%chk=000068765.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000068765

0 1
 O  -0.3708000       2.544400     -0.1268000    
 O   -4.359000      0.2144000     -0.4037000    
 O    5.603900      2.6000000E-03 -0.6955000    
 O    4.068900     -0.1568000      -2.256900    
 N  -0.3260000      0.2308000      0.1351000    
 N   -2.339300       1.376800     -0.4495000    
 N    4.402000     -1.5300000E-02  -1.055400    
 C   -1.022700      -1.019100      0.1006000    
 C   -2.405700      -1.029300     -0.1023000    
 C  -0.9575000       1.455800     -0.1634000    
 C   -3.132500      0.2303000     -0.3313000    
 C    1.055300      0.2500000      0.5202000    
 C   -3.016200       2.629000     -0.7751000    
 C  -0.3749000      -2.265700      0.2040000    
 C   -3.128100      -2.234000     -0.1299000    
 C    2.044100      0.1102000     -0.4481000    
 C    1.394600      0.4080000       1.859800    
 C   -1.090700      -3.466300      0.1727000    
 C   -3.435000       3.342200      0.4962000    
 C   -2.469500      -3.450100      1.6799999E-02
 C    3.387300      0.1287000     -7.2499998E-02
 C    2.737700      0.4265000       2.235500    
 C    3.734100      0.2869000       1.269400    
 H   -2.347200       3.270500      -1.359300    
 H   -3.898200       2.424500      -1.392100    
 H   0.7023000      -2.336200      0.3306000    
 H   -4.204600      -2.244600     -0.2795000    
 H    1.747000     -1.0700000E-02  -1.487400    
 H   0.6257000      0.5179000       2.619900    
 H  -0.5655000      -4.411900      0.2717000    
 H   -4.117700       2.726100       1.090800    
 H   -2.573100       3.584000       1.126400    
 H   -3.948300       4.277900      0.2532000    
 H   -3.028200      -4.380600     -8.0000004E-03
 H    3.007200      0.5497000       3.280400    
 H    4.769700      0.3058000       1.598900    


%chk=000068765-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000068765

0 1
O -0.293855 2.497708 -0.045398
O -4.358030 0.291359 -0.792832
O 5.665057 0.123737 -0.815946
O 4.029248 -0.045386 -2.395931
N -0.347150 0.170823 0.177646
N -2.320229 1.387003 -0.451667
N 4.427053 0.077769 -1.175350
C -1.047539 -1.060398 0.137862
C -2.431012 -1.051951 -0.197967
C -0.950361 1.422840 -0.106190
C -3.128602 0.215489 -0.503098
C 1.062610 0.208165 0.529090
C -2.974716 2.697629 -0.739050
C -0.403227 -2.293379 0.424814
C -3.154571 -2.269696 -0.241948
C 2.033330 0.124704 -0.486290
C 1.442220 0.328951 1.884925
C -1.138890 -3.491990 0.373629
C -3.530928 3.354585 0.538509
C -2.517848 -3.489520 0.040949
C 3.391294 0.166022 -0.110588
C 2.810866 0.369728 2.232735
C 3.802683 0.288038 1.233645
H -2.217089 3.343522 -1.209671
H -3.787861 2.489118 -1.452283
H 0.658936 -2.314914 0.681679
H -4.216073 -2.216812 -0.504172
H 1.756972 0.039629 -1.540140
H 0.666977 0.401394 2.654101
H -0.632361 -4.437761 0.594369
H -4.283797 2.706026 1.017684
H -2.720713 3.566768 1.256797
H -4.018309 4.311928 0.280555
H -3.077335 -4.428900 0.003720
H 3.102895 0.470338 3.282297
H 4.869455 0.319833 1.469016


