%chk=000231561.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000231561

0 1
O 1.272541 -1.681497 0.518566
O 3.203390 1.123642 -0.415905
O -3.556577 0.690657 0.526181
O 0.117710 -2.188602 -1.358685
O 2.251440 2.833852 0.722616
O -3.689522 -1.501420 1.079555
C 0.199411 0.432098 0.977652
C 1.293925 -0.255905 0.163541
C -1.167417 0.315629 0.301104
C 2.716879 0.164013 0.561114
C -2.277381 0.818598 1.219021
C 0.612485 -2.557901 -0.320644
C 2.901613 2.459277 -0.224121
C 0.647175 -3.916618 0.281607
C -4.163235 -0.546906 0.509586
C 3.502633 3.245517 -1.333325
C -5.420966 -0.454021 -0.281776
H 0.466629 1.503805 1.126912
H 0.166296 -0.016244 1.992991
H 1.141136 -0.153901 -0.937504
H -1.371546 -0.741647 0.019556
H -1.182619 0.876803 -0.654486
H 3.435849 -0.671599 0.451440
H 2.783312 0.593178 1.575716
H -2.328852 0.262334 2.171575
H -2.235591 1.907094 1.401744
H 1.322099 -3.978681 1.149913
H -0.360104 -4.206459 0.629275
H 0.964191 -4.668246 -0.457700
H 4.204764 3.999817 -0.942701
H 2.724371 3.788246 -1.894337
H 4.052533 2.613481 -2.050436
H -6.281003 -0.808197 0.307275
H -5.359486 -1.087444 -1.181382
H -5.634784 0.574845 -0.612938


%chk=000231561-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000231561

0 1
O 0.924368 -1.745341 0.450425
O 2.962675 1.243274 -0.550318
O -3.738415 0.779074 0.046587
O 1.757249 -2.845222 -1.435986
O 2.907557 2.409035 1.479377
O -3.976717 -0.733512 1.810046
C 0.103872 0.540963 0.355756
C 1.163126 -0.415456 -0.202089
C -1.331247 0.136684 -0.049793
C 2.614562 -0.026327 0.140236
C -2.364528 1.113973 0.526277
C 1.263402 -2.892733 -0.287603
C 3.098742 2.397143 0.244357
C 0.951967 -4.137273 0.512327
C -4.438425 -0.185497 0.783419
C 3.519095 3.567081 -0.616528
C -5.785376 -0.455684 0.148685
H 0.330462 1.556950 -0.022585
H 0.198205 0.578056 1.458028
H 1.063901 -0.546969 -1.296243
H -1.545305 -0.880594 0.323005
H -1.422024 0.120718 -1.153559
H 3.314208 -0.775733 -0.262521
H 2.743257 0.095663 1.230011
H -2.356986 1.092363 1.631274
H -2.204243 2.143153 0.163714
H 1.651266 -4.219602 1.363588
H -0.066950 -4.083841 0.930355
H 1.055294 -5.024846 -0.128220
H 4.556608 3.417747 -0.964889
H 3.463722 4.497003 -0.032703
H 2.880576 3.638158 -1.512683
H -6.439187 -0.967884 0.869637
H -5.653022 -1.105213 -0.735759
H -6.250391 0.482287 -0.194628


