%chk=000222855.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000222855

0 1
O 0.682972 -2.832197 -0.688883
O -1.306137 -2.546517 0.055829
O -3.511386 1.802603 -0.138317
N -2.354788 -0.201432 0.047704
N -0.188497 -2.104479 -0.248281
C 1.419968 -0.197104 -0.026693
C 1.651444 1.203536 0.001638
C 0.052157 -0.680524 -0.087077
C -1.021694 0.239808 -0.013268
C 0.539906 2.108036 -0.011448
C -0.742835 1.647832 -0.007539
C 2.559072 -1.055180 0.034444
C 2.982551 1.713647 0.053254
C 3.835458 -0.542462 0.092550
C 4.058222 0.858991 0.095510
C -3.541946 0.599188 -0.018896
C -4.794423 -0.216698 0.075335
H 0.740905 3.183576 -0.014300
H -1.584318 2.357069 -0.002412
H 2.426875 -2.142834 0.029150
H 3.129651 2.793861 0.061679
H -2.494866 -1.240659 0.145162
H 4.694694 -1.213703 0.137284
H 5.077871 1.237733 0.133833
H -4.889890 -0.945097 -0.744661
H -5.680047 0.440667 0.023234
H -4.867518 -0.776061 1.020571


%chk=000222855-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000222855

0 1
O 0.640618 -2.912183 -0.631672
O -1.460914 -2.536569 0.111788
O -3.615014 1.859875 -0.113872
N -2.376976 -0.153435 0.032130
N -0.255461 -2.089553 -0.200160
C 1.431888 -0.217237 -0.037976
C 1.675193 1.212199 -0.000432
C 0.042331 -0.666777 -0.069378
C -1.045366 0.277689 -0.008623
C 0.568817 2.121581 -0.009798
C -0.744527 1.682792 -0.008615
C 2.583759 -1.073723 0.006691
C 3.010047 1.723218 0.056397
C 3.878929 -0.543433 0.081675
C 4.107439 0.861912 0.096491
C -3.566487 0.600963 -0.019967
C -4.816166 -0.268327 0.059175
H 0.775596 3.198077 -0.003114
H -1.583613 2.379504 -0.006799
H 2.456279 -2.153716 -0.032142
H 3.151465 2.809900 0.076145
H -2.449921 -1.189149 0.125909
H 4.730534 -1.231214 0.122217
H 5.127587 1.256033 0.142828
H -4.856896 -0.981738 -0.784100
H -5.702132 0.380952 0.025223
H -4.833611 -0.856042 0.995381


