%chk=000081720.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000081720

0 1
 O    2.715100      -1.892900      0.1064000    
 O    3.794300      0.5508000     -0.5488000    
 O   -3.730400     -0.9495000      4.3099999E-02
 N   -2.139500      0.7872000     -6.1999999E-02
 C    1.499600      0.1716000     -1.9500000E-02
 C  -0.9159000      0.1182000     -1.9900000E-02
 C   0.2765000      0.8409000     -6.1500002E-02
 C    1.530400      -1.220400      6.4400002E-02
 C  -0.8850000      -1.273800      6.3699998E-02
 C   0.3381000      -1.943100      0.1057000    
 C    2.733000      0.9448000     -6.4000003E-02
 C    2.704200       2.326500      0.5199000    
 C   -3.427800      0.2371000     -3.0999999E-02
 C   -4.492700       1.302900     -9.6600004E-02
 H   0.2290000       1.923700     -0.1454000    
 H   -1.764700      -1.901100      9.9699996E-02
 H   0.3483000      -3.028000      0.1708000    
 H   -2.078400       1.801400     -0.1230000    
 H    2.060400       2.374900       1.402800    
 H    2.374700       3.045600     -0.2345000    
 H    3.712700       2.597800      0.8495000    
 H   -4.410200       1.961300      0.7727000    
 H   -5.482700      0.8384000     -9.8399997E-02
 H   -4.375100       1.889400      -1.012200    
 H    2.537000      -2.847400      0.1635000    


%chk=000081720-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000081720

0 1
O 2.792402 -2.000290 0.130988
O 3.968260 0.436577 0.173214
O -3.753180 -0.923835 -0.040792
N -2.142532 0.783210 0.021052
C 1.559226 0.111512 0.120962
C -0.928585 0.033955 0.048018
C 0.289003 0.748989 0.092910
C 1.573782 -1.321770 0.103139
C -0.892898 -1.386777 0.031366
C 0.350544 -2.037989 0.059318
C 2.810594 0.942842 0.166562
C 2.660700 2.470455 0.205424
C -3.454886 0.307675 -0.020795
C -4.526789 1.395269 -0.042528
H 0.256030 1.844113 0.105622
H -1.828321 -1.947606 -0.002363
H 0.373590 -3.136031 0.046736
H -2.031245 1.799122 0.033598
H 2.087574 2.803383 1.090843
H 2.147691 2.852508 -0.697033
H 3.669431 2.907972 0.250383
H -5.201015 1.249899 0.818909
H -5.135889 1.279051 -0.955552
H -4.127178 2.424023 -0.011143
H 2.634589 -2.979957 0.116562


