%chk=000259046.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000259046

0 1
O 0.584453 -0.730915 0.816331
O 0.311358 -1.673396 -1.246464
N -1.267596 -0.158469 -0.415721
C -1.792634 0.473101 0.839568
C -2.850461 -0.441775 1.498263
C -3.946970 -0.875426 0.517472
C -3.348134 -1.521716 -0.738238
C -2.308084 -0.599462 -1.392183
C -2.361375 1.870958 0.522204
C -1.266824 2.848854 0.075144
C -0.111796 -0.950047 -0.364939
C -1.827543 4.246206 -0.176751
C 1.936116 -1.284050 0.885519
C 2.894151 -0.362689 0.137312
C 4.351983 -0.754164 0.399198
C 5.319992 0.161236 -0.363999
C 6.776136 -0.219172 -0.106836
H -0.927498 0.592589 1.550909
H -2.343392 -1.338120 1.908220
H -3.299824 0.072260 2.367585
H -4.633219 -1.586862 1.015150
H -4.566302 -0.002635 0.233748
H -4.145927 -1.759249 -1.466208
H -2.878072 -2.490865 -0.477675
H -2.789941 0.320348 -1.792407
H -1.811648 -1.110559 -2.249987
H -2.869622 2.262804 1.424537
H -3.145751 1.804588 -0.255817
H -0.779492 2.465441 -0.844833
H -0.466011 2.896616 0.838773
H -2.595086 4.239074 -0.958798
H -2.281399 4.670562 0.725639
H -1.038342 4.934343 -0.500905
H 2.098709 -1.294517 1.977776
H 1.925719 -2.310432 0.477752
H 2.711544 0.688265 0.436485
H 2.670838 -0.405605 -0.950097
H 4.520562 -1.807105 0.098690
H 4.570771 -0.708096 1.483481
H 5.151079 1.216149 -0.071669
H 5.106368 0.110938 -1.450229
H 7.033022 -0.143533 0.955731
H 6.986835 -1.247354 -0.422923
H 7.459211 0.438084 -0.656805


%chk=000259046-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000259046

0 1
O 0.557977 -0.659651 0.963393
O 0.328339 -1.723075 -1.122974
N -1.460605 -0.541776 -0.156668
C -2.025869 0.257170 0.969580
C -3.330880 -0.425666 1.467090
C -4.331373 -0.719379 0.323177
C -3.649141 -1.551239 -0.787759
C -2.365344 -0.851849 -1.287412
C -2.238667 1.744615 0.571851
C -0.938590 2.474611 0.168506
C -0.169264 -1.025790 -0.192726
C -1.176885 3.960182 -0.176085
C 1.975700 -1.110576 0.981915
C 2.886637 -0.131323 0.229455
C 4.375037 -0.538913 0.329585
C 5.312262 0.433473 -0.423164
C 6.799162 0.029359 -0.327228
H -1.278885 0.227151 1.779209
H -3.060073 -1.381756 1.957642
H -3.800650 0.216161 2.237316
H -5.210114 -1.259875 0.722880
H -4.711574 0.229787 -0.105088
H -4.336101 -1.701904 -1.642485
H -3.384018 -2.552269 -0.394683
H -2.633072 0.088165 -1.812851
H -1.805816 -1.487164 -1.992192
H -2.691744 2.260035 1.443720
H -2.975643 1.826783 -0.252188
H -0.483562 1.959294 -0.700167
H -0.203660 2.392170 0.993773
H -1.885137 4.065415 -1.020043
H -1.601687 4.507644 0.686886
H -0.235075 4.462731 -0.463594
H 2.222019 -1.152692 2.056940
H 2.034465 -2.120683 0.537547
H 2.747166 0.886877 0.643816
H 2.578654 -0.104038 -0.832730
H 4.507934 -1.561351 -0.081341
H 4.680758 -0.586568 1.396135
H 5.177739 1.456636 -0.016578
H 5.006584 0.478847 -1.487944
H 7.137545 0.007532 0.726091
H 6.964119 -0.978478 -0.753005
H 7.447238 0.737580 -0.875602


