%chk=000251001.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000251001

0 1
O -3.738751 0.022581 -0.012044
O -2.410382 -0.989438 -1.535233
O 1.325607 1.067975 0.961484
O 2.303826 1.326787 -2.182644
O 4.217807 -2.449907 -0.087568
N -0.150912 -0.112104 -0.358962
N 3.490973 -0.315851 0.235482
C -1.394819 0.595018 0.052364
C -1.453994 2.054015 -0.472366
C -1.569105 0.686633 1.584122
C -2.155903 2.880492 0.619913
C -2.438404 1.934323 1.804102
C -2.536755 -0.226346 -0.600257
C 1.116289 0.242591 0.087029
C 2.274289 -0.542042 -0.571391
C 2.492708 -0.080169 -2.031141
C -4.914624 -0.687536 -0.532369
C -4.928907 -2.106040 -0.006366
C 4.376741 -1.380042 0.474232
C 5.508246 -1.062348 1.405851
H -0.426838 2.434765 -0.643758
H -1.968730 2.128082 -1.443346
H -2.021731 -0.221439 2.010313
H -0.580034 0.815327 2.074221
H -1.512368 3.720145 0.937050
H -3.090912 3.326887 0.242402
H -3.508607 1.652811 1.822939
H -2.214775 2.414079 2.770062
H -0.253332 -0.748313 -1.162694
H 2.048077 -1.650808 -0.582658
H 3.501812 -0.364864 -2.385898
H 1.729748 -0.506726 -2.711095
H -4.894270 -0.640229 -1.635607
H -5.725316 -0.057754 -0.122419
H 3.499155 0.538178 0.799867
H -4.113987 -2.702116 -0.445252
H -4.801935 -2.136045 1.083540
H -5.871126 -2.613469 -0.246662
H 2.967570 1.821839 -1.655931
H 6.104455 -0.203420 1.069616
H 6.193062 -1.924824 1.472238
H 5.160051 -0.850096 2.426233


%chk=000251001-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000251001

0 1
O -3.783482 0.146179 -0.444065
O -2.286372 -1.419584 -1.293717
O 1.272927 1.140177 0.970582
O 2.399233 0.845391 -2.326795
O 4.722219 -2.042994 -0.271706
N -0.183726 -0.274574 -0.182420
N 3.447105 -0.188101 0.294741
C -1.448908 0.425054 0.134277
C -1.455826 1.945504 -0.307309
C -1.763281 0.448872 1.681318
C -1.607011 2.769619 0.997893
C -2.396163 1.833824 1.947076
C -2.522219 -0.385993 -0.614356
C 1.056167 0.140215 0.206887
C 2.234365 -0.689710 -0.361244
C 2.334849 -0.555906 -1.907455
C -4.923297 -0.593502 -1.083955
C -5.428052 -1.703791 -0.160729
C 4.612869 -0.933700 0.340118
C 5.750022 -0.333216 1.160144
H -0.530476 2.178934 -0.858611
H -2.313219 2.128524 -0.977712
H -2.401227 -0.397425 1.990845
H -0.798757 0.371351 2.211066
H -0.607248 2.972622 1.419597
H -2.119624 3.732320 0.824000
H -3.467750 1.824892 1.675095
H -2.311207 2.128031 3.008498
H -0.289972 -1.090582 -0.799189
H 2.103307 -1.766400 -0.128223
H 3.219594 -1.129703 -2.244043
H 1.434149 -0.962733 -2.396749
H -4.575874 -0.994965 -2.051552
H -5.676876 0.193652 -1.242903
H 3.290250 0.635342 0.892965
H -4.660371 -2.483835 -0.024916
H -5.710140 -1.299166 0.826459
H -6.322078 -2.177121 -0.607089
H 3.179521 1.261618 -1.877767
H 5.493702 0.637345 1.617985
H 6.634760 -0.202892 0.513299
H 6.032016 -1.042970 1.957060


