%chk=000228898.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000228898

0 1
O 0.703813 1.928370 -1.370130
O -1.051418 2.398112 0.655492
O 2.502314 -1.708737 0.154063
O -2.065240 -1.000498 -0.478440
O 2.805523 0.534073 0.068649
O -3.598307 -0.134353 0.937650
C 0.023551 0.802846 -0.817028
C -0.317650 1.166782 0.654385
C 0.839863 -0.486477 -0.955373
C -1.209241 0.162158 1.389223
C 2.135946 -0.438578 -0.208203
C -2.439720 -0.278472 0.647230
C 3.775326 -1.857356 0.843449
C -3.140009 -1.515360 -1.308718
H -0.905703 0.742203 -1.439484
H 0.618041 1.341250 1.241632
H 1.056617 -0.669543 -2.034893
H 0.215895 -1.361280 -0.646249
H -1.551326 0.649475 2.339494
H -0.616404 -0.728738 1.687340
H 1.629533 1.999721 -1.008200
H -0.700956 3.003108 -0.049512
H 4.583430 -1.740771 0.114846
H 3.718437 -2.880015 1.231920
H 3.863729 -1.116504 1.645264
H -3.878676 -2.035958 -0.689130
H -2.620639 -2.198774 -1.987125
H -3.605930 -0.680483 -1.841654


%chk=000228898-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000228898

0 1
O 0.812448 1.849260 -1.415804
O -1.111551 2.226819 0.507530
O 2.731629 -1.650410 0.357690
O -2.417273 -0.914657 -0.617749
O 3.001034 0.601596 -0.145577
O -3.674804 -0.149176 1.184311
C 0.133238 0.649633 -0.879312
C -0.332258 0.988780 0.562673
C 1.026776 -0.608226 -0.994798
C -1.205006 -0.056224 1.289545
C 2.331004 -0.464868 -0.233823
C -2.559803 -0.339242 0.658138
C 4.029786 -1.613933 1.085680
C -3.689036 -1.230737 -1.314997
H -0.752153 0.513509 -1.517382
H 0.579335 1.145160 1.185865
H 1.279712 -0.743361 -2.064498
H 0.487379 -1.512096 -0.670621
H -1.407419 0.321977 2.304834
H -0.644055 -1.005241 1.380592
H 1.745393 1.848680 -1.052706
H -0.635815 2.815879 -0.141488
H 4.843136 -1.344613 0.392057
H 4.157217 -2.632655 1.475508
H 3.985062 -0.873824 1.901261
H -4.272785 -1.960174 -0.728940
H -3.384003 -1.652042 -2.283292
H -4.286388 -0.313614 -1.448200


