709 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 4.5834 -0.5334 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5917 -2.1500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1250 -1.4292 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 8.1520 -1.4250 0.0000 S 0 0 3 0 0 0 0 0 0 0 0 0 8.9706 -1.4334 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 8.1459 -0.5959 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.1542 -2.2125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.4917 -0.3917 0.0000 Cd 0 2 0 0 0 0 0 0 0 0 0 0 6.0875 -0.3292 0.0000 Cd 0 2 0 0 0 0 0 0 0 0 0 0 2.4042 -0.2334 0.0000 Cd 0 2 0 0 0 0 0 0 0 0 0 0 8.5917 -3.6209 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3062 -3.2084 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.0206 -3.6209 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5000 -3.7125 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2145 -3.3000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9290 -3.7125 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8750 -3.7459 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5895 -3.3334 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3040 -3.7459 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2209 -3.6834 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9353 -3.2709 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6498 -3.6834 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2209 -5.0250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9353 -4.6125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6498 -5.0250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8750 -5.1500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5895 -4.7375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3040 -5.1500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4042 -5.0584 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1187 -4.6459 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8331 -5.0584 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5959 -4.9834 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3103 -4.5709 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.0248 -4.9834 0.0000 H 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 19 20 1 0 0 0 0 20 21 1 0 0 0 0 2 4 2 0 0 0 0 2 5 2 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 7 9 2 0 0 0 0 7 10 2 0 0 0 0 31 32 1 0 0 0 0 32 33 1 0 0 0 0 34 35 1 0 0 0 0 35 36 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 37 38 1 0 0 0 0 38 39 1 0 0 0 0 12 14 2 0 0 0 0 12 15 2 0 0 0 0 40 41 1 0 0 0 0 41 42 1 0 0 0 0 M CHG 8 1 -1 3 -1 6 -1 8 -1 11 -1 13 -1 16 2 17 2 M CHG 1 18 2 M END > (C) 2008 SIGMA-ALDRICH CO. > 16244158 > MFCD02253000 > 1 > 255513 > R > 11720 > - > - $$$$ 3 2 0 0 0 0 0 0 0 0 1 V2000 0.0002 0.0000 0.0000 Cd 0 0 0 0 0 0 0 0 0 0 0 0 -1.2988 0.7500 0.0000 I 0 0 0 0 0 0 0 0 0 0 0 0 1.2992 0.7499 0.0000 I 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 3 1 0 0 0 0 M END > (C) 2008 SIGMA-ALDRICH CO. > 16244158 > MFCD00010920 > A > 202916 > - > - > - > - $$$$