%chk=000168298.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000168298

0 1
 O    2.061300     -0.2369000      -1.434000    
 O    2.932600      -2.218600      0.1763000    
 N    2.028300       2.250000      0.1980000    
 N   -4.898300     -0.4913000     -0.2222000    
 N    2.297700      -1.084200      0.6978000    
 C  -0.2310000       1.232500     -2.8600000E-02
 C   -1.167200      6.4499997E-02  0.3093000    
 C    1.221900       1.055200      0.4412000    
 C   -2.600800      0.3585000     -0.1431000    
 C   -3.542200     -0.7874000      0.2245000    
 C    1.897800     -0.1422000     -0.2191000    
 H  -0.2456000       1.390300      -1.115400    
 H  -0.6392000       2.146400      0.4235000    
 H  -0.8124000     -0.8519000     -0.1761000    
 H   -1.150700     -0.1126000       1.391400    
 H    1.197700      0.9020000       1.527700    
 H   -2.613300      0.5195000      -1.228600    
 H   -2.948100       1.288200      0.3253000    
 H   -3.548300     -0.9442000       1.308500    
 H   -3.207900      -1.720600     -0.2412000    
 H    2.941500       2.141800      0.6379000    
 H    1.591200       3.055400      0.6443000    
 H   -4.900300     -0.3338000      -1.229300    
 H   -5.214100      0.3823000      0.1978000    
 H    2.293200     -0.9862000       1.706500    
 H    2.176200      -2.826400      0.1154000    


%chk=000168298-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000168298

0 1
O 2.175623 -0.235589 -1.243993
O 2.746663 -2.384302 0.218733
N 2.035662 2.303195 0.383373
N -4.983628 -0.562603 -0.258881
N 2.135098 -1.219584 0.810962
C -0.208101 1.295848 0.091206
C -1.178326 0.138480 0.412370
C 1.225838 1.095692 0.642276
C -2.607706 0.400385 -0.115440
C -3.599465 -0.747334 0.219634
C 1.860633 -0.152663 -0.001375
H -0.142264 1.430694 -1.007413
H -0.585716 2.243953 0.517777
H -0.799718 -0.807358 -0.026275
H -1.220155 -0.017478 1.511955
H 1.165811 0.952201 1.740390
H -2.575342 0.540543 -1.216028
H -2.995893 1.348906 0.311755
H -3.633088 -0.890227 1.318015
H -3.215142 -1.696091 -0.203648
H 2.944259 2.299449 0.862504
H 2.156507 2.464821 -0.624967
H -5.075991 -0.558297 -1.279686
H -5.470616 0.232696 0.166654
H 1.935883 -1.351736 1.800570
H 2.829176 -2.073301 -0.742665


