%chk=000064166.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000064166

0 1
 O    2.691900       1.301900      1.5000000E-03
 N    1.755800     -0.8270000      1.9999999E-04
 N    4.035600     -0.5594000     -7.9999998E-04
 C   0.3652000     -0.4286000      8.9999998E-04
 C   -2.027600      -1.255300     -1.7000000E-03
 C   -1.426000      0.8418000       1.260500    
 C   -1.421900      0.8433000      -1.260800    
 C  -0.5475000      -1.675100      3.0000001E-04
 C   5.1600002E-02  0.4137000       1.257400    
 C   5.5799998E-02  0.4156000      -1.254300    
 C   -2.315800     -0.4125000       1.252000    
 C   -2.311700     -0.4113000      -1.255800    
 C   -1.713100       1.675200     -9.9999997E-05
 C    2.807600      7.7600002E-02  5.0000002E-04
 H   -2.664900      -2.146500     -3.1000001E-03
 H   -1.637100       1.438400       2.155000    
 H   -1.630800       1.440700      -2.155200    
 H  -0.3389000      -2.299600      0.8791000    
 H  -0.3370000      -2.299800     -0.8779000    
 H   0.6717000       1.314900       1.313400    
 H   0.2727000     -0.1648000       2.164400    
 H   0.2792000     -0.1612000      -2.161800    
 H   0.6753000       1.317400      -1.307300    
 H   -3.373300     -0.1216000       1.272500    
 H   -2.131900      -1.008500       2.154400    
 H   -2.125000      -1.006500      -2.158100    
 H   -3.369100     -0.1204000      -1.279400    
 H   -2.759900       2.003100     -1.5000000E-03
 H   -1.095500       2.581800      1.4000000E-03
 H    1.979400      -1.817700     -3.0000001E-04
 H    4.111600      -1.570900     -1.6000000E-03
 H    4.901400     -3.0700000E-02 -8.9999998E-04


%chk=000064166-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000064166

0 1
O 2.796254 1.280837 0.003193
N 1.778391 -0.841107 0.000138
N 4.123007 -0.631612 0.002644
C 0.362012 -0.387958 -0.000294
C -2.030460 -1.263368 -0.002023
C -1.461432 0.856491 1.267610
C -1.460173 0.858063 -1.268452
C -0.529332 -1.661960 -0.001505
C 0.037873 0.452007 1.271334
C 0.039118 0.453547 -1.271251
C -2.342411 -0.421316 1.265665
C -2.341162 -0.419711 -1.268985
C -1.765831 1.701080 -0.000060
C 2.877090 0.011263 0.001147
H -2.648574 -2.182860 -0.002885
H -1.676844 1.455747 2.174168
H -1.674702 1.458420 -2.174489
H -0.303042 -2.275640 0.895524
H -0.302123 -2.274659 -0.898964
H 0.687904 1.344648 1.285658
H 0.271790 -0.150745 2.171981
H 0.273853 -0.148174 -2.172374
H 0.689179 1.346173 -1.283962
H -3.416271 -0.146736 1.279343
H -2.145558 -1.018780 2.178851
H -2.143452 -1.016074 -2.182706
H -3.415018 -0.145137 -1.283339
H -2.828563 2.017217 -0.000408
H -1.147021 2.619837 0.000781
H 1.934047 -1.850608 0.000112
H 4.247352 -1.641455 0.001936
H 4.941899 -0.029430 0.004512


