%chk=000100298.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000100298

0 1
 O    4.441400      0.2927000      0.3973000    
 N    2.510800     -0.9581000     -0.1101000    
 N   -4.043600     -0.5130000      0.2127000    
 N   -2.154400      0.1784000     -0.6860000    
 N   -2.741900     -0.1187000      0.3769000    
 N    4.583900      -1.963800      6.6799998E-02
 C    1.492300     -4.4999998E-03 -0.1247000    
 C  -0.8382000      0.5640000     -0.4123000    
 C   0.1796000     -0.3898000     -0.3972000    
 C    1.787000       1.334500      0.1326000    
 C  -0.5433000       1.902900     -0.1550000    
 C   0.7693000       2.288100      0.1175000    
 C   -4.510400      -1.180500     -0.9902000    
 C   -4.812500     -0.6630000       1.431500    
 C    3.880100     -0.7693000      0.1403000    
 H  -5.4499999E-02  -1.432800     -0.5995000    
 H    2.777500       1.708300      0.3511000    
 H   -1.329200       2.653700     -0.1654000    
 H   0.9975000       3.331100      0.3175000    
 H    2.223400      -1.913800     -0.3064000    
 H   -4.068300     -0.7360000      -1.885400    
 H   -5.597200      -1.076800      -1.060100    
 H   -4.246000      -2.239600     -0.9291000    
 H   -4.724400      -1.694700       1.782700    
 H   -5.860400     -0.4251000       1.229200    
 H   -4.435800      2.1900000E-02   2.197100    
 H    5.585800      -1.992400      0.2240000    
 H    4.123600      -2.842500     -0.1452000    


%chk=000100298-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000100298

0 1
O 4.621342 0.429695 0.143756
N 2.751230 -0.925931 -0.377337
N -4.264681 -0.418533 0.100461
N -2.034649 -0.515658 -0.030391
N -3.077545 0.205753 0.332097
N 4.934128 -1.679900 -0.783304
C 1.665951 -0.093135 0.019711
C -0.781500 0.138940 0.207529
C 0.359239 -0.615096 -0.156982
C 1.837421 1.204574 0.569825
C -0.613894 1.441106 0.759487
C 0.688596 1.946834 0.929106
C -4.340218 -1.758438 -0.502245
C -5.468255 0.323640 0.478484
C 4.123567 -0.644996 -0.304949
H 0.197149 -1.614679 -0.580470
H 2.843518 1.604168 0.704907
H -1.494515 2.024821 1.040819
H 0.825320 2.948584 1.353154
H 2.476335 -1.834069 -0.756282
H -3.848703 -1.764721 -1.492562
H -5.400606 -2.039162 -0.603169
H -3.810378 -2.497759 0.126517
H -6.057389 -0.226725 1.237076
H -6.116307 0.512479 -0.399082
H -5.148575 1.287552 0.902484
H 5.937205 -1.518148 -0.748680
H 4.588317 -2.559997 -1.159361


