%chk=000026631.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000026631

0 1
 I   -6.480900       2.641600     -4.7600001E-02
 O    5.664500      3.6699999E-02 -7.1999999E-03
 O   -2.058200     -0.3691000      6.8000001E-03
 O  -0.5135000      -2.055300     -1.6400000E-02
 N   0.1211000      0.2025000      8.6000003E-03
 C    1.515600      0.1612000      5.1000002E-03
 C    2.248900       1.347600      1.7000001E-02
 C    2.176400      -1.067200     -1.1600000E-02
 C    4.304100      7.7500001E-02 -4.6000001E-03
 C    3.643100       1.305800      1.2100000E-02
 C    3.570700      -1.109100     -1.6500000E-02
 C  -0.7797000     -0.8597000     -1.6000000E-03
 C    6.351700       1.287000      7.6000001E-03
 C   -3.106500      -1.345200     -3.0000000E-03
 C   -4.405400     -0.6736000      7.4999998E-03
 C   -5.472300     -0.1216000      1.6200000E-02
 C   -6.779600      0.5409000      2.7400000E-02
 H    1.745800       2.311300      2.9899999E-02
 H    1.676700      -2.025900     -2.1600001E-02
 H    4.150400       2.264400      2.2000000E-02
 H    4.081200      -2.068400     -2.9200001E-02
 H  -0.2949000       1.130600      2.0500001E-02
 H    6.144600       1.849200      0.9245000    
 H    6.142200       1.872000     -0.8944000    
 H    7.424200       1.066500      3.5000001E-03
 H   -3.010900      -1.985400      0.8814000    
 H   -3.014300      -1.964000     -0.9028000    
 H   -7.332500      0.2690000      0.9326000    
 H   -7.376400      0.2121000     -0.8298000    


%chk=000026631-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000026631

0 1
I -6.702666 2.746845 -0.012726
O 5.753672 0.040300 0.003293
O -2.105988 -0.341295 -0.000056
O -0.548195 -2.115817 -0.014778
N 0.091820 0.173745 0.004929
C 1.516805 0.117837 0.004606
C 2.223771 1.344331 0.009078
C 2.241721 -1.105397 0.000049
C 4.352726 0.147154 0.004180
C 3.634924 1.368186 0.008873
C 3.646550 -1.081334 -0.000071
C -0.792969 -0.883000 -0.003937
C 6.523523 1.285216 0.005665
C -3.176443 -1.379695 -0.018459
C -4.467853 -0.692395 0.000906
C -5.571845 -0.140025 0.016671
C -6.870381 0.498631 0.036296
H 1.673261 2.293688 0.012547
H 1.702443 -2.054801 -0.003750
H 4.151210 2.332411 0.012254
H 4.220094 -2.013161 -0.003593
H -0.342247 1.099541 0.011197
H 6.315878 1.886871 0.912450
H 6.313893 1.891407 -0.897636
H 7.577890 0.971914 0.003762
H -3.051233 -2.038632 0.861204
H -3.057411 -1.999923 -0.926630
H -7.435991 0.307795 0.960569
H -7.480859 0.271003 -0.850492


