%chk=000042025.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000042025

0 1
 O   -2.042700       1.648600      1.1000000E-02
 O  -0.6608000       3.463600      1.1200000E-02
 O    2.613600       1.147300      1.2600000E-02
 O    1.692600       3.148000      2.0700000E-02
 N    1.342300     -0.8789000      3.0000001E-04
 N    1.643400       1.913000      1.3800000E-02
 C    1.987000      -1.389400      -1.204500    
 C    1.978400      -1.399800       1.205400    
 C    3.272100      -2.032500     -0.6919000    
 C    2.879700      -2.519100      0.6933000    
 C   0.2845000     -2.6699999E-02  1.9999999E-04
 C   -1.082700     -0.6086000     -7.4999998E-03
 C   0.3459000       1.315600      7.1000000E-03
 C   -2.190400      0.2470000     -9.9999997E-05
 C   -1.351900      -1.987700     -2.3700001E-02
 C  -0.7933000       2.245400      9.3000000E-03
 C   -3.507700     -0.2222000     -5.7999999E-03
 C   -2.666700      -2.472700     -3.0300001E-02
 C   -3.743300      -1.591000     -2.0900000E-02
 H    2.199000     -0.6071000      -1.940800    
 H    1.347900      -2.143500      -1.677900    
 H    1.245100      -1.791300       1.919000    
 H    2.570600     -0.6318000       1.713600    
 H    4.067600      -1.281800     -0.6141000    
 H    3.624700      -2.838200      -1.341700    
 H    2.311500      -3.453800      0.6140000    
 H    3.741000      -2.695000       1.343500    
 H  -0.5450000      -2.716600     -2.8899999E-02
 H   -4.343200      0.4717000      3.9999999E-04
 H   -2.844900      -3.544400     -4.1999999E-02
 H   -4.760300      -1.971000     -2.5800001E-02


%chk=000042025-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000042025

0 1
O -2.122184 1.587357 -0.199991
O -0.877107 3.418896 -0.809199
O 2.393027 1.866111 0.614216
O 1.871775 2.800920 -1.403926
N 1.370109 -0.851560 0.018089
N 1.601761 2.035177 -0.405583
C 2.645014 -0.668574 -0.719197
C 1.670426 -1.790060 1.138333
C 3.255041 -2.099598 -0.729960
C 2.604982 -2.840023 0.489731
C 0.249973 -0.040959 -0.062462
C -1.090711 -0.638310 0.086098
C 0.311853 1.329092 -0.385142
C -2.228104 0.218535 0.052943
C -1.334224 -2.041759 0.156903
C -0.849890 2.210083 -0.534167
C -3.541460 -0.275863 0.216147
C -2.635128 -2.547284 0.304491
C -3.742338 -1.658757 0.362291
H 3.314815 0.035733 -0.185608
H 2.447443 -0.265133 -1.726277
H 0.764015 -2.207227 1.597382
H 2.208342 -1.215035 1.921170
H 4.353611 -2.050419 -0.648110
H 3.010593 -2.619740 -1.671215
H 2.027923 -3.715725 0.145259
H 3.359709 -3.196894 1.210252
H -0.497604 -2.736722 0.048164
H -4.373052 0.433987 0.197886
H -2.797479 -3.628387 0.355744
H -4.757134 -2.050759 0.485238