%chk=000082081.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000082081

0 1
 O   0.2802000       1.455400     -4.9000001E-03
 O   -2.510500       1.085300      3.5999999E-03
 N    2.702000      0.2547000      4.4000000E-03
 N  -0.8655000     -0.5754000      9.9999997E-05
 C    1.536900     -0.6174000      1.1000000E-03
 C   0.2788000      0.2272000     -4.0000002E-03
 C    3.935100     -0.5215000     -8.9999998E-04
 C   -2.174000     -9.5700003E-02  3.5999999E-03
 C   -3.183000      -1.212700     -3.0000000E-03
 H    1.523000      -1.257700      0.8909000    
 H    1.527900      -1.248200     -0.8954000    
 H    2.684500      0.8430000      0.8375000    
 H  -0.7342000      -1.584300     -7.9999998E-04
 H    4.793200      0.1578000     -4.3000001E-03
 H    4.006000      -1.145900     -0.8974000    
 H    4.012700      -1.158000      0.8866000    
 H   -4.192800     -0.7985000      6.3500002E-02
 H   -3.092800      -1.785800     -0.9300000    
 H   -3.015100      -1.872800      0.8527000    


%chk=000082081-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000082081

0 1
O 0.377607 1.399114 0.327940
O -2.524861 1.078759 0.483572
N 2.726444 0.088440 -0.269786
N -0.897278 -0.565303 0.004485
C 1.565491 -0.726099 0.056014
C 0.309494 0.162830 0.135799
C 4.033087 -0.485199 0.062360
C -2.235693 -0.093460 0.158827
C -3.275307 -1.180158 -0.119086
H 1.650855 -1.241868 1.051965
H 1.417758 -1.532278 -0.696490
H 2.587775 1.069385 0.002124
H -0.795785 -1.555897 -0.236050
H 4.826549 0.241571 -0.182916
H 4.222086 -1.393309 -0.542372
H 4.146624 -0.771677 1.138128
H -4.276031 -0.768925 0.075356
H -3.226262 -1.511811 -1.173131
H -3.120154 -2.064615 0.526560


