%chk=000077634.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000077634

0 1
 O   -5.980400      0.7695000      -1.019000    
 O    5.979200      0.7710000       1.019600    
 N   -3.646800     -0.5048000      0.1233000    
 N    3.646900     -0.5050000     -0.1231000    
 C   -1.483600      -1.649100     -8.6599998E-02
 C    1.483500      -1.649100      8.6300001E-02
 C  -0.7026000     -0.3860000      0.2981000    
 C  -0.7026000      -2.911400      0.3002000    
 C   0.7028000     -0.3867000     -0.3009000    
 C   0.7026000      -2.911800     -0.2991000    
 C   -2.864800      -1.648900      0.5655000    
 C    2.865300      -1.649700     -0.5646000    
 C   -4.961700     -0.4961000      0.7515000    
 C    4.962400     -0.4971000     -0.7501000    
 C   -5.767000      0.6937000      0.3053000    
 C    5.767200      0.6933000     -0.3048000    
 C   -6.325700       1.716900      0.9895000    
 C    6.326500       1.715600     -0.9899000    
 C   -6.952900       2.517800      5.5000000E-03
 C    6.952800       2.517900     -6.3000000E-03
 C   -6.714200       1.899000      -1.199600    
 C    6.712800       1.900800       1.199200    
 H   -1.610400      -1.656000      -1.178700    
 H    1.609600      -1.654300       1.178500    
 H  -0.6276000     -0.3097000       1.390600    
 H   -1.222700      0.5146000     -4.8200000E-02
 H   -1.239900      -3.803700     -4.2700000E-02
 H  -0.6285000      -2.985800       1.392700    
 H   0.6280000     -0.3124000      -1.393600    
 H    1.223000      0.5145000      4.3800000E-02
 H    1.239900      -3.803600      4.4900000E-02
 H   0.6287000      -2.987500      -1.391500    
 H   -3.386500      -2.578200      0.3039000    
 H   -2.754600      -1.630800       1.657200    
 H    2.756100      -1.633000      -1.656400    
 H    3.386700      -2.578600     -0.3013000    
 H   -3.750700     -0.5364000     -0.8910000    
 H    3.749900     -0.5353000      0.8913000    
 H   -5.519500      -1.405600      0.4963000    
 H   -4.859600     -0.4614000       1.843000    
 H    5.520000      -1.406200     -0.4932000    
 H    4.861200     -0.4640000      -1.841800    
 H   -6.298700       1.886400       2.056100    
 H    6.300600       1.883600      -2.056700    
 H   -7.509300       3.431600      0.1556000    
 H    7.509300       3.431700     -0.1572000    
 H   -6.983100       2.123200      -2.221400    
 H    6.980700       2.126500       2.221100    


%chk=000077634-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000077634

0 1
O -6.448307 0.317731 -0.969253
O 6.447793 0.318767 0.969502
N -3.754162 -0.453294 0.254434
N 3.754434 -0.453903 -0.254410
C -1.506477 -1.527905 0.017287
C 1.506724 -1.528197 -0.016812
C -0.684692 -0.260091 0.356831
C -0.690194 -2.802547 0.349858
C 0.685195 -0.260548 -0.357545
C 0.690247 -2.802960 -0.348429
C -2.875874 -1.545653 0.730446
C 2.876260 -1.546673 -0.729690
C -5.065352 -0.400224 0.949237
C 5.065809 -0.401308 -0.948880
C -5.987021 0.608995 0.340644
C 5.987104 0.608637 -0.340915
C -6.536984 1.809951 0.754818
C 6.537115 1.809240 -0.756045
C -7.376037 2.301664 -0.321897
C 7.375510 2.302203 0.320614
C -7.295043 1.377659 -1.347391
C 7.294214 1.379184 1.346971
H -1.692099 -1.527106 -1.082144
H 1.692162 -1.526515 1.082651
H -0.526894 -0.225347 1.456790
H -1.270785 0.639309 0.093993
H -1.261169 -3.707281 0.058364
H -0.543732 -2.857727 1.450018
H 0.527427 -0.226782 -1.457538
H 1.271455 0.638979 -0.095520
H 1.261043 -3.707576 -0.056218
H 0.543797 -2.858959 -1.448548
H -3.345559 -2.556544 0.601875
H -2.720250 -1.407336 1.820836
H 2.720883 -1.409300 -1.820235
H 3.345884 -2.557464 -0.600126
H -3.886548 -0.496933 -0.766793
H 3.886527 -0.496622 0.766893
H -5.575123 -1.398368 0.961081
H -4.895555 -0.117180 2.004960
H 5.575742 -1.399381 -0.959643
H 4.896297 -0.119266 -2.004916
H -6.357462 2.293302 1.713132
H 6.357994 2.291599 -1.714935
H -7.957339 3.221598 -0.328859
H 7.956634 3.222254 0.326948
H -7.730151 1.302367 -2.339882
H 7.728862 1.304951 2.339743


