%chk=000081233.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000081233

0 1
 O   -3.372000     -0.4708000      0.2624000    
 O   -2.694200       1.574700     -0.5618000    
 N    1.350100      0.3263000     -2.7000001E-02
 C    1.536600     -0.9006000     -0.8092000    
 C    2.401900       1.326400     -0.2154000    
 C    2.950200      -1.487400     -0.8691000    
 C    3.515500       1.138700      0.8189000    
 C    3.732800      -1.401500      0.4371000    
 C    4.437400     -5.6499999E-02  0.5960000    
 C   2.5000000E-02  0.8892000     -0.2939000    
 C   -1.063400     -9.4099998E-02  0.1263000    
 C   -2.448500      0.4648000     -0.1098000    
 C   -4.740500     -8.6199999E-02  9.5799997E-02
 C   -5.631000      -1.223100      0.5498000    
 H    1.193000     -0.7658000      -1.843600    
 H   0.9221000      -1.692400     -0.3655000    
 H    2.000700       2.334000     -4.2500000E-02
 H    2.793800       1.333100      -1.239900    
 H    3.516900      -1.006000      -1.676000    
 H    2.861000      -2.543700      -1.154400    
 H    3.074000       1.070300       1.822100    
 H    4.135200       2.044700      0.8266000    
 H    4.506300      -2.179700      0.4223000    
 H    3.090800      -1.613400       1.299700    
 H    5.124400     -0.1215000       1.448900    
 H    5.064100      0.1331000     -0.2845000    
 H  -8.6800002E-02   1.166300      -1.350500    
 H  -0.1128000       1.808900      0.2901000    
 H  -0.9683000     -0.3344000       1.191500    
 H   -1.022500      -1.017100     -0.4607000    
 H   -4.944600      0.8068000      0.6971000    
 H   -4.931700      0.1347000     -0.9602000    
 H   -6.687000     -0.9623000      0.4358000    
 H   -5.425700      -2.128700     -3.0400001E-02
 H   -5.438400      -1.467800       1.599600    


%chk=000081233-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000081233

0 1
O -3.444169 -0.490531 0.220608
O -2.680991 1.709288 0.145522
N 1.375392 0.258480 -0.245753
C 1.647139 -1.023016 -0.942509
C 2.429404 1.302200 -0.367280
C 3.110011 -1.518322 -0.859005
C 3.463593 1.224166 0.783145
C 3.782814 -1.356683 0.528407
C 4.444746 0.031663 0.714499
C 0.001559 0.749073 -0.495897
C -1.066476 -0.171894 0.133660
C -2.438427 0.479251 0.156995
C -4.847589 0.021474 0.312657
C -5.755541 -1.200525 0.405656
H 1.360336 -0.960715 -2.026689
H 0.993499 -1.794447 -0.489482
H 1.933203 2.289394 -0.314435
H 2.947840 1.267613 -1.354855
H 3.732615 -0.998195 -1.614102
H 3.102831 -2.585973 -1.155036
H 2.890438 1.180822 1.729437
H 4.052112 2.165616 0.798501
H 4.567401 -2.131659 0.639179
H 3.039013 -1.533360 1.329977
H 5.055841 0.025876 1.639813
H 5.154450 0.189787 -0.125373
H -0.218177 0.862504 -1.589656
H -0.108303 1.748972 -0.041643
H -0.765868 -0.383430 1.179768
H -1.148313 -1.146001 -0.377094
H -4.922179 0.675370 1.200560
H -5.051510 0.635888 -0.582943
H -6.810973 -0.879293 0.474490
H -5.645056 -1.842584 -0.484914
H -5.516263 -1.801810 1.299392


