%chk=000095438.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000095438

0 1
 O   -1.435000     -0.9142000      -1.728400    
 O   -2.212100      -2.207200     -4.5499999E-02
 N    1.688100       2.075300     -0.3986000    
 N   -3.678300     -4.8999999E-02  0.9126000    
 C   -2.437900      0.2141000      0.1675000    
 C   -1.327600      0.7158000       1.147300    
 C  -4.0000002E-03   1.003900      0.5585000    
 C    1.075500      8.8600002E-02  0.4107000    
 C   -2.781500       1.281500     -0.8832000    
 C    2.124500      0.7860000     -0.1923000    
 C   0.4030000       2.216600      5.1899999E-02
 C   -2.034400      -1.091900     -0.5226000    
 C    1.261400      -1.270400      0.7329000    
 C    3.355000      0.1899000     -0.4902000    
 C    2.486900      -1.880000      0.4407000    
 C    3.516300      -1.159100     -0.1614000    
 H   -1.688400       1.619100       1.660200    
 H   -1.198900     -3.3100002E-02   1.942000    
 H   -3.574500      0.9378000      -1.559400    
 H   -1.924300       1.537600      -1.514800    
 H   -3.126000       2.209500     -0.4111000    
 H  -0.1045000       3.167900     -2.9300001E-02
 H    2.237600       2.810600     -0.8216000    
 H   -4.429400     -0.2930000      0.2677000    
 H   -3.981000      0.7991000       1.390700    
 H   0.4726000      -1.847700       1.206100    
 H    4.156900      0.7501000     -0.9589000    
 H    2.636300      -2.927700      0.6878000    
 H    4.460100      -1.652300     -0.3794000    
 H   -1.178800      -1.767500      -2.138600    


%chk=000095438-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000095438

0 1
O -1.562894 -0.960974 -1.757216
O -2.107450 -2.105222 0.180557
N 1.794426 2.141988 -0.312704
N -3.750621 0.170460 0.910120
C -2.506418 0.340749 0.123785
C -1.389578 0.799013 1.141304
C -0.017381 1.054391 0.572312
C 1.057140 0.090623 0.372402
C -2.741164 1.401019 -0.965983
C 2.179618 0.802224 -0.184195
C 0.477643 2.288364 0.146614
C -2.058699 -1.023082 -0.455043
C 1.186729 -1.303700 0.620848
C 3.402776 0.168723 -0.497182
C 2.404935 -1.940035 0.314248
C 3.500794 -1.213827 -0.241090
H -1.799580 1.713579 1.606892
H -1.333487 0.029345 1.936626
H -3.525832 1.078863 -1.674892
H -1.821226 1.583547 -1.541085
H -3.067962 2.338479 -0.482843
H -0.011498 3.261206 0.146822
H 2.382023 2.893280 -0.666343
H -3.680430 -0.595247 1.592850
H -4.584001 0.062247 0.319087
H 0.353557 -1.876909 1.042134
H 4.247276 0.724239 -0.920745
H 2.518219 -3.013057 0.505235
H 4.434780 -1.739535 -0.469462
H -1.224095 -1.860455 -2.021753


