%chk=000037610.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000037610

0 1
 O   -3.440900      0.3284000      8.1400000E-02
 O   -3.157900      -1.954200     -1.0500000E-02
 N  -0.7583000      0.7661000     -2.8700000E-02
 C   0.9911000     -0.6126000     -0.1545000    
 C   0.6164000      0.7312000     -9.3000002E-02
 C    3.304100      0.1026000     -0.2369000    
 C    2.361500     -0.9319000     -0.2277000    
 C  -0.2058000      -1.381600     -0.1251000    
 C   -1.264200     -0.5060000     -4.7200002E-02
 C    1.547400       1.776000     -0.1013000    
 C    4.757800     -0.2277000     -0.3140000    
 C    2.901200       1.435100     -0.1746000    
 C    5.386300     -0.4020000       1.065600    
 C   -2.660500     -0.8046000      6.0999999E-03
 C   -4.861300      0.1595000      0.1415000    
 C   -5.516900       1.521700      0.2189000    
 H    2.676300      -1.971000     -0.2745000    
 H  -0.2780000      -2.460700     -0.1576000    
 H   -1.311300       1.610700      2.4400000E-02
 H    1.234500       2.813600     -5.2200001E-02
 H    4.903100      -1.144700     -0.8988000    
 H    5.292500      0.5589000     -0.8611000    
 H    3.640400       2.233100     -0.1801000    
 H    5.297700      0.5138000       1.659800    
 H    6.449600     -0.6429000      0.9686000    
 H    4.903100      -1.212400       1.621600    
 H   -5.201800     -0.3677000     -0.7564000    
 H   -5.119000     -0.4293000       1.028500    
 H   -6.605600       1.429700      0.2663000    
 H   -5.169100       2.067000       1.102500    
 H   -5.250600       2.127600     -0.6535000    


%chk=000037610-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000037610

0 1
O -3.465600 0.347876 0.059036
O -3.273230 -1.985454 -0.132842
N -0.795081 0.741552 -0.030829
C 0.983913 -0.687335 -0.205830
C 0.595223 0.700151 -0.089154
C 3.332420 0.006749 -0.249680
C 2.366469 -1.015799 -0.287534
C -0.226005 -1.467043 -0.215976
C -1.298272 -0.569268 -0.106761
C 1.553415 1.739953 -0.055203
C 4.821595 -0.311684 -0.295056
C 2.908020 1.374363 -0.134662
C 5.500127 -0.202186 1.096606
C -2.732747 -0.853987 -0.067725
C -4.948953 0.198210 0.114068
C -5.529889 1.596123 0.302287
H 2.678863 -2.062704 -0.380264
H -0.326933 -2.547885 -0.290933
H -1.392551 1.561841 0.054659
H 1.257596 2.791495 0.025323
H 4.973189 -1.334275 -0.689589
H 5.332203 0.377093 -0.996851
H 3.673531 2.160268 -0.115143
H 5.390412 0.815654 1.513687
H 6.580193 -0.429049 1.028589
H 5.042252 -0.908057 1.812820
H -5.285113 -0.276356 -0.825715
H -5.199358 -0.480634 0.949281
H -6.632708 1.538979 0.347618
H -5.168599 2.050731 1.240787
H -5.252582 2.256377 -0.537515


