%chk=000044366.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000044366

0 1
 O  -0.9482000       2.291900     -0.2219000    
 C   -1.347100     -9.8899998E-02 -5.3800002E-02
 C    1.540400     -0.3802000     -1.7899999E-02
 C   0.9319000      0.8891000     -0.1114000    
 C  -0.7385000      -1.368400      3.9099999E-02
 C  -0.4721000       1.010300     -0.1277000    
 C   -2.785400     -3.5999999E-03 -6.8200000E-02
 C    2.978600     -0.4757000     -2.7000001E-03
 C   0.6654000      -1.489500      5.5500001E-02
 C   -3.558200      -1.191000      1.1300000E-02
 C    3.751500      0.7115000     -8.2599998E-02
 C    1.726400       2.037300     -0.1884000    
 C   -1.533000      -2.516700      0.1158000    
 C    3.114500       1.950600     -0.1742000    
 C   -2.921000      -2.430100      0.1020000    
 C   -3.503000       1.215800     -0.1577000    
 C    3.695900      -1.695100      8.8500001E-02
 C   -4.962500      -1.134300     -1.9999999E-04
 C    5.155700      0.6547000     -7.0100002E-02
 C   -4.900000       1.258900     -0.1679000    
 C    5.092900      -1.738100      9.9799998E-02
 C   -5.629900      8.3200000E-02 -8.9100003E-02
 C    5.822900     -0.5626000      2.0400001E-02
 C   -1.177400       2.980900       1.001400    
 H    1.079200      -2.494300      0.1289000    
 H    1.305800       3.034900     -0.2862000    
 H   -1.077500      -3.502700      0.1879000    
 H    3.693400       2.869900     -0.2413000    
 H   -3.499300      -3.350100      0.1638000    
 H   -3.059600       2.184800     -0.3089000    
 H    3.178000      -2.648500      0.1534000    
 H   -5.553500      -2.046500      5.9799999E-02
 H    5.746900       1.566800     -0.1313000    
 H   -5.413500       2.212100     -0.2564000    
 H    5.604600      -2.693500      0.1709000    
 H   -6.715200      0.1110000     -0.1013000    
 H    6.908200     -0.5909000      2.8999999E-02
 H  -0.2338000       3.322300       1.437400    
 H   -1.698200       2.356000       1.734800    
 H   -1.788900       3.864000      0.7937000    


%chk=000044366-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000044366

0 1
O -0.980807 2.420750 -0.081945
C -1.356207 -0.033757 -0.024219
C 1.551904 -0.351055 -0.007902
C 0.943736 0.959562 -0.085672
C -0.718302 -1.336243 0.102243
C -0.477904 1.088344 -0.057971
C -2.827834 0.027466 -0.102931
C 3.016446 -0.466065 -0.030942
C 0.691423 -1.463550 0.109674
C -3.587776 -1.190312 0.070766
C 3.813285 0.731585 -0.124092
C 1.784576 2.133509 -0.190481
C -1.532583 -2.524795 0.249155
C 3.159963 2.021458 -0.206513
C -2.907289 -2.453798 0.261004
C -3.559739 1.224262 -0.388603
C 3.695016 -1.720226 0.032287
C -5.013871 -1.158096 0.017823
C 5.237915 0.635615 -0.144994
C -4.962413 1.229051 -0.451184
C 5.095994 -1.795141 0.011258
C -5.702697 0.035988 -0.230735
C 5.877585 -0.608904 -0.077125
C -1.221027 2.978155 1.268321
H 1.102793 -2.472563 0.214205
H 1.294787 3.106375 -0.284587
H -1.021670 -3.488098 0.361380
H 3.787325 2.916357 -0.295802
H -3.513861 -3.357918 0.389086
H -3.003056 2.140510 -0.590976
H 3.121657 -2.650198 0.095853
H -5.564950 -2.095223 0.162460
H 5.827553 1.557370 -0.217280
H -5.488077 2.162803 -0.680301
H 5.590365 -2.771487 0.061590
H -6.797326 0.048376 -0.271596
H 6.971001 -0.672239 -0.094013
H -0.285482 2.975444 1.859265
H -2.000498 2.399770 1.799641
H -1.563554 4.012216 1.108050


