%chk=000093639.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000093639

0 1
 O    2.524500     -0.8312000      0.9077000    
 O    3.234900     -0.1499000      -1.193000    
 C  -0.8229000      0.6920000     -0.2064000    
 C   0.6455000      0.5714000      0.3703000    
 C   -1.626100     -0.5545000      0.3296000    
 C    1.348300     -0.7887000      6.8599999E-02
 C   -3.184600     -0.5125000      0.1456000    
 C  -0.9609000      -1.877200     -0.1111000    
 C   0.4626000      -1.979200      0.4290000    
 C   -1.484100       1.982100      0.3536000    
 C    1.584500       1.766000      7.2999999E-02
 C   -3.722800      0.8453000      0.6628000    
 C    3.420900      4.8799999E-02  0.2153000    
 C    2.023300     -0.9162000      -1.296400    
 C   -2.991000       2.062700      0.1138000    
 C  -0.8120000      0.7927000      -1.749900    
 C    3.014600       1.486200      0.5593000    
 C   -3.847300      -1.611000       1.019900    
 C   -3.661000     -0.7658000      -1.296300    
 C    4.853400     -0.2609000      0.6048000    
 H   0.5372000      0.5945000       1.468100    
 H   -1.493400     -0.5225000       1.424600    
 H  -0.9558000      -1.984700      -1.199400    
 H   -1.515700      -2.737200      0.2763000    
 H   0.4179000      -2.070800       1.523300    
 H   0.9207000      -2.917200      9.0800002E-02
 H   -1.016700       2.871800     -8.5800000E-02
 H   -1.308100       2.043200       1.435900    
 H    1.217700       2.679500      0.5534000    
 H    1.627900       1.972900      -1.000400    
 H   -3.641700      0.8719000       1.758400    
 H   -4.792800      0.9399000      0.4372000    
 H    2.328200      -1.949100      -1.500200    
 H    1.443100     -0.5627000      -2.146800    
 H   -3.379000       2.962300      0.6072000    
 H   -3.212200       2.189000     -0.9504000    
 H   -1.744800       1.185700      -2.154900    
 H  -4.6399999E-02   1.483800      -2.110700    
 H  -0.6441000     -0.1674000      -2.239100    
 H    3.693700       2.209300      9.3199998E-02
 H    3.053800       1.633300       1.645600    
 H   -3.645600      -2.616900      0.6384000    
 H   -3.493700      -1.564600       2.056000    
 H   -4.937300      -1.491700       1.040700    
 H   -4.752700     -0.8707000      -1.329000    
 H   -3.419500      4.7100000E-02  -1.979300    
 H   -3.240300      -1.689900      -1.705000    
 H    5.101000      -1.298200      0.3521000    
 H    5.559400      0.3808000      6.7800000E-02
 H    5.007400     -0.1442000       1.682500    


%chk=000093639-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000093639

0 1
O 2.539072 -0.877556 0.931497
O 3.379432 -0.233679 -1.157834
C -0.836678 0.691750 -0.259549
C 0.631003 0.561641 0.320350
C -1.635362 -0.554655 0.302663
C 1.337508 -0.798734 0.022006
C -3.206041 -0.519464 0.171941
C -0.982938 -1.880353 -0.169285
C 0.459709 -2.006035 0.371147
C -1.472427 1.993041 0.325815
C 1.595027 1.729788 -0.024291
C -3.714889 0.849154 0.723730
C 3.488314 0.057091 0.309016
C 2.048949 -0.865827 -1.362196
C -3.000731 2.074943 0.119121
C -0.846558 0.790040 -1.811451
C 3.007337 1.501539 0.573035
C -3.816405 -1.631380 1.075814
C -3.737942 -0.756520 -1.268923
C 4.898270 -0.261645 0.775486
H 0.510624 0.560379 1.426658
H -1.461868 -0.509613 1.405025
H -0.989480 -1.953242 -1.274567
H -1.564620 -2.745090 0.198325
H 0.421840 -2.072977 1.476055
H 0.942981 -2.933610 0.010627
H -0.990815 2.882743 -0.125100
H -1.260962 2.033062 1.416053
H 1.188640 2.684991 0.354241
H 1.700448 1.834558 -1.119804
H -3.562031 0.859876 1.824153
H -4.808559 0.921319 0.555560
H 2.201883 -1.917831 -1.668502
H 1.529039 -0.316145 -2.162258
H -3.385303 2.999123 0.593835
H -3.241796 2.164811 -0.958427
H -1.814806 1.162638 -2.182553
H -0.078321 1.500905 -2.165306
H -0.663181 -0.179290 -2.305360
H 3.726871 2.216110 0.132037
H 2.998641 1.660188 1.668870
H -3.655757 -2.643282 0.661584
H -3.385100 -1.604670 2.094804
H -4.909590 -1.484900 1.167864
H -4.835948 -0.894221 -1.241870
H -3.528473 0.084279 -1.950198
H -3.301685 -1.669362 -1.714370
H 5.115962 -1.326726 0.595360
H 5.627209 0.349606 0.216818
H 5.007507 -0.049469 1.853055


