%chk=000128451.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000128451

0 1
 O   -2.172900     -0.2356000      -1.028700    
 O   -3.838400      -2.475700      0.2283000    
 O   -3.719900       2.099200      -1.124900    
 O    1.196400      -2.122500      0.2253000    
 O    3.240500       2.061700      0.5096000    
 N  -8.5100003E-02 -0.1990000      2.7100001E-02
 N    2.258400     -5.6000002E-02  0.3809000    
 C   -1.293200     -0.9504000     -0.1495000    
 C   -3.485000      -1.179500      0.7058000    
 C   -2.041600      -1.177900       1.153700    
 C   -3.489500     -0.1840000     -0.4459000    
 C   -3.744600       1.247100      8.6000003E-03
 C    1.121700     -0.8899000      0.2117000    
 C  -0.1490000       1.174900      9.6000005E-03
 C   0.9137000       1.969200      0.1646000    
 C    2.249400       1.346500      0.3688000    
 C    3.535100     -0.7349000      0.5776000    
 C   0.8306000       3.462900      0.1429000    
 C    4.170900     -0.9726000     -0.7517000    
 C    4.502400      -2.183500      -1.213800    
 H   -1.076300      -1.911600     -0.6308000    
 H   -4.179000     -0.9243000       1.512200    
 H   -1.873000     -0.3526000       1.855900    
 H   -1.727000      -2.106100       1.641100    
 H   -4.197500     -0.4588000      -1.235500    
 H   -3.018300       1.610000      0.7393000    
 H   -4.737500       1.328200      0.4625000    
 H   -1.111000       1.635800     -0.1405000    
 H   -4.754200      -2.426200     -9.4999999E-02
 H    4.198300     -0.1059000       1.181900    
 H    3.383800      -1.669800       1.129100    
 H   -2.860800       1.983400      -1.564800    
 H    1.183500       3.879400       1.092000    
 H  -0.1948000       3.814800     -1.2800000E-02
 H    1.446700       3.868600     -0.6662000    
 H    4.392900     -0.1059000      -1.369600    
 H    4.971200      -2.291000      -2.185900    
 H    4.313100      -3.082300     -0.6375000    


%chk=000128451-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000128451

0 1
O -2.066354 -0.376603 -0.917397
O -3.798590 -2.481722 0.766115
O -3.659451 1.677603 -1.934184
O 1.195503 -2.156034 0.274974
O 3.496981 1.927362 0.552828
N -0.041543 -0.156300 0.356239
N 2.340810 -0.106852 0.409018
C -1.300978 -0.909829 0.243553
C -3.639732 -1.021840 0.826513
C -2.256416 -0.779561 1.450839
C -3.521402 -0.381561 -0.581926
C -4.011813 1.074746 -0.651979
C 1.174756 -0.895129 0.334670
C -0.059915 1.237316 0.430571
C 1.077384 1.999750 0.513048
C 2.382610 1.324257 0.498769
C 3.650676 -0.828992 0.353918
C 1.064998 3.506498 0.590419
C 4.195414 -0.894121 -1.061012
C 4.368907 -2.049521 -1.747505
H -1.022799 -1.958158 0.052887
H -4.461733 -0.564005 1.414373
H -2.197295 0.227460 1.899550
H -2.042058 -1.531801 2.224798
H -4.026119 -0.987209 -1.358552
H -3.586338 1.659819 0.194919
H -5.113245 1.120645 -0.591035
H -1.052949 1.691994 0.390727
H -4.617453 -2.712465 0.258664
H 4.342029 -0.263925 1.002846
H 3.485443 -1.839614 0.757282
H -2.714142 1.434477 -2.123010
H 1.570363 3.854741 1.509345
H 0.035058 3.902641 0.578266
H 1.624215 3.945779 -0.255229
H 4.467973 0.070907 -1.509646
H 4.783907 -2.055529 -2.761856
H 4.093293 -3.019524 -1.316396


