%chk=000233090.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000233090

0 1
O 3.135494 -0.159155 0.867710
O -1.548024 -0.877535 -2.155443
N -0.514911 0.137462 -0.397962
C 0.844697 -0.014279 -0.993563
C 1.675595 1.181398 -0.590792
C 1.464745 -1.310133 -0.525220
C 2.744206 1.056484 0.304534
C 2.540114 -1.318201 0.371657
C 3.528008 2.160626 0.716574
C 1.384531 2.456515 -1.103121
C 0.968991 -2.546367 -0.967221
C 3.119442 -2.502686 0.853430
C 3.201955 3.413038 0.190802
C 2.140819 3.559829 -0.714550
C -1.643000 -0.364744 -1.049867
C 1.530290 -3.737724 -0.505930
C 4.649562 1.985558 1.682153
C 2.597784 -3.714241 0.404097
C -2.932687 -0.186601 -0.315210
C -4.012478 0.402645 -0.989571
C -3.088026 -0.632050 1.003384
C -5.393299 0.130690 0.988835
C -5.234370 0.566372 -0.338498
C -4.313196 -0.473194 1.653176
C -6.708468 0.302343 1.674314
H 0.729983 -0.046049 -2.118420
H -0.564792 0.531226 0.536400
H 0.557755 2.575145 -1.804543
H 0.131551 -2.562311 -1.674896
H 3.950509 -2.457076 1.552161
H 3.782556 4.287217 0.485259
H 1.910009 4.545505 -1.115210
H 1.137925 -4.691105 -0.854447
H 4.347390 2.285962 2.696184
H 4.975397 0.934250 1.743975
H 5.528696 2.582284 1.405739
H 3.026467 -4.651047 0.760339
H -3.891781 0.723610 -2.026491
H -2.259029 -1.114860 1.521974
H -6.069753 1.026628 -0.862989
H -4.430001 -0.823777 2.676767
H -6.667898 0.061388 2.744684
H -7.077703 1.334710 1.591398
H -7.473151 -0.350849 1.226697


%chk=000233090-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000233090

0 1
O 3.332608 -0.305553 0.746499
O -1.597640 -0.426883 -2.276494
N -0.509776 0.049258 -0.277754
C 0.850307 -0.021011 -0.877632
C 1.692081 1.158175 -0.402030
C 1.522250 -1.359582 -0.582896
C 2.854466 0.976043 0.383072
C 2.686523 -1.445365 0.214722
C 3.632820 2.064728 0.865206
C 1.307404 2.482601 -0.727684
C 0.976376 -2.563909 -1.093520
C 3.287070 -2.685142 0.524589
C 3.210182 3.367276 0.522579
C 2.057383 3.583154 -0.272677
C -1.656799 -0.136071 -1.035433
C 1.564331 -3.811043 -0.802415
C 4.868595 1.812347 1.703606
C 2.721324 -3.869928 0.015343
C -2.970509 0.013055 -0.316390
C -4.119502 -0.559389 -0.920471
C -3.121619 0.712451 0.908324
C -5.538412 0.229350 0.931743
C -5.379656 -0.456105 -0.303292
C -4.389832 0.817502 1.519779
C -6.899574 0.326569 1.596489
H 0.658966 0.053513 -1.965564
H -0.572946 0.150322 0.736657
H 0.408735 2.634156 -1.336882
H 0.080247 -2.502734 -1.721983
H 4.184975 -2.696924 1.149775
H 3.795903 4.222265 0.879847
H 1.753256 4.602339 -0.532427
H 1.129153 -4.730352 -1.207530
H 4.620838 1.259856 2.628453
H 5.600654 1.190766 1.156399
H 5.354011 2.762665 1.982562
H 3.183384 -4.835116 0.249199
H -3.994854 -1.072626 -1.879592
H -2.267652 1.215846 1.378252
H -6.256317 -0.908705 -0.782637
H -4.491344 1.371004 2.460812
H -6.880616 1.008476 2.463604
H -7.666855 0.693704 0.890247
H -7.238037 -0.664083 1.955844


