34 37 0 0 1 0 0 0 0 0 1 V2000 0.6311 0.6572 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2186 1.3717 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6311 2.0850 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2186 2.8013 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4563 2.0850 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6666 0.6239 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2813 2.0850 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6938 1.3746 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5132 1.3746 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9228 2.0850 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5132 2.7927 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6938 2.7927 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2842 3.5090 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 3.9257 3.5090 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 4.7480 2.0850 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 3.9257 0.6613 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 2.2813 0.6584 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 -3.2459 -2.6260 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4417 -2.7970 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0307 -2.0850 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5808 -1.4740 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3318 -1.8084 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0829 -1.4740 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7480 -1.9573 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6621 -2.7749 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9110 -3.1093 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0307 -3.5090 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2085 -3.5090 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7975 -2.7970 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2085 -2.0850 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4099 -0.6699 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6280 -0.4158 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4570 0.3884 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0680 0.9385 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 2 3 1 0 0 0 3 4 2 0 0 0 3 5 1 0 0 0 7 5 1 0 0 0 7 8 2 0 0 0 8 9 1 0 0 0 9 10 2 0 0 0 10 11 1 0 0 0 11 12 2 0 0 0 7 12 1 0 0 0 12 13 1 0 0 0 11 14 1 0 0 0 10 15 1 0 0 0 9 16 1 0 0 0 8 17 1 0 0 0 2 6 1 1 0 0 6 33 1 0 0 0 18 19 1 0 0 0 19 20 2 0 0 0 20 21 1 0 0 0 21 22 1 0 0 0 18 22 2 0 0 0 22 23 1 0 0 0 23 24 2 0 0 0 24 25 1 0 0 0 25 26 2 0 0 0 18 26 1 0 0 0 19 27 1 0 0 0 27 28 2 0 0 0 28 29 1 0 0 0 29 30 2 0 0 0 20 30 1 0 0 0 21 31 1 0 0 0 31 32 1 0 0 0 32 33 1 0 0 0 33 34 2 0 0 0 M STY 1 1 SUP M SLB 1 1 1 M SAL 1 15 18 19 20 21 22 23 24 25 26 27 28 29 30 31 32 M SAL 1 2 33 34 M SBL 1 1 18 M SMT 1 ^Fmoc M SBV 1 18 -6.9995 6.2765 M END > (C) 2008 SIGMA-ALDRICH CO. > 16255240 > MFCD00153372 > F > 80061 > - > - > - > - $$$$ 25 25 0 0 1 0 0 0 0 0 1 V2000 3.2750 -6.1542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9875 -5.7417 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4833 -5.7375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7500 -6.1167 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.2750 -6.9792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5208 -4.9125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.3917 -7.1417 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1292 -5.7417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4125 -6.1542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5542 -5.7417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1750 -6.1833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.1042 -6.7292 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 8.6792 -6.7292 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.8417 -6.1542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7125 -6.9375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9625 -7.1417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6792 -5.9042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1042 -5.9042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8167 -7.1417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9625 -5.4917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8167 -5.4917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5292 -6.7292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2500 -6.7292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2500 -5.9042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5292 -5.9042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2 1 1 0 0 0 0 3 4 1 0 0 0 0 4 2 1 6 0 0 0 5 1 2 0 0 0 0 6 3 2 0 0 0 0 8 14 1 0 0 0 0 9 8 2 0 0 0 0 10 1 1 0 0 0 0 11 3 1 0 0 0 0 12 7 1 0 0 0 0 13 7 1 0 0 0 0 14 10 1 0 0 0 0 15 4 1 0 0 0 0 16 13 1 0 0 0 0 17 13 1 0 0 0 0 18 12 1 0 0 0 0 19 12 1 0 0 0 0 20 17 1 0 0 0 0 21 18 1 0 0 0 0 22 19 1 0 0 0 0 23 16 1 0 0 0 0 24 20 1 0 0 0 0 25 22 1 0 0 0 0 23 24 1 0 0 0 0 21 25 1 0 0 0 0 M END > (C) 2008 SIGMA-ALDRICH CO. > 16255240 > MFCD02259515 > F > 14829 > - > - > - > - $$$$ 10 8 0 0 1 0 0 0 0 0 1 V2000 3.8360 -6.5317 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5505 -6.1192 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.2650 -6.5317 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9794 -6.1192 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5195 -5.1837 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2650 -7.3538 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9794 -7.7663 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6939 -7.3538 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6083 -6.6167 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4333 -6.6167 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 2 1 1 0 0 0 0 3 2 1 0 0 0 0 4 3 2 0 0 0 0 3 6 1 0 0 0 0 2 5 1 6 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 9 10 1 0 0 0 0 M END > (C) 2008 SIGMA-ALDRICH CO. > 16255240 > MFCD00063662 > A > 855669 > F > 05170 > - > - $$$$ 6 5 0 0 1 0 0 0 0 0 1 V2000 -1.0692 0.2070 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3548 -0.2055 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3572 0.2055 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0692 -0.2055 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3572 1.0277 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3548 -1.0277 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 2 3 1 0 0 0 3 4 1 0 0 0 3 5 2 0 0 0 2 6 1 6 0 0 M END > (C) 2008 SIGMA-ALDRICH CO. > 16255240 > MFCD00008077 > F > 05140 > S > A7377 > - > - $$$$ 16 16 0 0 1 0 0 0 0 0 1 V2000 3.6170 -7.8149 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3315 -7.4024 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.0460 -7.8149 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7605 -7.4024 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7440 -6.6879 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7523 -5.8337 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4668 -5.4212 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1812 -5.8337 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0403 -5.4227 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8957 -5.4212 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6102 -5.8337 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3247 -5.4212 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3247 -4.5962 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6102 -4.1837 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8957 -4.5962 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0460 -8.6371 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2 1 1 0 0 0 0 3 2 1 0 0 0 0 4 3 1 0 0 0 0 2 5 1 6 0 0 0 5 6 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 6 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 15 10 1 0 0 0 0 3 16 2 0 0 0 0 M END > (C) 2008 SIGMA-ALDRICH CO. > 16255240 > MFCD00002640 > A > 156892 > F > 95850 > - > - $$$$ 26 27 0 0 1 0 0 0 0 0 1 V2000 0.1419 0.2178 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8563 0.6303 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5683 0.2192 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2465 0.2779 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5320 0.6904 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8199 0.2793 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9610 0.6904 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2465 -0.5471 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5320 1.5126 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9027 -0.2705 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4917 0.4415 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6875 0.2705 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6016 -0.5471 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3526 -0.8815 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6067 -1.6634 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4108 -1.8343 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9610 -1.2234 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7069 -0.4415 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7457 1.2234 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1956 1.8343 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3914 1.6634 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1374 0.8815 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1104 -0.9582 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8224 -0.5471 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5344 -0.9582 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4914 -1.7792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 4 5 1 0 5 6 1 0 7 4 1 0 4 8 1 1 5 9 2 0 8 25 1 0 10 11 1 0 11 12 2 0 12 13 1 0 13 14 1 0 10 14 2 0 14 15 1 0 15 16 2 0 16 17 1 0 17 18 2 0 10 18 1 0 11 19 1 0 19 20 2 0 20 21 1 0 21 22 2 0 12 22 1 0 13 23 1 0 23 24 1 0 24 25 1 0 25 26 2 0 M STY 1 1 SUP M SLB 1 1 1 M SAL 1 3 1 2 3 M SMT 1 • H2O M STY 1 2 SUP M SLB 1 2 2 M SAL 2 15 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 M SAL 2 2 25 26 M SBL 2 1 8 M SMT 2 Fmoc M SBV 2 8 -0.7121 0.4111 M END > (C) 2008 SIGMA-ALDRICH CO. > 16255240 > MFCD00150487 > A > 338311 > - > - > - > - $$$$ 9 7 0 0 1 0 0 0 0 0 1 V2000 9.3333 -6.3417 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 8.5083 -6.3375 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4148 -5.8078 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1293 -5.3953 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.8437 -5.8078 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1084 -4.5911 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.8437 -6.6299 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7374 -5.2495 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4494 -5.6606 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4 3 1 0 0 0 0 5 4 1 0 0 0 0 5 7 2 0 0 0 0 4 6 1 1 0 0 0 5 8 1 0 0 0 0 1 2 1 0 0 0 0 8 9 1 0 0 0 0 M END > (C) 2008 SIGMA-ALDRICH CO. > 16255240 > MFCD00066141 > A > 414549 > - > - > - > - $$$$ 16 15 0 0 1 0 0 0 0 0 1 V2000 -0.6582 1.2354 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0563 1.6479 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7683 1.2367 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3727 1.6479 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6582 0.4104 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0563 2.4700 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7683 0.4146 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4803 1.6478 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1923 1.2367 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3702 -0.8257 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3702 -1.6479 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1923 -1.6479 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5481 -1.6479 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3702 -2.4700 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6582 -0.4146 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0538 -0.8257 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 4 1 1 0 1 5 1 1 2 6 2 0 3 7 1 0 3 8 1 0 8 9 1 0 5 15 1 0 10 11 1 0 11 12 1 0 11 13 1 0 11 14 1 0 15 16 2 0 10 15 1 0 M STY 1 1 SUP M SLB 1 1 1 M SAL 1 2 8 9 M SBL 1 1 7 M SMT 1 OCH3 M SBV 1 7 -0.7120 -0.4111 M STY 1 2 SUP M SLB 1 2 2 M SAL 2 7 10 11 12 13 14 15 16 M SBL 2 1 9 M SMT 2 Boc M SBV 2 9 0.0000 0.8250 M END > (C) 2008 SIGMA-ALDRICH CO. > 16255240 > MFCD00151859 > A > 458457 > - > - > - > - $$$$ 9 7 0 0 1 0 0 0 0 0 1 V2000 3.8360 -6.5317 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5505 -6.1192 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.2650 -6.5317 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9794 -6.1192 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5195 -5.1837 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2650 -7.3538 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9794 -7.7663 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6083 -6.6167 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4333 -6.6167 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 2 1 1 0 0 0 0 3 2 1 0 0 0 0 4 3 2 0 0 0 0 3 6 1 0 0 0 0 2 5 1 6 0 0 0 6 7 1 0 0 0 0 8 9 1 0 0 0 0 M END > (C) 2008 SIGMA-ALDRICH CO. > 16255240 > MFCD00063663 > A > 330639 > F > 05200 > - > - $$$$ 23 24 0 0 1 0 0 0 0 0 1 V2000 9.6083 -4.6542 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 8.8875 -5.0625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.1708 -4.6417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3583 -4.9917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7000 -3.8333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0167 -5.0500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7375 -4.6375 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.4542 -5.0542 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.1750 -3.8125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.5083 -3.6667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9167 -4.3833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0917 -3.2750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.5292 -5.8000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0125 -5.8792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3000 -4.6292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5792 -5.0417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8667 -4.6208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4625 -5.8792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8708 -3.7917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1458 -5.0333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1583 -3.3750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4292 -4.6083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4375 -3.7792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2 1 1 0 0 0 0 3 2 1 0 0 0 0 4 1 1 0 0 0 0 5 1 1 0 0 0 0 6 7 1 0 0 0 0 8 7 1 6 0 0 0 8 3 1 0 0 0 0 9 3 2 0 0 0 0 10 5 1 0 0 0 0 11 4 1 0 0 0 0 12 5 2 0 0 0 0 13 4 2 0 0 0 0 14 6 2 0 0 0 0 15 6 1 0 0 0 0 16 15 1 0 0 0 0 17 16 1 0 0 0 0 18 8 1 0 0 0 0 19 17 2 0 0 0 0 20 17 1 0 0 0 0 21 19 1 0 0 0 0 22 20 2 0 0 0 0 23 21 2 0 0 0 0 10 11 1 0 0 0 0 22 23 1 0 0 0 0 M END > (C) 2008 SIGMA-ALDRICH CO. > 16255240 > MFCD00053548 > F > 95870 > - > - > - > - $$$$ 11 9 0 0 1 0 0 0 0 0 1 V2000 1.1208 -0.0333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9417 -0.0375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7083 0.6875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3583 0.6750 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7042 -0.7458 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.1208 -0.7417 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5875 -1.3750 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.6458 1.0875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7667 1.3917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0750 0.2667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1125 -1.4583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2 1 1 0 0 0 0 3 1 2 0 0 0 0 4 2 1 0 0 0 0 5 1 1 0 0 0 0 5 6 1 1 0 0 0 8 4 1 0 0 0 0 9 4 1 0 0 0 0 10 4 1 0 0 0 0 11 5 1 0 0 0 0 M END > (C) 2008 SIGMA-ALDRICH CO. > 16255240 > MFCD00077087 > F > 30178 > - > - > - > - $$$$ 34 37 0 0 1 0 0 0 0 0 1 V2000 5.2934 -7.8562 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8809 -7.1400 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.2934 -6.4266 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8809 -5.7104 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1186 -6.4266 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1465 -7.1515 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.9436 -6.4266 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3561 -7.1371 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1755 -7.1371 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5851 -6.4266 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1755 -5.7189 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3561 -5.7189 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9465 -5.0027 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 8.5880 -5.0027 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 9.4103 -6.4266 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 8.5880 -7.8504 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 6.9436 -7.8533 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 1.5753 -9.6059 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3795 -9.7768 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7906 -9.0648 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2405 -8.4537 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.4893 -8.7882 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7382 -8.4537 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0730 -8.9370 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1589 -9.7547 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9101 -10.0892 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7906 -10.4889 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6129 -10.4889 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0240 -9.7768 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6129 -9.0648 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4114 -7.6495 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1934 -7.3954 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3644 -6.5911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7533 -6.0410 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8 17 1 0 0 0 0 6 33 1 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 2 6 1 6 0 0 0 7 5 1 0 0 0 0 7 8 2 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 11 12 2 0 0 0 0 7 12 1 0 0 0 0 12 13 1 0 0 0 0 11 14 1 0 0 0 0 10 15 1 0 0 0 0 9 16 1 0 0 0 0 18 19 1 0 0 0 0 19 20 2 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 18 22 2 0 0 0 0 22 23 1 0 0 0 0 23 24 2 0 0 0 0 24 25 1 0 0 0 0 25 26 2 0 0 0 0 18 26 1 0 0 0 0 19 27 1 0 0 0 0 27 28 2 0 0 0 0 28 29 1 0 0 0 0 29 30 2 0 0 0 0 20 30 1 0 0 0 0 21 31 1 0 0 0 0 31 32 1 0 0 0 0 32 33 1 0 0 0 0 33 34 2 0 0 0 0 G 33 6 Fmoc M STY 1 1 SUP M SLB 1 1 1 M SAL 1 15 18 19 20 21 22 23 24 25 26 27 28 29 30 31 32 M SAL 1 2 33 34 M SBL 1 1 2 M SMT 1 Fmoc M SBV 1 2 0.7800 -0.5700 M END > (C) 2008 SIGMA-ALDRICH CO. > 16255240 > MFCD00065612 > F > 47438 > - > - > - > - $$$$ 29 29 0 0 1 0 0 0 0 0 1 V2000 6.0792 -6.6792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0667 -5.9792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8500 -5.9792 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.7792 -5.9208 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2583 -6.6792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0417 -5.2125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6292 -5.9125 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.6583 -5.2792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6583 -6.7167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2458 -7.4167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4250 -5.9792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8333 -6.7167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8333 -5.2792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6292 -4.4708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.8583 -5.2125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2250 -9.0500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4292 -7.3375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3333 -4.5875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8083 -5.1542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4250 -5.4042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4042 -9.0375 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 8.0417 -6.6083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3667 -4.5583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4583 -7.3042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0000 -8.3333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9792 -9.7292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1583 -9.7208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1792 -8.3208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7583 -9.0125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2 3 1 0 0 0 0 3 5 1 0 0 0 0 4 1 1 0 0 0 0 5 1 1 0 0 0 0 6 7 1 0 0 0 0 7 4 1 6 0 0 0 8 2 2 0 0 0 0 9 2 1 0 0 0 0 10 1 2 0 0 0 0 11 12 1 0 0 0 0 12 9 2 0 0 0 0 13 8 1 0 0 0 0 14 6 2 0 0 0 0 15 6 1 0 0 0 0 17 12 1 0 0 0 0 18 13 1 0 0 0 0 19 3 1 0 0 0 0 20 3 1 0 0 0 0 21 16 1 0 0 0 0 22 7 1 0 0 0 0 23 18 1 0 0 0 0 24 17 1 0 0 0 0 25 21 1 0 0 0 0 26 21 1 0 0 0 0 27 26 1 0 0 0 0 28 25 1 0 0 0 0 29 27 1 0 0 0 0 13 11 2 0 0 0 0 29 28 1 0 0 0 0 M END > (C) 2008 SIGMA-ALDRICH CO. > 16255240 > MFCD00235844 > F > 75827 > - > - > - > - $$$$ 23 25 0 0 1 0 0 0 0 0 1 V2000 1.9738 -8.1407 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5613 -7.4245 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.9738 -6.7112 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5613 -5.9950 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7990 -6.7112 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8686 -7.4297 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3637 -6.1841 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7527 -5.6339 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0406 -6.0450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2116 -6.8493 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.0293 -6.9352 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5126 -7.6004 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3303 -7.5145 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6647 -6.7633 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1814 -6.0982 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7527 -4.8117 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0406 -4.4006 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3285 -4.8117 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3285 -5.6339 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6614 -7.4603 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8571 -7.2894 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3070 -7.9004 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5597 -8.6828 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 2 6 1 1 0 0 0 6 22 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 7 11 2 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 7 15 1 0 0 0 0 8 16 1 0 0 0 0 16 17 2 0 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 9 19 1 0 0 0 0 10 20 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 22 23 2 0 0 0 0 G 22 6 Fmoc M STY 1 1 SUP M SLB 1 1 1 M SAL 1 15 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 M SAL 1 2 22 23 M SBL 1 1 6 M SMT 1 Fmoc M SBV 1 6 0.5600 0.4800 M END > (C) 2008 SIGMA-ALDRICH CO. > 16255240 > MFCD00062960 > F > 47508 > - > - > - > - $$$$ 14 13 0 0 1 0 0 0 0 0 1 V2000 6.2369 -6.7865 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.8244 -6.0720 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.0638 -6.7865 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9952 -6.0720 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5807 -6.7887 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9931 -7.5048 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 4.5822 -5.3610 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8224 -7.5032 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2712 -7.9247 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7139 -7.0902 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4097 -8.2257 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4763 -7.4961 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4783 -6.0699 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.1903 -6.4810 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5 4 1 0 0 0 0 6 5 1 0 0 0 0 4 7 2 0 0 0 0 8 1 1 0 0 0 0 6 9 1 0 0 0 0 6 10 1 0 0 0 0 6 11 1 0 0 0 0 3 12 2 0 0 0 0 1 2 1 1 0 0 0 3 13 1 0 0 0 0 3 1 1 0 0 0 0 2 4 1 0 0 0 0 13 14 1 0 0 0 0 G 13 3 OCH3 M STY 1 1 SUP M SLB 1 1 1 M SAL 1 2 13 14 M SBL 1 1 10 M SMT 1 OCH3 M SBV 1 10 -0.4100 -0.7200 M END > (C) 2008 SIGMA-ALDRICH CO. > 16255240 > MFCD00191865 > A > 414646 > F > 15049 > - > - $$$$ 14 13 0 0 1 0 0 0 0 0 1 V2000 5.3744 -3.6199 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.9619 -2.9054 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.0888 -4.0324 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9619 -2.0804 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2474 -1.6679 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3181 -1.6507 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.6739 -1.6694 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6599 -4.0324 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1046 -0.8539 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9056 -2.3652 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4931 -1.6507 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0888 -4.8545 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8033 -3.6199 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5153 -4.0310 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2 4 1 0 0 0 0 5 4 1 0 0 0 0 6 5 1 0 0 0 0 4 7 2 0 0 0 0 8 1 1 0 0 0 0 6 9 1 0 0 0 0 6 10 1 0 0 0 0 6 11 1 0 0 0 0 3 12 2 0 0 0 0 1 2 1 6 0 0 0 3 13 1 0 0 0 0 3 1 1 0 0 0 0 13 14 1 0 0 0 0 G 13 3 OCH3 M STY 1 1 SUP M SLB 1 1 1 M SAL 1 2 13 14 M SBL 1 1 11 M SDI 1 4 6.6600 -3.9300 6.4500 -3.5700 M SMT 1 OCH3 M SBV 1 11 -0.7200 -0.4100 M SDS EXP 1 1 M END > (C) 2008 SIGMA-ALDRICH CO. > 16255240 > MFCD00038513 > A > 423572 > F > 15051 > - > - $$$$ 14 15 0 0 1 0 0 0 0 0 1 V2000 -1.3452 -0.6476 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6653 -1.8421 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6281 -2.5157 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3329 -1.7374 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1103 -0.6476 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5769 0.3737 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5250 -2.0443 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.0946 0.3290 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8136 0.3737 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4319 1.4447 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8136 2.5157 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5769 2.5157 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0414 1.4447 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4319 -2.1364 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 3 4 1 0 0 0 4 5 1 0 0 0 5 1 1 0 0 0 5 6 1 0 0 0 4 7 2 0 0 0 1 8 2 0 0 0 6 9 2 0 0 0 9 10 1 0 0 0 10 11 2 0 0 0 11 12 1 0 0 0 12 13 2 0 0 0 13 6 1 0 0 0 2 3 1 0 0 0 2 14 1 6 0 0 M END > (C) 2008 SIGMA-ALDRICH CO. > 16255240 > F______99138 > F > 99138 > - > - > - > - $$$$ 24 24 0 0 1 0 0 0 0 0 1 V2000 -2.2723 1.5827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5578 1.1702 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8434 1.5827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1289 1.1702 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8434 2.4048 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5578 0.3480 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5856 1.5827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3000 1.1702 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3000 0.3452 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0145 -0.0673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7290 0.3452 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7290 1.1702 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0145 1.5827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0145 -1.1673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0145 -1.9923 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3000 -2.4048 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5856 -1.9923 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5856 -1.1673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3000 -0.7548 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7290 -2.4048 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1289 -0.7548 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 0.1289 0.0702 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1289 -1.5798 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9258 -0.9683 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2 1 1 0 0 0 3 2 1 0 0 0 4 3 1 0 0 0 3 5 2 0 0 0 2 6 1 1 0 0 7 4 1 0 0 0 8 7 1 0 0 0 8 9 2 0 0 0 9 10 1 0 0 0 10 11 2 0 0 0 11 12 1 0 0 0 12 13 2 0 0 0 13 8 1 0 0 0 14 15 2 0 0 0 15 16 1 0 0 0 16 17 2 0 0 0 17 18 1 0 0 0 18 19 2 0 0 0 19 14 1 0 0 0 15 20 1 0 0 0 18 21 1 0 0 0 21 22 2 0 0 0 21 23 2 0 0 0 21 24 1 0 0 0 M END > (C) 2008 SIGMA-ALDRICH CO. > 16255240 > MFCD00066143 > F > 05183 > - > - > - > - $$$$ 14 13 0 0 1 0 0 0 0 0 1 V2000 1.8083 -0.7766 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2036 -0.0546 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.0333 -0.0352 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4285 0.6909 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4624 -0.7382 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7756 0.6491 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9786 -0.7960 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1781 -0.1621 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6104 -0.7570 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 0.0156 -0.1893 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2053 -1.3246 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0428 -1.3518 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9468 0.6269 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1478 0.8210 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2 6 1 6 0 0 0 7 1 1 0 0 0 0 6 13 1 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 12 1 0 0 0 0 13 14 2 0 0 0 0 8 13 1 0 0 0 0 G 13 6 Boc M STY 1 1 SUP M SLB 1 1 1 M SAL 1 7 8 9 10 11 12 13 14 M SBL 1 1 3 M SMT 1 Boc M SBV 1 3 0.8300 0.0200 M END > (C) 2008 SIGMA-ALDRICH CO. > 16255240 > MFCD00236843 > A > 662836 > - > - > - > - $$$$ 12 11 0 0 1 0 0 0 0 0 1 V2000 6.2333 -7.7625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5208 -7.3500 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.5083 -6.4917 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 6.2333 -8.5833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9500 -7.3500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3292 -6.4917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0958 -5.7792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8042 -7.7625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7417 -5.7750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5083 -5.0625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5667 -5.7750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0958 -4.3500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2 1 1 0 0 0 0 2 3 1 6 0 0 0 4 1 2 0 0 0 0 5 1 1 0 0 0 0 6 3 1 0 0 0 0 7 3 1 0 0 0 0 8 2 1 0 0 0 0 9 6 1 0 0 0 0 10 7 1 0 0 0 0 11 9 1 0 0 0 0 12 10 1 0 0 0 0 M END > (C) 2008 SIGMA-ALDRICH CO. > 16255240 > MFCD00010823 > A > 299715 > - > - > - > - $$$$ 8 6 0 0 1 0 0 0 0 0 1 V2000 9.3333 -6.3417 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 8.5083 -6.3375 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4148 -5.8078 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1293 -5.3953 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.8437 -5.8078 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1084 -4.5911 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.8437 -6.6299 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7374 -5.2495 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4 3 1 0 0 0 0 5 4 1 0 0 0 0 5 7 2 0 0 0 0 4 6 1 6 0 0 0 5 8 1 0 0 0 0 1 2 1 0 0 0 0 M END > (C) 2008 SIGMA-ALDRICH CO. > 16255240 > MFCD00066145 > A > 459216 > - > - > - > - $$$$ 13 12 0 0 1 0 0 0 0 0 1 V2000 0.9833 -1.0667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7000 -1.4750 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.1292 -1.4667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4125 -1.0583 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 0.2708 -1.4833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9792 -0.2417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1333 -2.2917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4458 -1.0750 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.8417 -1.0542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4083 -0.2333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1625 -0.6625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8583 -1.7875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0333 -0.3583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2 1 1 0 0 0 0 3 4 1 0 0 0 0 4 2 1 0 0 0 0 5 1 1 0 0 0 0 6 1 2 0 0 0 0 7 3 2 0 0 0 0 8 5 1 0 0 0 0 9 3 1 0 0 0 0 4 10 1 6 0 0 0 11 8 1 0 0 0 0 12 8 1 0 0 0 0 13 8 1 0 0 0 0 M END > (C) 2008 SIGMA-ALDRICH CO. > 16255240 > MFCD00063123 > F > 15048 > - > - > - > - $$$$ 22 22 0 0 1 0 0 0 0 0 1 V2000 4.1771 -1.8226 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7646 -1.1064 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.1771 -0.3931 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7646 0.3231 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0023 -0.3931 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9885 -1.0928 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4148 -1.1076 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9991 -1.8175 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4109 -2.5315 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2368 -2.5319 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6491 -1.8124 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2349 -1.1014 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6502 -3.2459 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 6.2389 -3.9608 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 7.4754 -3.2447 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3808 -0.1328 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9622 -0.7142 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.3808 -1.2956 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5436 -0.1328 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5436 -1.2956 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5866 -0.3456 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3738 -1.1399 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10 11 1 0 0 0 0 2 6 1 6 0 0 0 11 12 2 0 0 0 0 12 7 1 0 0 0 0 6 21 1 0 0 0 0 10 13 1 0 0 0 0 5 7 1 0 0 0 0 13 14 1 0 0 0 0 13 15 2 0 0 0 0 1 2 1 0 0 0 0 7 8 2 0 0 0 0 2 3 1 0 0 0 0 8 9 1 0 0 0 0 3 4 2 0 0 0 0 9 10 2 0 0 0 0 3 5 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 20 1 0 0 0 0 21 22 2 0 0 0 0 16 21 1 0 0 0 0 G 21 6 Boc M CHG 2 13 1 14 -1 M STY 1 1 SUP M SLB 1 1 1 M SAL 1 7 16 17 18 19 20 21 22 M SBL 1 1 5 M SMT 1 Boc M SBV 1 5 0.4000 -0.7500 M END > (C) 2008 SIGMA-ALDRICH CO. > 16255240 > MFCD00038117 > F > 15052 > - > - > - > - $$$$ 16 16 0 0 0 0 0 0 0 0 1 V2000 -1.7664 0.4954 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4675 -0.2547 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9476 -0.1876 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8258 0.4954 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9476 -1.7440 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2802 0.5851 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1191 -0.2547 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8258 2.5221 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2802 -2.5221 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6126 -0.1876 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4123 0.4954 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6126 -1.7440 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3193 -0.0251 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4123 2.5221 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3193 -2.0574 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6126 0.7193 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 3 1 0 0 0 0 2 4 1 0 0 0 0 3 5 2 0 0 0 0 3 6 1 0 0 0 0 4 7 1 0 0 0 0 4 8 2 0 0 0 0 5 9 1 0 0 0 0 6 10 2 0 0 0 0 7 11 1 0 0 0 0 9 12 2 0 0 0 0 10 12 1 0 0 0 0 11 13 1 0 0 0 0 11 14 1 0 0 0 0 13 15 2 0 0 0 0 13 16 1 0 0 0 0 M END > (C) 2008 SIGMA-ALDRICH CO. > 16255240 > MFCD00063125 > A > 850691 > F > 95860 > - > - $$$$ 16 16 0 0 1 0 0 0 0 0 1 V2000 -1.7743 0.8519 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7743 -0.1020 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0599 1.2644 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0599 2.0894 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3454 0.8519 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4888 1.2644 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0777 -0.6655 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4888 -1.3774 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0777 -2.0894 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2556 -2.0894 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8445 -1.3774 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2556 -0.6655 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0224 -1.3774 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3887 -0.6655 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2108 -0.6655 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6219 -1.3774 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 6 0 0 1 3 1 0 0 0 3 4 2 0 0 0 3 5 1 0 0 0 1 6 1 0 0 0 2 15 1 0 0 0 7 8 2 0 0 0 8 9 1 0 0 0 9 10 2 0 0 0 10 11 1 0 0 0 11 12 2 0 0 0 7 12 1 0 0 0 11 13 1 0 0 0 13 14 1 0 0 0 14 15 1 0 0 0 15 16 2 0 0 0 M STY 1 1 SUP M SLB 1 1 1 M SAL 1 10 7 8 9 10 11 12 13 14 15 16 M SBL 1 1 6 M SMT 1 Cbz M SBV 1 6 -6.5954 6.0916 M END > (C) 2008 SIGMA-ALDRICH CO. > 16255240 > MFCD00063126 > F > 95848 > - > - > - > - $$$$ 16 17 0 0 1 0 0 0 0 0 1 V2000 3.7292 -0.3750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3167 -1.0875 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.0792 -3.2333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3167 -2.5167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7292 -1.8042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4917 -2.5167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3167 0.3417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4917 -3.9500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3167 -3.9500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4917 -1.0917 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5542 -0.3750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7292 -3.2333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2500 -3.2333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0792 -4.6708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8333 -3.9500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2500 -4.6708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2 1 1 0 0 0 0 3 6 1 0 0 0 0 4 5 1 0 0 0 0 5 2 1 0 0 0 0 6 4 2 0 0 0 0 7 1 2 0 0 0 0 8 9 1 0 0 0 0 9 12 2 0 0 0 0 2 10 1 1 0 0 0 11 1 1 0 0 0 0 12 4 1 0 0 0 0 13 3 1 0 0 0 0 14 8 1 0 0 0 0 15 13 2 0 0 0 0 16 14 2 0 0 0 0 8 3 2 0 0 0 0 16 15 1 0 0 0 0 M END > (C) 2008 SIGMA-ALDRICH CO. > 16255240 > MFCD00038546 > S > N5387 > - > - > - > - $$$$ 16 17 0 0 1 0 0 0 0 0 1 V2000 5.7667 -6.8500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4292 -6.8458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1875 -6.1292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0167 -6.1333 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.1792 -7.5667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2583 -6.8667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7667 -8.2792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4292 -5.4167 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.0958 -7.3833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9375 -8.2792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5262 -7.5674 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9375 -6.8500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5219 -6.1373 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6952 -6.1407 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2859 -6.8628 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7038 -7.5726 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7 5 2 0 0 0 0 4 8 1 6 0 0 0 9 2 1 0 0 0 0 12 1 2 0 0 0 0 10 7 1 0 0 0 0 10 11 2 0 0 0 0 2 4 1 0 0 0 0 11 12 1 0 0 0 0 3 1 1 0 0 0 0 12 13 1 0 0 0 0 4 3 1 0 0 0 0 13 14 2 0 0 0 0 5 1 1 0 0 0 0 14 15 1 0 0 0 0 6 2 2 0 0 0 0 15 16 2 0 0 0 0 16 11 1 0 0 0 0 M END > (C) 2008 SIGMA-ALDRICH CO. > 16255240 > MFCD00066086 > S > N1521 > - > - > - > - $$$$ 23 25 0 0 1 0 0 0 0 0 1 V2000 -0.6167 -8.7875 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.9167 -8.5042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5042 -7.7917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6958 -7.9667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3583 -9.1208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5292 -9.2333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2458 -8.8250 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6708 -8.8292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0958 -9.2125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9583 -9.2417 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 0.8167 -8.8083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5167 -10.0625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3875 -9.2417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6708 -8.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7583 -7.0042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7167 -8.6750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6083 -9.9000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1417 -7.3542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9542 -10.0667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2042 -6.3958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4125 -10.0792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9750 -9.4583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3958 -6.5708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2 5 2 0 0 0 0 3 4 2 0 0 0 0 4 1 1 0 0 0 0 5 1 1 0 0 0 0 6 11 1 0 0 0 0 7 6 1 0 0 0 0 8 10 1 0 0 0 0 9 1 1 0 0 0 0 10 7 1 6 0 0 0 11 9 1 0 0 0 0 12 6 2 0 0 0 0 13 8 2 0 0 0 0 14 8 1 0 0 0 0 15 3 1 0 0 0 0 16 2 1 0 0 0 0 17 5 1 0 0 0 0 18 4 1 0 0 0 0 19 10 1 0 0 0 0 20 23 1 0 0 0 0 21 17 2 0 0 0 0 22 16 2 0 0 0 0 23 18 2 0 0 0 0 2 3 1 0 0 0 0 15 20 2 0 0 0 0 21 22 1 0 0 0 0 M END > (C) 2008 SIGMA-ALDRICH CO. > 16255240 > MFCD00037139 > A > 531480 > F > 47616 > - > - $$$$ 20 20 0 0 1 0 0 0 0 0 1 V2000 5.3567 -7.8474 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9442 -7.1312 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.3567 -6.4179 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9442 -5.7016 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1819 -6.4179 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2098 -7.0885 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.0069 -6.4179 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 7.4826 -7.0911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2675 -6.8476 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2675 -6.0253 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4826 -5.7645 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2303 -4.9796 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2160 -7.8731 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3812 -6.0034 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9626 -6.5848 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 4.3812 -7.1662 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5440 -6.0034 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5440 -7.1662 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5870 -6.2162 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3742 -7.0104 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 7 11 1 0 0 0 0 11 12 2 0 0 0 0 8 13 2 0 0 0 0 6 19 1 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 2 6 1 6 0 0 0 7 5 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 18 1 0 0 0 0 19 20 2 0 0 0 0 14 19 1 0 0 0 0 G 19 6 Boc M STY 1 1 SUP M SLB 1 1 1 M SAL 1 7 14 15 16 17 18 19 20 M SBL 1 1 8 M SMT 1 Boc M SBV 1 8 0.6200 -0.8700 M END > (C) 2008 SIGMA-ALDRICH CO. > 16255240 > MFCD00065974 > F > 15385 > - > - > - > - $$$$ 13 12 0 0 1 0 0 0 0 0 1 V2000 -1.4253 1.3880 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7109 0.9755 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0012 1.3866 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7108 0.9770 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0012 2.2060 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7109 0.1505 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0012 -1.0828 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7133 -1.4939 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3022 -2.2060 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1244 -0.7819 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4253 -1.9050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0012 -0.2606 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7133 0.1505 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 1 0 3 5 2 0 2 6 1 1 6 12 1 0 7 8 1 0 8 9 1 0 8 10 1 0 8 11 1 0 12 13 2 0 7 12 1 0 M STY 1 1 SUP M SLB 1 1 1 M SAL 1 7 7 8 9 10 11 12 13 M SBL 1 1 6 M SMT 1 Boc M SBV 1 6 -0.7121 0.4111 M END > (C) 2008 SIGMA-ALDRICH CO. > 16255240 > MFCD00037225 > A > 134511 > F > 15380 > - > - $$$$ 11 9 0 0 1 0 0 0 0 0 1 V2000 -3.2104 0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4959 -0.2063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7815 0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0670 -0.2063 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7815 1.0284 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4959 -1.0284 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3525 0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1390 -0.5906 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3525 1.0284 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4725 0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2104 0.2805 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 2 1 1 0 0 0 3 2 1 0 0 0 4 3 1 0 0 0 3 5 2 0 0 0 2 6 1 1 0 0 7 4 1 0 0 0 8 7 1 0 0 0 7 9 1 0 0 0 7 10 1 0 0 0 M END > (C) 2008 SIGMA-ALDRICH CO. > 16255240 > MFCD00035524 > F > 05190 > S > A0255 > - > - $$$$ 10 8 0 0 0 0 0 0 0 0 1 V2000 -2.8025 0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0880 -0.2063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3736 0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6591 -0.2063 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0554 0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7698 -0.2063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0880 -1.0284 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3736 1.0284 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0880 -0.4041 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8025 0.0084 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 2 1 1 0 0 0 3 2 1 0 0 0 4 3 1 0 0 0 5 4 1 0 0 0 6 5 1 0 0 0 2 7 1 0 0 0 3 8 2 0 0 0 9 10 1 0 0 0 M STY 1 1 SUP M SLB 1 1 1 M SAL 1 2 9 10 M SMT 1 • HCl M END > (C) 2008 SIGMA-ALDRICH CO. > 16255240 > MFCD00013018 > A > 05180 > - > - > - > - $$$$ 6 5 0 0 0 0 0 0 0 0 1 V2000 -1.0717 0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3572 -0.2063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3572 0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0717 -0.2063 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3572 1.0284 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3572 -1.0284 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2 1 1 0 0 0 3 2 1 0 0 0 4 3 1 0 0 0 3 5 2 0 0 0 2 6 1 0 0 0 M END > (C) 2008 SIGMA-ALDRICH CO. > 16255240 > MFCD00064408 > F > 05150 > S > A7502 > - > - $$$$ 6 5 0 0 1 0 0 0 0 0 1 V2000 -0.7083 0.0583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4833 1.4125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8333 0.0583 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.4833 -1.2708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6083 1.4125 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.6083 -1.2708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2 1 2 0 0 0 0 3 1 1 0 0 0 0 4 1 1 0 0 0 0 3 5 1 1 0 0 0 6 3 1 0 0 0 0 M END > (C) 2008 SIGMA-ALDRICH CO. > 16255240 > MFCD00064410 > A > A26802 > F > 05130 > S > A7469 $$$$