%chk=000010409.chk
%nprocshared=24
%mem=100GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000010409

0 1
 O   -2.582200      0.1776000      -1.672800    
 C    2.998000     -0.5146000      0.3486000    
 C    3.381700      0.8304000     -0.2806000    
 C    2.531200      -1.533800     -0.6961000    
 C    2.175900       1.709000     -0.6408000    
 C    1.996900      -2.832500     -8.2800001E-02
 C    1.563000       2.392700      0.5867000    
 C   0.7053000      -2.693400      0.7326000    
 C   0.3450000       3.259400      0.2503000    
 C  -0.4671000      -2.137600     -7.9499997E-02
 C  -0.9097000       2.490600     -0.1832000    
 C   -1.747600      -2.069200      0.7579000    
 C   -1.461100       1.572100      0.9131000    
 C   -2.934700      -1.539000     -4.0300000E-02
 C   -2.829800      0.9863000      0.5729000    
 C   -2.764800     -9.7999997E-02 -0.4861000    
 H    2.236100     -0.3620000       1.117500    
 H    3.878600     -0.9248000      0.8583000    
 H    3.976100      0.6495000      -1.184500    
 H    4.030700       1.378100      0.4137000    
 H    3.385500      -1.786400      -1.337500    
 H    1.779100      -1.099100      -1.360800    
 H    1.424100       1.118100      -1.171600    
 H    2.513000       2.487300      -1.336800    
 H    2.771000      -3.273100      0.5574000    
 H    1.821900      -3.550100     -0.8943000    
 H    2.325200       3.041700       1.036700    
 H    1.299900       1.658500       1.353500    
 H   0.8798000      -2.063600       1.611900    
 H   0.4363000      -3.686000       1.115300    
 H   0.6156000       3.967400     -0.5426000    
 H   9.7099997E-02   3.864800       1.131300    
 H  -0.6361000      -2.769800     -0.9594000    
 H  -0.2225000      -1.134600     -0.4422000    
 H  -0.6991000       1.915600      -1.090300    
 H   -1.678000       3.226100     -0.4523000    
 H   -1.578100      -1.445700       1.643100    
 H   -1.993900      -3.074200       1.121600    
 H   -1.559100       2.149200       1.840700    
 H  -0.7511000      0.7637000       1.112200    
 H   -3.851200      -1.600700      0.5573000    
 H   -3.100100      -2.157600     -0.9303000    
 H   -3.522100       1.762400      0.2277000    
 H   -3.275200      0.5566000       1.477500    


%chk=000010409-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000010409

0 1
O -2.624876 0.270357 -1.693696
C 3.069619 -0.510038 0.341617
C 3.438982 0.846694 -0.315700
C 2.565704 -1.559606 -0.679371
C 2.213027 1.731814 -0.665992
C 2.010741 -2.858596 -0.040759
C 1.599306 2.438183 0.567498
C 0.697379 -2.687736 0.766737
C 0.347774 3.297369 0.252270
C -0.491655 -2.177906 -0.079392
C -0.920592 2.509502 -0.166981
C -1.816399 -2.120926 0.713636
C -1.463629 1.588316 0.950357
C -3.002532 -1.556967 -0.124538
C -2.851656 0.945059 0.639570
C -2.814227 -0.084673 -0.495969
H 2.303067 -0.340053 1.124024
H 3.954650 -0.924923 0.865897
H 4.026699 0.644171 -1.234675
H 4.105719 1.420670 0.360217
H 3.408071 -1.824136 -1.351036
H 1.792464 -1.106891 -1.330483
H 1.444832 1.114917 -1.173540
H 2.513911 2.508476 -1.398601
H 2.787623 -3.292480 0.622490
H 1.833371 -3.604105 -0.843487
H 2.376258 3.093645 1.012888
H 1.352739 1.690231 1.347178
H 0.861980 -1.997237 1.619120
H 0.427183 -3.666620 1.214598
H 0.605209 4.011012 -0.557466
H 0.102805 3.913217 1.143191
H -0.623361 -2.835288 -0.963406
H -0.263163 -1.171340 -0.480803
H -0.732810 1.919141 -1.082137
H -1.713792 3.235289 -0.438841
H -1.679378 -1.510775 1.629773
H -2.084767 -3.139604 1.057717
H -1.575165 2.182966 1.880316
H -0.730990 0.789267 1.177929
H -3.937593 -1.656861 0.463080
H -3.111937 -2.138992 -1.057488
H -3.547920 1.752942 0.339434
H -3.249169 0.473817 1.557828


