%chk=000148554.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000148554

1 1
 O   -2.554900     -0.9158000     -9.9299997E-02
 O    2.487500     -0.7941000      4.0700000E-02
 N   -3.610300       1.096100     -6.7400001E-02
 N    3.689000       1.168200      6.4199999E-02
 C   -4.574000      0.1116000     -8.6700000E-02
 C    4.578700      0.1047000      9.2200004E-02
 C   -2.482900      0.4409000     -7.5800002E-02
 C    2.414000      0.6204000      3.3599999E-02
 C   -3.923900      -1.124200     -0.1062000    
 C    3.839300      -1.086900      7.7299997E-02
 C   -3.829700       2.512600     -4.3800000E-02
 C    4.116300       2.545100      7.1999997E-02
 C   -5.964600      0.1922000     -8.8600002E-02
 C    5.956700      5.9000000E-02  0.1289000    
 C   -6.663800      -1.023400     -0.1110000    
 C    6.572400      -1.198800      0.1501000    
 C   -1.224200       1.126200     -6.1600000E-02
 C    1.220500       1.223600      6.9999998E-04
 C   -4.595400      -2.339500     -0.1285000    
 C    4.416400      -2.336400      9.7700000E-02
 C   -5.994400      -2.257700     -0.1305000    
 C    5.809900      -2.383500      0.1347000    
 C  -3.4499999E-02  0.5041000     -2.8800000E-02
 C   -3.910500       2.986700       1.393600    
 C    4.357600       3.059000      -1.332400    
 C   -8.157900      -1.003300     -0.1148000    
 C    8.062700      -1.287100      0.1899000    
 H   -4.770300       2.741200     -0.5581000    
 H   -3.056600       3.051400     -0.5989000    
 H    3.351900       3.170400      0.5491000    
 H    5.019400       2.678500      0.6794000    
 H   -6.486300       1.142700     -7.2800003E-02
 H    6.552200      0.9658000      0.1362000    
 H   -1.222400       2.211800     -5.5399999E-02
 H    1.170800       2.309300     -7.1999999E-03
 H   -4.075500      -3.289100     -0.1440000    
 H    3.822400      -3.242000      8.5199997E-02
 H   -6.566600      -3.183400     -0.1498000    
 H    6.305000      -3.351700      0.1497000    
 H   5.4000001E-03 -0.5820000     -2.2800000E-02
 H   -2.977600       2.788800       1.930600    
 H   -4.101200       4.063700       1.428200    
 H   -4.718200       2.480700       1.932500    
 H    5.146700       2.489900      -1.834800    
 H    3.451300       2.982300      -1.942400    
 H    4.661700       4.110000      -1.306600    
 H   -8.530700      -1.044600      -1.143100    
 H   -8.544800     -9.5700003E-02  0.3613000    
 H   -8.563800      -1.854400      0.4425000    
 H    8.462500      -1.338000     -0.8277000    
 H    8.390300      -2.174600      0.7419000    
 H    8.497700     -0.4178000      0.6948000    


%chk=000148554-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000148554

1 1
O -2.497334 -0.671927 -0.038454
O 2.514767 -0.748646 0.035670
N -3.718770 1.238170 -0.069783
N 3.791633 1.123060 0.127257
C -4.646564 0.162437 -0.083058
C 4.687815 0.021105 0.097393
C -2.434198 0.728023 -0.029860
C 2.492498 0.651686 0.075471
C -3.880695 -1.023268 -0.071965
C 3.888075 -1.141001 0.049135
C -4.074158 2.674408 -0.037439
C 4.189382 2.548382 0.136023
C -6.051718 0.116122 -0.114530
C 6.091104 -0.066708 0.117463
C -6.667895 -1.162950 -0.137221
C 6.670222 -1.363057 0.091018
C -1.207210 1.410414 0.010878
C 1.286568 1.371491 0.062479
C -4.446841 -2.297745 -0.093025
C 4.416980 -2.431175 0.020941
C -5.860946 -2.341370 -0.126368
C 5.829501 -2.516618 0.043190
C 0.029685 0.737425 0.025558
C -4.207824 3.220508 1.398573
C 4.331620 3.132757 -1.283968
C -8.179571 -1.289371 -0.171066
C 8.177720 -1.534150 0.113917
H -5.022622 2.788197 -0.589981
H -3.307186 3.230910 -0.603811
H 3.442439 3.110276 0.723485
H 5.143522 2.617226 0.686154
H -6.661725 1.024475 -0.119744
H 6.727309 0.822962 0.149901
H -1.239731 2.503976 0.034647
H 1.351953 2.463759 0.077214
H -3.837395 -3.204194 -0.085303
H 3.781562 -3.318875 -0.015823
H -6.357180 -3.317547 -0.144057
H 6.297231 -3.506682 0.021864
H 0.013156 -0.360315 0.006487
H -3.258635 3.128450 1.954344
H -4.484244 4.288656 1.364807
H -4.990250 2.682711 1.960774
H 5.094522 2.588816 -1.866702
H 3.376935 3.085127 -1.835861
H 4.639846 4.190806 -1.220584
H -8.512961 -1.843045 -1.067709
H -8.676066 -0.304891 -0.181658
H -8.552493 -1.843893 0.709491
H 8.530150 -2.086175 -0.776378
H 8.498573 -2.110981 1.000743
H 8.702744 -0.564846 0.137475


