%chk=000085076.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000085076

0 1
 O    1.363300       3.260300     -7.1999999E-03
 O    2.292300      -1.775100       1.213600    
 O    2.422000      -1.935700      -1.064000    
 N  -0.5600000       2.000200      4.9999999E-03
 C  -0.4168000     -0.4273000     -1.7700000E-02
 C   -1.191100      0.7438000      7.9999998E-04
 C    1.048100     -0.2936000     -3.1399999E-02
 C   -1.081400      -1.660600     -2.3399999E-02
 C   -2.588500      0.6888000      1.4000000E-02
 C    1.621800      0.9190000     -2.7400000E-02
 C   0.8078000       2.163900     -8.7000001E-03
 C   -2.478600      -1.718200     -1.0400000E-02
 C   -3.230600     -0.5462000      8.2999999E-03
 C    1.991600      -1.419400     -5.1399998E-02
 H   -1.147700       2.829000      1.7899999E-02
 H  -0.5237000      -2.593900     -3.7999999E-02
 H   -3.182100       1.599000      2.8100001E-02
 H    2.700000       1.048400     -3.8199998E-02
 H   -2.979000      -2.682500     -1.4900000E-02
 H   -4.315400     -0.5960000      1.8200001E-02
 H    2.921700      -2.526900       1.245800    


%chk=000085076-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000085076

0 1
O 1.359206 3.309344 0.226645
O 3.229337 -1.232735 0.326683
O 1.512277 -2.769119 0.194317
N -0.551842 1.975928 0.056503
C -0.464424 -0.473146 0.044346
C -1.220446 0.749753 -0.008457
C 0.992388 -0.352538 0.164100
C -1.183246 -1.704652 -0.023993
C -2.635950 0.726330 -0.125932
C 1.597501 0.892684 0.223642
C 0.844365 2.149232 0.173578
C -2.582318 -1.719663 -0.139769
C -3.311435 -0.501710 -0.191052
C 1.871909 -1.567219 0.225108
H -1.096850 2.843666 0.018485
H -0.622235 -2.640102 0.016008
H -3.191800 1.670672 -0.164886
H 2.681156 0.985745 0.311518
H -3.112277 -2.675955 -0.190619
H -4.402816 -0.517019 -0.281399
H 3.761204 -2.072496 0.364175


