%chk=000156710.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000156710

0 1
 O    1.546500      0.9380000       1.972400    
 N    1.130000      0.7412000     -6.5899998E-02
 N    1.596000       1.522900      0.8860000    
 C   -2.557700     -0.8637000      0.5185000    
 C   -1.523100      -1.741400     -0.1952000    
 C   -2.129800      0.6010000      0.6833000    
 C  -0.2876000      -2.029700      0.6616000    
 C   -2.029400       1.358600     -0.6466000    
 C   0.9131000      -2.515900     -0.1523000    
 C  -0.7902000       2.251700     -0.7858000    
 C    1.509900      -1.520800      -1.161300    
 C   0.5065000       1.501300      -1.163100    
 C    2.115800     -0.2432000     -0.5515000    
 H   -3.497900     -0.8957000     -4.5899998E-02
 H   -2.771900      -1.287700       1.507000    
 H   -1.994300      -2.699400     -0.4492000    
 H   -1.247600      -1.283400      -1.147400    
 H   -2.886700       1.102200       1.300900    
 H   -1.205900      0.6635000       1.260500    
 H  -9.9999997E-05  -1.169600       1.266900    
 H  -0.5516000      -2.812100       1.385300    
 H   -2.091300      0.6878000      -1.509900    
 H   -2.913900       2.005300     -0.7219000    
 H    1.703100      -2.817400      0.5471000    
 H   0.6249000      -3.424700     -0.6956000    
 H  -0.9929000       2.960500      -1.599800    
 H  -0.6552000       2.863000      0.1140000    
 H    2.324300      -2.045400      -1.679500    
 H   0.7838000      -1.282000      -1.943600    
 H   0.2620000      0.8382000      -2.001100    
 H    1.226300       2.230600      -1.562700    
 H    2.778000     -0.5686000      0.2642000    
 H    2.773700      0.2296000      -1.294200    


%chk=000156710-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000156710

0 1
O 1.843483 0.605091 1.972610
N 1.231754 0.856181 -0.187275
N 1.179885 1.309533 1.116338
C -2.620726 -0.879116 0.563408
C -1.601206 -1.848746 -0.090744
C -2.130336 0.590935 0.643030
C -0.291588 -2.036496 0.718531
C -1.943713 1.276587 -0.742689
C 0.906653 -2.519254 -0.137658
C -0.793645 2.318691 -0.809024
C 1.436623 -1.508245 -1.188450
C 0.592521 1.745853 -1.193994
C 2.134437 -0.242458 -0.622502
H -3.573969 -0.917220 -0.004081
H -2.852388 -1.235188 1.588171
H -2.081015 -2.837168 -0.240664
H -1.359855 -1.479063 -1.107362
H -2.854597 1.179810 1.240247
H -1.183439 0.633042 1.208107
H -0.011733 -1.098591 1.228739
H -0.468895 -2.773077 1.527609
H -1.767178 0.509880 -1.523958
H -2.892489 1.773841 -1.025283
H 1.744310 -2.794739 0.534585
H 0.615561 -3.447558 -0.672383
H -1.026281 3.073391 -1.587058
H -0.712689 2.863355 0.148656
H 2.189261 -2.026743 -1.816048
H 0.624587 -1.207844 -1.880680
H 0.495155 1.150491 -2.120424
H 1.289709 2.582247 -1.410456
H 2.743200 -0.502588 0.263175
H 2.805405 0.179866 -1.397273


