%chk=000269738.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000269738

0 1
O -3.475449 1.149669 1.455667
O -4.878150 -0.659088 -0.384579
N 5.812682 0.068185 0.633155
N 1.711399 0.261422 -2.956077
C -0.717607 -0.245449 -0.508699
C -1.437261 0.534874 0.408632
C -2.827625 0.404386 0.478908
C -3.499867 -0.519495 -0.354527
C -1.390103 -1.134130 -1.363741
C 0.758175 -0.123404 -0.575074
C -2.775608 -1.278643 -1.283186
C 1.536847 -0.217856 0.518787
C 3.004450 -0.111974 0.535425
C 3.760244 -1.101265 1.186105
C 3.669350 0.969101 -0.060978
C 1.294207 0.088531 -1.892004
C 5.157392 -0.975041 1.207167
C 5.071295 1.020209 0.010748
C -4.415495 2.125341 0.922211
C -5.469138 -1.076358 0.878485
H -0.937767 1.250071 1.062314
H -0.828550 -1.724181 -2.089735
H -3.309028 -1.973144 -1.933220
H 1.082882 -0.402512 1.501915
H 3.277340 -1.953784 1.657294
H 3.116199 1.755128 -0.571137
H 5.788008 -1.726470 1.697841
H 5.631831 1.846355 -0.444524
H -5.144806 1.641470 0.262837
H -3.861227 2.907543 0.396238
H -4.885681 2.513174 1.832311
H -5.152952 -0.420156 1.697309
H -5.192829 -2.116312 1.072904
H -6.540857 -0.980398 0.672630


%chk=000269738-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000269738

0 1
O -3.406309 0.574224 1.816024
O -4.994163 -0.372414 -0.472651
N 5.881940 0.085856 0.901380
N 1.665438 -0.192092 -3.271109
C -0.740064 -0.144885 -0.697822
C -1.412134 0.231640 0.497772
C -2.813051 0.179285 0.594822
C -3.589817 -0.288386 -0.509780
C -1.530746 -0.537245 -1.815076
C 0.748156 -0.118640 -0.798042
C -2.932769 -0.613244 -1.715922
C 1.578908 -0.080932 0.308416
C 3.039902 -0.024326 0.426189
C 3.588807 -0.021719 1.744959
C 3.976442 0.031603 -0.649775
C 1.276862 -0.155687 -2.139421
C 4.984024 0.032669 1.931902
C 5.355952 0.084025 -0.362552
C -4.284847 1.766273 1.717342
C -5.554176 -1.263798 0.574330
H -0.873297 0.618167 1.368322
H -1.045503 -0.808325 -2.758335
H -3.542529 -0.941869 -2.562964
H 1.068278 -0.108967 1.280148
H 2.926561 -0.062512 2.617723
H 3.654990 0.034536 -1.692607
H 5.414325 0.034613 2.939553
H 6.086204 0.127203 -1.178167
H -5.103323 1.598975 0.994187
H -3.691009 2.648401 1.413103
H -4.688081 1.915492 2.730093
H -5.193409 -0.976348 1.577402
H -5.273919 -2.311703 0.359609
H -6.645343 -1.144072 0.502350


