%chk=000152590.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000152590

0 1
 O   -7.288200       1.051600       1.019800    
 O   -5.351000       2.022200      0.3419000    
 N  -8.9100003E-02 -0.7273000      -1.308700    
 N    3.600400     -0.6167000      0.6768000    
 N    3.806400       4.162700      0.2395000    
 C    1.162000     -0.6898000     -0.6355000    
 C    1.802000      0.5365000     -0.4297000    
 C    1.742500      -1.879600     -0.1846000    
 C    3.036900      0.5264000      0.2405000    
 C    2.979800      -1.795200      0.4760000    
 C    1.241700       1.747400     -0.8723000    
 C    3.679100       1.744200      0.4483000    
 C   -1.410100     -0.6472000     -0.8488000    
 C    1.121700      -3.126100     -0.3778000    
 C    3.125100       2.949400      9.8999999E-03
 C    1.903800       2.951500     -0.6519000    
 C    3.562900      -2.976300      0.9274000    
 C    1.725600      -4.292000      8.3099999E-02
 C   -2.477700     -0.7117000      -1.751500    
 C   -1.675400     -0.5013000      0.5176000    
 C   -4.049400     -0.4863000      6.9499999E-02
 C    2.948700      -4.216700      0.7371000    
 C   -3.792900     -0.6314000      -1.293900    
 C   -2.990500     -0.4211000      0.9752000    
 C   -5.455500     -0.4010000      0.5593000    
 C    3.131500       5.411400      0.4152000    
 C   -5.990400       1.016300      0.6175000    
 H   9.7000003E-03 -0.8345000      -2.314000    
 H   0.2915000       1.783900      -1.398800    
 H    4.637300       1.754300      0.9668000    
 H   0.1675000      -3.221500     -0.8893000    
 H    1.447400       3.867400      -1.014900    
 H    4.521200      -2.943500       1.442700    
 H   -2.293500     -0.8241000      -2.817200    
 H  -0.8705000     -0.4471000       1.246100    
 H    1.244800      -5.253500     -6.8400003E-02
 H    3.428600      -5.120500       1.100500    
 H   -4.609000     -0.6815000      -2.010000    
 H   -3.177100     -0.3060000       2.039700    
 H    4.747500       4.083900      0.6113000    
 H   -5.527800     -0.8344000       1.564200    
 H   -6.111900     -0.9877000     -9.4800003E-02
 H    2.350600       5.341700       1.179700    
 H    2.688900       5.764000     -0.5216000    
 H    3.846400       6.173600      0.7417000    
 H   -7.633800       1.968900       1.057900    


%chk=000152590-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000152590

0 1
O -6.805962 0.312329 1.683341
O -7.042467 0.430551 -0.624108
N -0.262678 -0.009870 -1.161770
N 3.543744 -0.522011 0.800791
N 4.578361 4.162365 0.187231
C 0.960925 -0.202059 -0.471327
C 1.831074 0.917976 -0.293836
C 1.390309 -1.494784 -0.021809
C 3.139445 0.702670 0.323951
C 2.690292 -1.582279 0.641777
C 1.482039 2.260774 -0.669245
C 4.036610 1.802961 0.465891
C -1.568354 -0.379289 -0.756155
C 0.646980 -2.705378 -0.243824
C 3.687067 3.100942 0.048167
C 2.369964 3.317924 -0.512550
C 3.131809 -2.865572 1.126358
C 1.118906 -3.931537 0.219484
C -2.632241 -0.257032 -1.694366
C -1.865381 -0.824201 0.560460
C -4.252661 -1.033956 -0.018378
C 2.366169 -4.010034 0.928432
C -3.952711 -0.574244 -1.326508
C -3.191575 -1.147313 0.912298
C -5.687588 -1.387009 0.377694
C 4.292304 5.544335 -0.192520
C -6.573365 -0.150062 0.379490
H -0.221742 0.631555 -1.956229
H 0.478308 2.472829 -1.055568
H 5.008840 1.592943 0.925211
H -0.298834 -2.660331 -0.790618
H 2.061650 4.328310 -0.798309
H 4.099186 -2.893813 1.637303
H -2.416911 0.080197 -2.716124
H -1.067180 -0.907507 1.303502
H 0.540835 -4.843908 0.036538
H 2.718793 -4.979847 1.297320
H -4.760699 -0.460623 -2.058330
H -3.402529 -1.483908 1.934272
H 5.485798 3.956388 0.601121
H -5.709763 -1.848221 1.377014
H -6.121857 -2.095778 -0.350629
H 3.442545 5.969541 0.379421
H 4.062001 5.639959 -1.272697
H 5.179720 6.164226 0.016076
H -7.351476 1.145088 1.643257


