%chk=000107919.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000107919

0 1
 O   -4.352300     -0.2724000       1.279800    
 O   -4.588600      0.5200000     -0.8310000    
 O    2.046400       1.918300     -0.6869000    
 O    4.387100      -1.907300      0.3424000    
 N    1.231900      0.4659000      0.8991000    
 N   -2.508200     -0.9480000      -1.772700    
 N    3.273100      8.9999996E-03 -0.2171000    
 N    3.375600      -1.241500      0.5887000    
 C   -1.544800     -0.6099000      0.4870000    
 C   -1.129600      0.8587000      0.3041000    
 C   -2.770500      -1.033200     -0.3365000    
 C   5.5799998E-02   1.240200       1.187600    
 C   -3.986500     -0.1789000     -2.6100000E-02
 C    2.176900      0.8693000     -4.7699999E-02
 C    4.333700      0.3099000      -1.170500    
 H  -0.7049000      -1.267400      0.2285000    
 H   -1.753300     -0.7840000       1.550500    
 H   -1.968000       1.519800      0.5506000    
 H  -0.8661000       1.045400     -0.7431000    
 H   -3.031400      -2.072200     -0.1055000    
 H   0.2813000       2.304700       1.061300    
 H  -0.1894000       1.076900       2.242600    
 H    1.352400     -0.4009000       1.410400    
 H   -1.671500      -1.484200      -1.999800    
 H   -2.307300      1.4300000E-02  -2.040100    
 H   -5.137500      0.2806000       1.479500    
 H    5.283300      0.3972000     -0.6340000    
 H    4.140400       1.249300      -1.695000    
 H    4.392400     -0.4969000      -1.907300    


%chk=000107919-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000107919

0 1
O -4.545409 -0.420983 1.071877
O -4.360560 0.717987 -0.943086
O 1.953010 1.848459 -0.802773
O 4.424831 -1.845437 0.395357
N 1.323623 0.482782 0.998429
N -2.330325 -0.968645 -1.775328
N 3.280305 -0.023015 -0.247441
N 3.398688 -1.110990 0.612047
C -1.571710 -0.585333 0.641615
C -1.117238 0.877538 0.467982
C -2.697925 -1.027437 -0.363730
C 0.108346 1.247234 1.336773
C -3.931965 -0.155582 -0.157481
C 2.126071 0.853965 -0.046531
C 4.261339 0.247368 -1.310889
H -0.713669 -1.266840 0.473003
H -1.932760 -0.760275 1.674110
H -1.941230 1.567419 0.738725
H -0.873057 1.077035 -0.592410
H -2.987906 -2.058783 -0.076519
H 0.333136 2.320818 1.207093
H -0.107691 1.068149 2.406318
H 1.595091 -0.352550 1.525058
H -1.410293 -1.330333 -2.022674
H -2.635674 -0.133962 -2.279088
H -5.334469 0.176167 1.180636
H 5.262037 0.399453 -0.870972
H 3.928724 1.150911 -1.840749
H 4.317078 -0.612419 -2.000553


