%chk=000029658.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000029658

1 1
 O   -1.262900     -0.1405000     -1.2700000E-02
 O  -0.1900000       1.901700     -2.4999999E-03
 N    3.569100     -0.2908000      5.9000002E-03
 C    2.364500      0.6385000      4.5800000E-02
 C    4.845300      0.5264000      0.1469000    
 C    3.477200      -1.289600       1.150700    
 C    3.589500      -1.038600      -1.319400    
 C    1.080900     -0.1743000     -2.9600000E-02
 C  -0.1694000      0.6787000     -1.7300000E-02
 C   -3.634800     -0.5232000      1.4100000E-02
 C   -2.530300      0.5241000      1.2000000E-02
 C   -5.019500      0.1181000      2.3900000E-02
 C   -6.119400     -0.9305000     -1.7700000E-02
 H    2.449500       1.337700     -0.7948000    
 H    2.414000       1.213500      0.9785000    
 H    4.815400       1.050900       1.106500    
 H    5.702400     -0.1527000      0.1107000    
 H    4.890200       1.241100     -0.6802000    
 H    2.700600      -2.030300      0.9446000    
 H    4.439100      -1.807600       1.223500    
 H    3.277600     -0.7452000       2.078400    
 H    2.789600      -1.782200      -1.346900    
 H    3.488300     -0.3148000      -2.133500    
 H    4.550600      -1.557000      -1.399300    
 H    1.025700     -0.7596000     -0.9517000    
 H   0.9831000     -0.8412000      0.8325000    
 H   -3.513200      -1.179700      0.8847000    
 H   -3.521600      -1.169100     -0.8657000    
 H   -2.619000       1.164100     -0.8737000    
 H   -2.596600       1.143500      0.9141000    
 H   -5.127900      0.7846000     -0.8397000    
 H   -5.139300      0.7317000      0.9243000    
 H   -6.047700      -1.538900     -0.9249000    
 H   -6.059100      -1.596800      0.8489000    
 H   -7.102500     -0.4493000     -8.2999999E-03


%chk=000029658-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000029658

1 1
O -1.322349 -0.261543 0.009173
O -0.081892 1.478392 0.955639
N 3.655383 -0.294269 -0.045259
C 2.283968 0.423483 -0.090924
C 4.738585 0.759920 -0.289962
C 3.891070 -0.927933 1.325265
C 3.745611 -1.364520 -1.131303
C 1.055318 -0.493826 -0.000196
C -0.162914 0.369172 0.375943
C -3.756620 -0.443203 -0.171114
C -2.624702 0.429151 0.362127
C -5.139795 0.185062 0.135629
C -6.300658 -0.680198 -0.399165
H 2.268775 0.995193 -1.034934
H 2.265662 1.146189 0.743258
H 4.646492 1.550694 0.469773
H 5.728577 0.284416 -0.218525
H 4.602084 1.190397 -1.293469
H 3.139781 -1.708854 1.507929
H 4.896154 -1.376544 1.341529
H 3.815807 -0.147935 2.097907
H 3.011767 -2.156944 -0.927141
H 3.535683 -0.903550 -2.108633
H 4.760953 -1.790140 -1.129499
H 0.835705 -1.024416 -0.940450
H 1.154161 -1.256007 0.796218
H -3.695825 -1.449653 0.284779
H -3.640717 -0.571753 -1.264121
H -2.603847 1.432896 -0.099017
H -2.652289 0.542870 1.460865
H -5.196008 1.197085 -0.313218
H -5.252770 0.318995 1.230199
H -6.234250 -0.803662 -1.495976
H -6.290180 -1.687895 0.055903
H -7.277321 -0.218366 -0.171131


