10 9 0 0 0 0 0 0 0 0 1 V2000 -2.6453 0.0007 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6453 -0.8243 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9309 -1.2368 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2164 -0.8243 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2164 0.0007 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9309 0.4132 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5044 0.4118 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5044 1.2368 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2101 -0.0007 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6453 0.1898 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 2 3 1 0 0 0 3 4 2 0 0 0 4 5 1 0 0 0 5 6 2 0 0 0 6 1 1 0 0 0 5 7 1 0 0 0 7 8 2 0 0 0 7 9 1 0 0 0 M END > (C) 2008 SIGMA-ALDRICH CO. > F______82785 > FLUKA > 82785 > - > - > - > - > 16263288 $$$$ 8 8 0 0 0 0 0 0 0 0 1 V2000 0.0067 0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7111 0.4183 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7178 -0.4067 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0067 -0.8250 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7111 -0.4183 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7178 0.4067 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4331 0.8119 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -1.4331 -0.8119 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 2 3 1 0 3 4 2 0 4 5 1 0 5 6 2 0 6 1 1 0 6 7 1 0 3 8 1 0 M END > (C) 2008 SIGMA-ALDRICH CO. > MFCD00006466 > ALDRICH > D73200 > FLUKA > 17255 > - > - > 16263288 $$$$ 10 11 0 0 0 0 0 0 0 0 1 V2000 -1.4289 0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4289 -0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7145 -0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0000 -0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0000 0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7145 0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7145 -0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4289 -0.4125 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4289 0.4125 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7145 0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 2 3 1 0 3 4 2 0 4 5 1 0 5 6 2 0 6 1 1 0 4 7 1 0 7 8 2 0 8 9 1 0 9 10 2 0 10 5 1 0 M END > (C) 2008 SIGMA-ALDRICH CO. > MFCD00006908 > ALDRICH > P38706 > - > - > - > - > 16263288 $$$$ 9 9 0 0 0 0 0 0 0 0 1 V2000 -0.3572 0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3572 -0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3572 -0.8250 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0717 -0.4125 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0717 0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3572 0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7837 0.8236 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -1.0692 -0.8236 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7837 -0.4111 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 2 3 1 0 3 4 2 0 4 5 1 0 5 6 2 0 6 1 1 0 5 7 1 0 2 8 1 0 8 9 1 0 M END > (C) 2008 SIGMA-ALDRICH CO. > MFCD00006467 > ALDRICH > 108596 > - > - > - > - > 16263288 $$$$ 9 9 0 0 0 1 V2000 0.0034 -0.7931 0.0000 C 0 0 0 0 0 0 0 0 0 1.2310 -0.0862 0.0000 C 0 0 0 0 0 0 0 0 0 -1.2379 -0.0862 0.0000 C 0 0 0 0 0 0 0 0 0 0.0034 -2.2310 0.0000 Cl 0 0 0 0 0 0 0 0 0 1.2310 1.3517 0.0000 C 0 0 0 0 0 0 0 0 0 2.4828 -0.7931 0.0000 Cl 0 0 0 0 0 0 0 0 0 -1.2379 1.3517 0.0000 N 0 0 0 0 0 0 0 0 0 -2.4897 -0.7931 0.0000 O 0 0 0 0 0 0 0 0 0 0.0034 2.0690 0.0000 N 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 1 3 1 0 0 0 1 4 1 0 0 0 2 5 1 0 0 0 2 6 1 0 0 0 3 7 1 0 0 0 3 8 2 0 0 0 5 9 2 0 0 0 7 9 1 0 0 0 M END > (C) 2008 SIGMA-ALDRICH CO. > MFCD00051504 > ALDRICH > 303097 > - > - > - > - > 16263288 $$$$ 7 7 0 0 0 0 0 0 0 0 1 V2000 6.2580 -2.4172 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2580 -3.0172 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.7384 -3.3172 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 5.2188 -3.0172 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2188 -2.4172 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7384 -2.1172 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7384 -4.1964 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 3 7 1 0 0 0 0 M CHG 2 3 1 7 -1 M END > (C) 2008 SIGMA-ALDRICH CO. > MFCD05742416 > ALDRICH > 687642 > - > - > - > - > 16263288 $$$$ 19 21 0 0 0 0 0 0 0 0 1 V2000 -1.4289 1.5462 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4289 0.7212 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7145 0.3087 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0000 0.7212 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0000 1.5462 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7145 1.9587 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7145 0.3087 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4289 0.7212 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4289 1.5462 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7145 1.9587 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7145 -0.5135 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0000 -0.9260 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0000 -1.7510 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7145 -2.1635 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4289 -1.7510 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4289 -0.9260 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7145 2.7808 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3597 -2.3697 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0717 -2.7808 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 2 3 1 0 0 0 3 4 2 0 0 0 4 5 1 0 0 0 5 6 2 0 0 0 6 1 1 0 0 0 4 7 1 0 0 0 7 8 2 0 0 0 8 9 1 0 0 0 9 10 1 0 0 0 10 5 1 0 0 0 7 11 1 0 0 0 11 12 2 0 0 0 12 13 1 0 0 0 13 14 2 0 0 0 14 15 1 0 0 0 15 16 2 0 0 0 16 11 1 0 0 0 10 17 2 0 0 0 14 18 1 0 0 0 18 19 1 0 0 0 M STY 1 1 SUP M SLB 1 1 1 M SAL 1 2 18 19 M SBL 1 1 20 M SMT 1 OCH3 M SBV 1 20 -2.8095 3.8493 M END > (C) 2008 SIGMA-ALDRICH CO. > MFCD02660689 > ALDRICH > 548839 > - > - > - > - > 16263288 $$$$ 7 7 0 0 0 0 0 0 0 0 1 V2000 0.4125 -0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -0.7145 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8250 -0.7145 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2375 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8250 0.7145 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 0.7145 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2375 -0.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 2 0 3 4 1 0 4 5 2 0 5 6 1 0 1 6 1 0 1 7 2 0 M END > (C) 2008 SIGMA-ALDRICH CO. > MFCD00099605 > FLUKA > 82685 > - > - > - > - > 16263288 $$$$ 15 16 0 0 0 0 0 0 0 0 1 V2000 0.3560 0.0014 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3560 -0.8236 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0705 0.4139 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0705 1.2389 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3560 1.6514 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3585 1.2389 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3585 0.4139 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3585 -1.2361 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3585 -2.0611 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3560 -2.4736 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0705 -2.0611 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0705 -1.2361 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0705 0.0029 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0705 1.6500 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.3560 2.4736 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 1 3 1 0 3 4 2 0 4 5 1 0 5 6 2 0 6 7 1 0 7 1 1 0 2 8 1 0 8 9 2 0 9 10 1 0 10 11 2 0 11 12 1 0 12 2 2 0 7 13 2 0 6 14 1 0 5 15 1 0 M END > (C) 2008 SIGMA-ALDRICH CO. > MFCD00006470 > ALDRICH > 176842 > - > - > - > - > 16263288 $$$$ 13 14 0 0 0 0 0 0 0 0 1 V2000 -1.2226 0.9147 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2226 0.0897 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5082 -0.3228 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2063 0.0897 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2063 0.9147 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5082 1.3272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9909 -0.1652 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4758 0.5022 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9909 1.1697 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.9346 -0.3213 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.2226 -0.9162 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 1.9346 -1.3272 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5107 -1.3272 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 2 3 2 0 0 0 3 4 1 0 0 0 4 5 1 0 0 0 5 6 1 0 0 0 6 1 2 0 0 0 4 7 1 0 0 0 7 8 2 0 0 0 8 9 1 0 0 0 9 5 2 0 0 0 2 10 1 0 0 0 7 11 1 0 0 0 11 12 2 0 0 0 11 13 1 0 0 0 M STY 1 1 SUP M SLB 1 1 1 M SAL 1 3 11 12 13 M SBL 1 1 12 M SMT 1 NO2 M SBV 1 12 -4.6378 4.7734 M END > (C) 2008 SIGMA-ALDRICH CO. > MFCD08276991 > FLUKA > 17256 > - > - > - > - > 16263288 $$$$ 8 8 0 0 0 0 0 0 0 0 1 V2000 -0.7145 0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7145 -0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -0.8250 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7145 -0.4125 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7145 0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4265 0.8236 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4265 -0.8236 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 2 3 1 0 0 0 3 4 2 0 0 0 4 5 1 0 0 0 5 6 2 0 0 0 6 1 1 0 0 0 5 7 1 0 0 0 2 8 1 0 0 0 M END > (C) 2008 SIGMA-ALDRICH CO. > MFCD00051506 > FLUKA > 17745 > - > - > - > - > 16263288 $$$$ 8 8 0 0 0 0 0 0 0 0 1 V2000 -0.7157 0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7157 -0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0012 -0.8250 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7132 -0.4125 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7132 0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0012 0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4277 0.8250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4277 -0.8236 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 2 3 1 0 3 4 2 0 4 5 1 0 5 6 2 0 6 1 1 0 7 5 1 0 2 8 1 0 M END > (C) 2008 SIGMA-ALDRICH CO. > MFCD00006665 > ALDRICH > D119806 > - > - > - > - > 16263288 $$$$ 9 9 0 0 0 0 0 0 0 0 1 V2000 5.2200 -3.4688 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2200 -4.0687 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7396 -4.3687 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.2592 -4.0687 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.2592 -3.4688 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7396 -3.1688 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7770 -3.1698 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7022 -4.3677 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7396 -2.5708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 5 7 1 0 0 0 0 2 8 1 0 0 0 0 6 9 1 0 0 0 0 M END > (C) 2008 SIGMA-ALDRICH CO. > MFCD00067746 > ALDRICH > 668141 > - > - > - > - > 16263288 $$$$ 13 14 0 0 0 0 0 0 0 0 1 V2000 -1.4289 -0.2063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4289 -1.0313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7145 -1.4438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -1.0313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -0.2063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7145 0.2063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7145 -1.4438 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4289 -1.0313 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4289 -0.2063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7145 0.2063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7145 1.0313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 1.4438 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4289 1.4438 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 2 3 1 0 3 4 2 0 4 5 1 0 5 6 2 0 6 1 1 0 4 7 1 0 7 8 2 0 8 9 1 0 9 10 2 0 10 5 1 0 10 11 1 0 11 12 2 0 11 13 1 0 M END > (C) 2008 SIGMA-ALDRICH CO. > MFCD00006813 > ALDRICH > C82159 > - > - > - > - > 16263288 $$$$ 14 15 0 0 0 0 0 0 0 0 1 V2000 0.0000 0.2055 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7145 -0.2070 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4289 0.2055 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4289 1.0305 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7145 1.4430 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 1.0305 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1409 1.4416 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7120 -0.2055 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4265 0.2070 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1409 -0.2055 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1409 -1.0305 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4265 -1.4430 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7120 -1.0305 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -1.4416 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 2 3 1 0 3 4 1 0 4 5 1 0 5 6 2 0 6 1 1 0 4 7 2 0 1 8 1 0 8 9 2 0 9 10 1 0 10 11 2 0 11 12 1 0 12 13 2 0 13 8 1 0 13 14 1 0 M END > (C) 2008 SIGMA-ALDRICH CO. > MFCD07369768 > ALDRICH > 653578 > - > - > - > - > 16263288 $$$$ 6 6 0 0 0 0 0 0 0 0 1 V2000 -0.7145 0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7145 -0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -0.8250 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7145 -0.4125 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7145 0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 2 3 1 0 3 4 2 0 4 5 1 0 5 6 2 0 6 1 1 0 M END > (C) 2008 SIGMA-ALDRICH CO. > MFCD00006463 > ALDRICH > P57204 > FLUKA > 82680 > - > - > 16263288 $$$$ 7 7 0 0 0 0 0 0 0 0 1 V2000 -0.7145 0.0014 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7145 -0.8236 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -1.2361 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7145 -0.8236 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7145 0.0014 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 0.4139 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 1.2361 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 2 3 1 0 3 4 2 0 4 5 1 0 5 6 2 0 6 1 1 0 6 7 1 0 M END > (C) 2008 SIGMA-ALDRICH CO. > MFCD00011594 > ALDRICH > 297771 > - > - > - > - > 16263288 $$$$ 10 10 0 0 0 0 0 0 0 0 1 V2000 -0.3585 0.4139 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3585 -0.4111 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3560 -0.8236 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0705 -0.4111 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0705 0.4139 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3560 0.8264 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0705 -0.8221 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0705 0.8250 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.3560 1.6486 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.3560 -1.6486 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 1 0 4 5 2 0 5 6 1 0 6 1 2 0 2 7 2 0 1 8 1 0 6 9 1 0 3 10 1 0 M END > (C) 2008 SIGMA-ALDRICH CO. > MFCD00051686 > ALDRICH > 597716 > - > - > - > - > 16263288 $$$$ 11 12 0 0 0 0 0 0 0 0 1 V2000 -1.4289 0.8236 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4289 -0.0014 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7145 -0.4139 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0000 -0.0014 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0000 0.8236 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7145 1.2361 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7145 -0.4139 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4289 -0.0014 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4289 0.8236 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7145 1.2361 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7145 -1.2361 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 2 3 1 0 3 4 2 0 4 5 1 0 5 6 2 0 6 1 1 0 4 7 1 0 7 8 1 0 8 9 1 0 9 10 2 0 10 5 1 0 7 11 2 0 M END > (C) 2008 SIGMA-ALDRICH CO. > MFCD00006892 > ALDRICH > P39001 > - > - > - > - > 16263288 $$$$ 12 13 0 0 0 0 0 0 0 0 1 V2000 -1.4289 0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4289 -0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7145 -0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0000 -0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0000 0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7145 0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7145 -0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4289 -0.4125 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4289 0.4125 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7145 0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7145 1.6471 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.7145 -1.6471 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 2 3 1 0 3 4 2 0 4 5 1 0 5 6 2 0 6 1 1 0 4 7 1 0 7 8 2 0 8 9 1 0 9 10 2 0 10 5 1 0 10 11 1 0 7 12 1 0 M END > (C) 2008 SIGMA-ALDRICH CO. > MFCD00006909 > ALDRICH > 126020 > - > - > - > - > 16263288 $$$$ 14 15 0 0 0 0 0 0 0 0 1 V2000 0.3560 1.0305 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3560 0.2055 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0705 -0.2070 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.7849 0.2055 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.7849 1.0305 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0705 1.4430 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4969 1.4416 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3560 -0.2055 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0705 0.2070 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7849 -0.2055 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7849 -1.0305 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0705 -1.4430 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3560 -1.0305 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4969 -1.4416 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 2 3 2 0 0 0 3 4 1 0 0 0 4 5 1 0 0 0 5 6 1 0 0 0 6 1 1 0 0 0 5 7 2 0 0 0 2 8 1 0 0 0 8 9 2 0 0 0 9 10 1 0 0 0 10 11 2 0 0 0 11 12 1 0 0 0 12 13 2 0 0 0 13 8 1 0 0 0 11 14 1 0 0 0 M END > (C) 2008 SIGMA-ALDRICH CO. > MFCD00203490 > ALDRICH > 546305 > - > - > - > - > 16263288 $$$$ 18 20 0 0 0 0 0 0 0 0 1 V2000 -1.4289 1.6486 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4289 0.8236 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7145 0.4111 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0000 0.8236 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0000 1.6486 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7145 2.0611 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7145 0.4111 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4289 0.8236 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4289 1.6486 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7145 2.0611 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7145 2.8832 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7145 -0.4111 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0000 -0.8236 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0000 -1.6486 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7145 -2.0611 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4289 -1.6486 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4289 -0.8236 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7145 -2.8832 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 2 3 1 0 0 0 3 4 2 0 0 0 4 5 1 0 0 0 5 6 2 0 0 0 6 1 1 0 0 0 4 7 1 0 0 0 7 8 2 0 0 0 8 9 1 0 0 0 9 10 1 0 0 0 10 5 1 0 0 0 10 11 2 0 0 0 7 12 1 0 0 0 12 13 2 0 0 0 13 14 1 0 0 0 14 15 2 0 0 0 15 16 1 0 0 0 16 17 2 0 0 0 17 12 1 0 0 0 15 18 1 0 0 0 M END > (C) 2008 SIGMA-ALDRICH CO. > MFCD02660631 > ALDRICH > 534234 > - > - > - > - > 16263288 $$$$ 8 8 0 0 0 0 0 0 0 0 1 V2000 -0.7145 0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7145 -0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -0.8250 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7145 -0.4125 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7145 0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4265 0.8236 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -1.4265 -0.8236 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 2 3 1 0 0 0 3 4 2 0 0 0 4 5 1 0 0 0 5 6 2 0 0 0 6 1 1 0 0 0 5 7 1 0 0 0 2 8 1 0 0 0 M END > (C) 2008 SIGMA-ALDRICH CO. > MFCD00052905 > ALDRICH > 637637 > - > - > - > - > 16263288 $$$$ 18 20 0 0 0 0 0 0 0 0 1 V2000 -0.6187 0.3572 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2062 -0.3572 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6187 -1.0717 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4437 -1.0717 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8563 -0.3572 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6812 -0.3572 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0938 0.3572 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6812 1.0717 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8563 1.0717 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4437 0.3572 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2062 1.0717 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6187 -0.3572 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0313 0.3572 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8563 0.3572 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2688 -0.3572 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8563 -1.0717 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0313 -1.0717 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0938 -0.3572 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 2 0 4 5 1 0 5 6 1 0 6 7 2 0 7 8 1 0 8 9 2 0 9 10 1 0 1 10 1 0 5 10 2 0 1 11 2 0 12 13 1 0 13 14 2 0 14 15 1 0 15 16 2 0 16 17 1 0 12 17 2 0 15 18 1 0 2 12 1 0 M END > (C) 2008 SIGMA-ALDRICH CO. > MFCD02683505 > ALDRICH > 528080 > - > - > - > - > 16263288 $$$$ 13 14 0 0 0 0 0 0 0 0 1 V2000 -2.1409 -0.2055 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1409 -1.0305 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4265 -1.4430 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7120 -1.0305 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7120 -0.2055 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4265 0.2070 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 0.2055 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7145 -0.2070 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4289 0.2055 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4289 1.0305 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7145 1.4430 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 1.0305 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1409 1.4416 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 2 3 1 0 3 4 2 0 4 5 1 0 5 6 2 0 6 1 1 0 5 7 1 0 7 8 2 0 8 9 1 0 9 10 1 0 10 11 1 0 11 12 1 0 12 7 1 0 10 13 2 0 M END > (C) 2008 SIGMA-ALDRICH CO. > MFCD00099597 > ALDRICH > 510599 > - > - > - > - > 16263288 $$$$ 13 14 0 0 0 0 0 0 0 0 1 V2000 -2.1434 -0.2063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1434 -1.0313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4289 -1.4438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7145 -1.0313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7145 -0.2063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4289 0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 0.2063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7145 -0.2062 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4289 0.2063 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4289 1.0313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7145 1.4437 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 1.0313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1434 1.4438 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 2 3 1 0 3 4 2 0 4 5 1 0 5 6 2 0 6 1 1 0 5 7 1 0 7 8 2 0 8 9 1 0 9 10 2 0 10 11 1 0 11 12 2 0 12 7 1 0 10 13 1 0 M END > (C) 2008 SIGMA-ALDRICH CO. > MFCD00075253 > ALDRICH > 342319 > - > - > - > - > 16263288 $$$$ 13 14 0 0 0 0 0 0 0 0 1 V2000 1.4289 0.2055 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4289 1.0305 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7145 1.4430 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 1.0305 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 0.2055 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7145 -0.2070 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7120 -0.2055 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7120 -1.0305 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4265 -1.4430 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1409 -1.0305 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1409 -0.2055 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4265 0.2070 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1409 1.4416 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 3 4 2 0 4 5 1 0 5 6 2 0 6 1 1 0 2 3 1 0 5 7 1 0 7 8 2 0 8 9 1 0 9 10 2 0 10 11 1 0 11 12 2 0 12 7 1 0 2 13 2 0 M END > (C) 2008 SIGMA-ALDRICH CO. > MFCD00114953 > ALDRICH > 510602 > - > - > - > - > 16263288 $$$$ 11 11 0 0 0 0 0 0 0 0 1 V2000 -0.7145 -0.2041 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7145 -1.0291 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -1.4416 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7145 -1.0291 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7145 -0.2041 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 0.2084 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4265 0.2070 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -1.4265 -1.4402 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 1.0305 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7120 1.4416 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7120 1.4416 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 2 3 1 0 3 4 2 0 4 5 1 0 5 6 2 0 6 1 1 0 5 7 1 0 2 8 1 0 6 9 1 0 9 10 2 0 9 11 1 0 M END > (C) 2008 SIGMA-ALDRICH CO. > MFCD00011575 > ALDRICH > 297755 > - > - > - > - > 16263288 $$$$ 18 20 0 0 0 1 V2000 -1.0345 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0.1276 0.6724 0.0000 C 0 0 0 0 0 0 0 0 0 -2.2000 0.6724 0.0000 C 0 0 0 0 0 0 0 0 0 -1.0345 -1.3448 0.0000 C 0 0 0 0 0 0 0 0 0 1.2966 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0.1276 2.0138 0.0000 N 0 0 0 0 0 0 0 0 0 -2.2000 2.0138 0.0000 C 0 0 0 0 0 0 0 0 0 -3.3621 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 -2.2000 -2.0172 0.0000 C 0 0 0 0 0 0 0 0 0 1.2966 -1.3448 0.0000 C 0 0 0 0 0 0 0 0 0 2.4621 0.6724 0.0000 C 0 0 0 0 0 0 0 0 0 -1.0345 2.6897 0.0000 N 0 0 0 0 0 0 0 0 0 -3.3621 2.6897 0.0000 O 0 0 0 0 0 0 0 0 0 -3.3621 -1.3448 0.0000 C 0 0 0 0 0 0 0 0 0 2.4621 -2.0172 0.0000 C 0 0 0 0 0 0 0 0 0 3.6241 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 3.6241 -1.3448 0.0000 C 0 0 0 0 0 0 0 0 0 4.7897 -2.0172 0.0000 Cl 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 1 3 1 0 0 0 1 4 2 0 0 0 2 5 1 0 0 0 2 6 2 0 0 0 3 7 1 0 0 0 3 8 2 0 0 0 4 9 1 0 0 0 5 10 1 0 0 0 5 11 2 0 0 0 6 12 1 0 0 0 7 13 2 0 0 0 8 14 1 0 0 0 10 15 2 0 0 0 11 16 1 0 0 0 15 17 1 0 0 0 17 18 1 0 0 0 7 12 1 0 0 0 9 14 2 0 0 0 16 17 2 0 0 0 M END > (C) 2008 SIGMA-ALDRICH CO. > MFCD00098133 > ALDRICH > 548820 > - > - > - > - > 16263288 $$$$ 9 9 0 0 0 0 0 0 0 0 1 V2000 -0.7145 -0.2042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7145 -1.0292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -1.4417 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7145 -1.0292 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7145 -0.2042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 0.2083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 1.0306 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7121 1.4417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7121 1.4417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 2 3 1 0 3 4 2 0 4 5 1 0 5 6 2 0 6 1 1 0 6 7 1 0 7 8 2 0 7 9 1 0 M END > (C) 2008 SIGMA-ALDRICH CO. > MFCD00011576 > ALDRICH > 297763 > - > - > - > - > 16263288 $$$$ 7 7 0 0 0 0 0 0 0 0 1 V2000 -1.0717 0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0717 -0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3572 -0.8250 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3572 -0.4125 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3572 0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3572 0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0717 0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 2 3 1 0 3 4 2 0 4 5 1 0 5 6 2 0 6 1 1 0 5 7 1 0 M END > (C) 2008 SIGMA-ALDRICH CO. > MFCD00006469 > ALDRICH > 107239 > - > - > - > - > 16263288 $$$$ 9 9 0 0 0 0 0 0 0 0 1 V2000 -0.7145 0.0014 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7145 -0.8236 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -1.2361 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7145 -0.8236 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7145 0.0014 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 0.4139 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4265 -1.2346 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 1.2361 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4265 0.4125 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 2 0 3 4 1 0 4 5 2 0 5 6 1 0 6 1 2 0 2 7 1 0 6 8 1 0 5 9 1 0 M END > (C) 2008 SIGMA-ALDRICH CO. > MFCD00006465 > ALDRICH > 297747 > - > - > - > - > 16263288 $$$$ 17 19 0 0 0 0 0 0 0 0 1 V2000 1.4289 0.4125 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4289 1.2375 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7145 1.6500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0000 1.2375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0000 0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7145 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7145 1.6500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4289 1.2375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4289 0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7145 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7145 -0.8221 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0000 -1.2346 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0000 -2.0596 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7145 -2.4721 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4289 -2.0596 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4289 -1.2346 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7145 2.4721 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 1 0 4 5 2 0 5 6 1 0 6 1 2 0 4 7 1 0 7 8 2 0 8 9 1 0 9 10 2 0 10 5 1 0 6 11 1 0 11 12 2 0 12 13 1 0 13 14 2 0 14 15 1 0 15 16 2 0 16 11 1 0 3 17 2 0 M END > (C) 2008 SIGMA-ALDRICH CO. > MFCD00098272 > ALDRICH > 525553 > - > - > - > - > 16263288 $$$$