126
alpha-cyclodextrin
C    4.6024   -2.6572    0.1139
C    5.1802   -1.9191    1.3153
C    4.6543   -0.4797    1.4320
C    4.7937    0.2440    0.0928
C    4.3111   -0.5482   -1.1259
C    4.8099    0.0428   -2.4517
O    4.9347   -2.6011    2.5316
O    5.4237    0.1899    2.4123
O    3.9724    1.3897    0.1893
O    4.7626   -1.9011   -1.0705
O    3.9077    1.0126   -2.9355
H    5.3605   -3.8418   -0.0820
H    6.2533   -1.8951    1.1215
H    3.6133   -0.5196    1.7582
H    5.8530    0.4447   -0.0532
H    3.2196   -0.5672   -1.1660
H    5.7970    0.4860   -2.3211
H    4.8808   -0.7527   -3.1946
H    5.3115   -2.0727    3.2417
H    5.0989    1.0954    2.4907
H    3.8731    1.7354   -2.2982
C   -0.0001   -5.3144    0.1139
C    0.9281   -5.4457    1.3152
C    1.9117   -4.2706    1.4320
C    2.6082   -4.0294    0.0928
C    1.6808   -4.0075   -1.1259
C    2.4420   -4.1442   -2.4518
O    0.2148   -5.5742    2.5315
O    2.8763   -4.6021    2.4123
O    3.1898   -2.7454    0.1893
O    0.7349   -5.0751   -1.0704
O    2.8308   -2.8779   -2.9356
H   -0.6468   -6.5631   -0.0820
H    1.4855   -6.3631    1.1215
H    1.3566   -3.3891    1.7581
H    3.3116   -4.8464   -0.0533
H    1.1186   -3.0718   -1.1661
H    3.3194   -4.7774   -2.3211
H    1.7885   -4.6033   -3.1945
H    0.8609   -5.6362    3.2416
H    3.4981   -3.8680    2.4907
H    3.4395   -2.4864   -2.2981
C   -4.6025   -2.6572    0.1139
C   -4.2522   -3.5266    1.3152
C   -2.7426   -3.7909    1.4320
C   -2.1854   -4.2735    0.0929
C   -2.6302   -3.4594   -1.1259
C   -2.3680   -4.1869   -2.4518
O   -4.7200   -2.9730    2.5315
O   -2.5475   -4.7921    2.4123
O   -0.7826   -4.1350    0.1893
O   -4.0277   -3.1739   -1.0705
O   -1.0769   -3.8905   -2.9356
H   -6.0072   -2.7214   -0.0821
H   -4.7679   -4.4680    1.1214
H   -2.2567   -2.8694    1.7581
H   -2.5414   -5.2911   -0.0533
H   -2.1010   -2.5046   -1.1661
H   -2.4777   -5.2634   -2.3211
H   -3.0923   -3.8505   -3.1946
H   -4.4507   -3.5636    3.2416
H   -1.6008   -4.9635    2.4907
H   -0.4336   -4.2220   -2.2981
C   -4.6025    2.6572    0.1138
C   -5.1802    1.9192    1.3152
C   -4.6543    0.4798    1.4319
C   -4.7936   -0.2441    0.0929
C   -4.3111    0.5482   -1.1260
C   -4.8099   -0.0428   -2.4519
O   -4.9347    2.6011    2.5315
O   -5.4238   -0.1899    2.4123
O   -3.9724   -1.3897    0.1893
O   -4.7625    1.9012   -1.0705
O   -3.9077   -1.0126   -2.9356
H   -5.3604    3.8417   -0.0820
H   -6.2534    1.8951    1.1214
H   -3.6133    0.5196    1.7581
H   -5.8529   -0.4446   -0.0533
H   -3.2196    0.5672   -1.1661
H   -5.7971   -0.4860   -2.3211
H   -4.8808    0.7527   -3.1945
H   -5.3115    2.0726    3.2416
H   -5.0989   -1.0954    2.4907
H   -3.8730   -1.7355   -2.2981
C    0.0000    5.3144    0.1138
C   -0.9281    5.4458    1.3152
C   -1.9117    4.2707    1.4320
C   -2.6082    4.0294    0.0929
C   -1.6808    4.0075   -1.1260
C   -2.4420    4.1442   -2.4518
O   -0.2148    5.5741    2.5315
O   -2.8763    4.6022    2.4123
O   -3.1897    2.7454    0.1893
O   -0.7349    5.0751   -1.0705
O   -2.8308    2.8779   -2.9355
H    0.6469    6.5631   -0.0820
H   -1.4854    6.3631    1.1215
H   -1.3566    3.3891    1.7581
H   -3.3115    4.8465   -0.0533
H   -1.1186    3.0718   -1.1660
H   -3.3194    4.7775   -2.3211
H   -1.7884    4.6033   -3.1945
H   -0.8609    5.6363    3.2416
H   -3.4981    3.8680    2.4906
H   -3.4395    2.4864   -2.2982
C    4.6024    2.6572    0.1139
C    4.2521    3.5266    1.3152
C    2.7427    3.7909    1.4320
C    2.1855    4.2735    0.0928
C    2.6303    3.4594   -1.1260
C    2.3680    4.1868   -2.4518
O    4.7200    2.9731    2.5315
O    2.5474    4.7921    2.4123
O    0.7827    4.1350    0.1893
O    4.0277    3.1739   -1.0704
O    1.0769    3.8905   -2.9356
H    6.0073    2.7214   -0.0820
H    4.7679    4.4680    1.1215
H    2.2567    2.8694    1.7581
H    2.5414    5.2912   -0.0533
H    2.1010    2.5046   -1.1660
H    2.4777    5.2634   -2.3210
H    3.0923    3.8506   -3.1946
H    4.4507    3.5636    3.2416
H    1.6007    4.9635    2.4907
H    0.4335    4.2219   -2.2981
