%chk=000245376.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000245376

0 1
O -1.695905 -1.107382 -0.767426
O 1.274446 0.509933 0.103459
O 1.309843 -1.753169 0.193886
C -1.733688 -0.220749 0.362142
C -1.660092 1.185839 -0.255374
C -3.023854 -0.448912 1.176906
C -2.925809 1.510704 -1.056082
C -4.265744 -0.102673 0.344787
C -4.189155 1.328421 -0.204402
C -0.497705 -0.512206 1.263654
C 0.760072 -0.713313 0.468988
C 2.499631 0.527799 -0.694523
C 3.700481 0.327807 0.224091
C 5.015301 0.580087 -0.523281
C 6.223929 0.372543 0.385876
H -0.766903 1.244756 -0.913371
H -1.504092 1.935448 0.541812
H -3.000678 0.174269 2.090864
H -3.086126 -1.497247 1.520026
H -2.972855 0.841380 -1.940811
H -2.870042 2.542935 -1.446085
H -5.176628 -0.230414 0.957238
H -4.349337 -0.817454 -0.499718
H -4.195508 2.056860 0.627837
H -5.087559 1.547453 -0.810942
H -0.669305 -1.421317 1.876683
H -0.361970 0.320784 1.984794
H -1.715675 -2.044102 -0.496415
H 2.449341 1.538060 -1.137794
H 2.426553 -0.247709 -1.477103
H 3.684219 -0.703840 0.634908
H 3.618567 0.999267 1.101104
H 5.028325 1.609849 -0.931846
H 5.086982 -0.097612 -1.397728
H 6.206018 1.051967 1.245684
H 6.262322 -0.650693 0.778481
H 7.160803 0.550730 -0.154220


%chk=000245376-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000245376

0 1
O -1.671313 -1.288293 -0.419033
O 1.684107 1.199336 0.806419
O 0.894533 -0.218932 -0.860136
C -1.808097 -0.031138 0.347167
C -2.145147 1.149941 -0.606539
C -2.968033 -0.275414 1.340009
C -3.492692 0.930152 -1.331495
C -4.317362 -0.483584 0.615728
C -4.641585 0.703890 -0.321500
C -0.492202 0.233108 1.139047
C 0.732112 0.358714 0.250419
C 2.970079 1.364726 0.051411
C 3.963216 0.248459 0.397474
C 5.330498 0.475187 -0.291917
C 6.346419 -0.638340 0.041889
H -1.331645 1.275189 -1.347675
H -2.195192 2.086146 -0.011890
H -3.039687 0.596295 2.022673
H -2.723315 -1.163531 1.953393
H -3.404353 0.040559 -1.984419
H -3.712867 1.798754 -1.982062
H -5.123382 -0.620112 1.362686
H -4.255236 -1.413261 0.019689
H -4.788366 1.624272 0.283128
H -5.591518 0.517362 -0.858794
H -0.322478 -0.628762 1.815960
H -0.571928 1.135156 1.769949
H -0.837305 -1.204655 -0.962581
H 3.333500 2.352954 0.377870
H 2.742290 1.376399 -1.029665
H 3.544611 -0.724970 0.079871
H 4.101708 0.209257 1.495368
H 5.742537 1.457395 0.017283
H 5.185792 0.525394 -1.390041
H 6.535510 -0.690844 1.130425
H 5.970699 -1.626491 -0.282449
H 7.314292 -0.462219 -0.461563


