%chk=000196856.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000196856

0 1
O 1.171178 2.120031 -0.012427
O 4.542026 -1.259419 0.266538
O -4.406094 -0.554815 1.681851
O -0.301776 3.744866 -0.121593
O -4.154273 0.703262 -0.157110
N -3.272227 -2.564555 0.037397
C -1.841874 -0.827585 -0.990722
C -0.799045 0.205402 -0.661042
C 0.570850 -0.194581 -0.427741
C -2.642066 -1.232302 0.262874
C 1.515789 0.812495 -0.105985
C -1.144701 1.516408 -0.565445
C 1.043372 -1.531621 -0.504413
C 2.873316 0.530353 0.143136
C 3.276300 -0.797105 0.058847
C 2.361901 -1.844216 -0.266841
C -0.202840 2.558266 -0.246515
C -3.785473 -0.239264 0.493798
C 5.577750 -0.295859 0.599285
H -2.541238 -0.439147 -1.772150
H -1.390115 -1.724243 -1.466911
H -1.975999 -1.200466 1.170506
H -2.176508 1.856968 -0.732591
H 0.335370 -2.323947 -0.762219
H 3.543979 1.349447 0.385463
H 2.735987 -2.864302 -0.322915
H -3.880958 -2.810642 0.818858
H -2.563804 -3.288476 -0.041330
H -5.171703 0.046471 1.891286
H 5.340820 0.201549 1.544539
H 5.705135 0.419014 -0.219271
H 6.458718 -0.943489 0.701145


%chk=000196856-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000196856

0 1
O 1.218865 2.214443 -0.270629
O 4.453448 -1.326355 0.505290
O -4.005049 -0.938268 2.061108
O -0.266414 3.942683 -0.639728
O -3.933189 0.736132 0.454301
N -3.297236 -2.551191 -0.150124
C -1.951266 -0.688182 -1.092286
C -0.848331 0.319228 -0.813429
C 0.498300 -0.133523 -0.479516
C -2.543098 -1.327709 0.193987
C 1.499168 0.848810 -0.213887
C -1.116425 1.675545 -0.865014
C 0.899526 -1.502392 -0.399060
C 2.827719 0.509092 0.118265
C 3.179797 -0.855358 0.189458
C 2.208344 -1.866154 -0.072155
C -0.121047 2.706620 -0.608873
C -3.539905 -0.372555 0.864300
C 5.501236 -0.334228 0.780079
H -2.774846 -0.211296 -1.647684
H -1.559763 -1.506869 -1.726195
H -1.721909 -1.501621 0.930404
H -2.122555 2.036923 -1.090158
H 0.169589 -2.292072 -0.603223
H 3.535787 1.319363 0.305760
H 2.516978 -2.913222 -0.012103
H -3.776837 -2.981848 0.645880
H -2.771974 -3.221774 -0.717951
H -4.675949 -0.332505 2.478607
H 5.236431 0.292230 1.652847
H 5.680784 0.308824 -0.102263
H 6.401617 -0.924274 1.002294


