%chk=000048836.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000048836

0 1
 O   0.5151000      -1.101200     -0.2083000    
 O   0.9774000       1.659000      0.4787000    
 N   -2.926900      0.1949000     -0.1654000    
 C   -1.846200     -0.7850000     -4.8700001E-02
 C  -0.5081000     -9.8800004E-02 -0.2810000    
 C  -0.2482000      0.9775000      0.7646000    
 C   -1.891300      -1.456900       1.322400    
 C   -4.217400     -0.4330000      0.1131000    
 C   -2.927400      0.7973000      -1.497600    
 C    1.769000     -0.5540000     -0.1356000    
 C    1.992400      0.7864000      0.1866000    
 C   -5.347900      0.5736000      5.7500001E-02
 C    2.848100      -1.400900     -0.3900000    
 C    3.292500       1.291600      0.2116000    
 C    4.148800     -0.8982000     -0.3514000    
 C    4.370300      0.4475000     -5.6400001E-02
 H   -1.956800      -1.581900     -0.7985000    
 H  -0.4250000      0.3116000      -1.293800    
 H   -1.032000       1.740900      0.7733000    
 H  -0.1633000      0.5700000       1.779400    
 H  -0.9628000      -1.995600       1.541200    
 H   -2.050000     -0.7420000       2.138000    
 H   -2.682000      -2.213900       1.375600    
 H   -4.426400      -1.263500     -0.5732000    
 H   -4.251000     -0.8305000       1.132100    
 H   -2.041600       1.412000      -1.680600    
 H   -3.742100       1.516000      -1.628200    
 H   -3.008700      4.8400000E-02  -2.294100    
 H   -5.110100       1.485900      0.6155000    
 H   -5.621100      0.8437000     -0.9671000    
 H   -6.247200      0.1415000      0.5116000    
 H    2.683800      -2.448000     -0.6290000    
 H    3.474500       2.336200      0.4492000    
 H    4.990000      -1.554200     -0.5556000    
 H    5.383800      0.8373000     -3.1099999E-02


%chk=000048836-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000048836

0 1
O 0.573315 -1.073026 -0.262006
O 0.985648 1.662693 0.688912
N -2.977753 0.109307 -0.384182
C -1.851587 -0.855114 -0.138807
C -0.520213 -0.062694 -0.221498
C -0.267829 0.910392 0.935134
C -1.944603 -1.633503 1.190297
C -4.284432 -0.254215 0.228191
C -3.127919 0.398310 -1.831596
C 1.864363 -0.510147 -0.130378
C 2.063404 0.827548 0.314977
C -5.300200 0.904916 0.197476
C 2.973806 -1.313822 -0.463758
C 3.368256 1.356325 0.390450
C 4.280000 -0.785729 -0.373783
C 4.476357 0.553764 0.043069
H -1.805288 -1.615089 -0.958507
H -0.471268 0.513097 -1.166597
H -1.069576 1.661079 0.988313
H -0.173780 0.372874 1.897415
H -1.001680 -2.188776 1.332259
H -2.089423 -0.968527 2.060522
H -2.768932 -2.366160 1.173698
H -4.735993 -1.152793 -0.268198
H -4.108748 -0.523600 1.281834
H -2.153898 0.653161 -2.280863
H -3.792134 1.264769 -1.983276
H -3.548265 -0.470527 -2.398027
H -4.846607 1.818755 0.621248
H -5.655040 1.133783 -0.822517
H -6.186951 0.641676 0.802947
H 2.792290 -2.339941 -0.799375
H 3.492067 2.389147 0.731310
H 5.137627 -1.414286 -0.635111
H 5.487188 0.970050 0.105225


