%chk=000135655.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000135655

0 1
 O   -5.011100      0.4578000       2.132900    
 O   -5.682600     -0.6777000     -0.2715000    
 N  -0.2232000      0.1576000      -1.278000    
 N    3.478200     -0.2887000      0.6375000    
 C    1.031900      6.2000002E-03 -0.6283000    
 C    1.496800      -1.273300     -0.3077000    
 C    1.791500       1.138000     -0.3155000    
 C    2.742700      -1.375700      0.3339000    
 C    3.025900      0.9414000      0.3263000    
 C   0.7545000      -2.428100     -0.6104000    
 C    1.348900       2.435700     -0.6262000    
 C    3.210900      -2.646800      0.6558000    
 C    3.786700       2.064400      0.6404000    
 C   -1.464700      0.3105000     -0.7069000    
 C    1.244900      -3.687300     -0.2781000    
 C    2.128500       3.541900     -0.3015000    
 C    2.475700      -3.796500      0.3564000    
 C    3.349900       3.355400      0.3332000    
 C   -1.600400      0.3566000      0.6297000    
 C   -2.570300      0.4421000      -1.636600    
 C   -2.783500      0.5396000       1.428300    
 C   -3.876500      0.2357000      -1.443700    
 C   -4.065400      0.3085000       1.126700    
 C   -4.589500     -0.1170000     -0.1968000    
 H  -0.1813000      9.4999999E-02  -2.290000    
 H  -0.2090000      -2.379800      -1.110900    
 H   0.4019000       2.617600      -1.127500    
 H    4.172700      -2.758700       1.153100    
 H    4.747500       1.944500       1.137700    
 H   0.6704000      -4.577800     -0.5141000    
 H    1.785200       4.542900     -0.5436000    
 H    2.867900      -4.774400      0.6198000    
 H    3.966300       4.211700      0.5907000    
 H  -0.7166000      0.2673000       1.260800    
 H   -2.278900      0.6957000      -2.656700    
 H   -2.546800      0.8469000       2.447600    
 H   -4.528100      0.3102000      -2.313100    
 H   -4.564800      0.7319000       2.952200    


%chk=000135655-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000135655

0 1
O -5.043483 1.777463 1.906984
O -6.021981 1.194651 -0.484247
N -0.347501 -0.448355 -1.117811
N 3.617414 -0.298696 0.564727
C 0.939806 -0.374106 -0.525120
C 1.702971 -1.578642 -0.385643
C 1.527979 0.874146 -0.139642
C 3.059393 -1.477218 0.144453
C 2.870892 0.844221 0.435191
C 1.192147 -2.881467 -0.721862
C 0.894685 2.150658 -0.337754
C 3.854925 -2.671584 0.255236
C 3.476023 2.081082 0.856913
C -1.579362 0.039206 -0.610253
C 1.990197 -4.016616 -0.595676
C 1.521728 3.327759 0.062468
C 3.339812 -3.909704 -0.115033
C 2.817586 3.293652 0.683118
C -1.676643 0.483792 0.715790
C -2.672270 -0.000913 -1.554986
C -2.806540 1.013929 1.399023
C -3.996884 0.366038 -1.410291
C -4.131525 1.229897 1.002963
C -4.779533 0.943527 -0.304173
H -0.426846 -1.086217 -1.913528
H 0.152004 -2.992184 -1.049079
H -0.086281 2.195372 -0.818176
H 4.870951 -2.556639 0.644628
H 4.474831 2.017968 1.299148
H 1.583864 -5.001762 -0.849019
H 1.028097 4.291331 -0.104039
H 3.954351 -4.812065 -0.026719
H 3.289813 4.229368 1.001319
H -0.765443 0.414518 1.320150
H -2.402177 -0.380747 -2.552799
H -2.587846 1.294422 2.443114
H -4.636894 0.228327 -2.293051
H -4.612062 1.968886 2.779576


