%chk=000199344.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000199344

0 1
O 2.586576 1.090302 -0.302181
O -1.618530 -1.963391 0.810119
O 1.167202 0.319104 -1.886746
O -0.474339 -0.092936 1.355280
C 2.443589 -1.251669 -0.474149
C 0.723499 -2.216945 1.003816
C 2.043040 -1.421778 1.006281
C 1.776493 -2.413754 -1.239338
C 0.729227 -3.041504 -0.302396
C 1.951770 0.088521 -0.997350
C -0.461811 -1.269015 1.072911
C 2.107928 2.461479 -0.487562
C -2.874904 -1.214382 0.769946
C 1.071267 2.733744 0.596609
C -2.999385 -0.532447 -0.587934
C 0.432748 4.115599 0.419083
C -4.385966 0.096739 -0.766252
C -0.584342 4.403994 1.520755
C -4.513885 0.786830 -2.121910
H 3.553028 -1.278812 -0.584568
H 0.660347 -2.890946 1.891454
H 2.825310 -1.978340 1.551646
H 1.942202 -0.442535 1.519833
H 1.301777 -2.052659 -2.174374
H 2.530725 -3.158322 -1.544532
H 0.977878 -4.094713 -0.084558
H -0.273398 -3.056274 -0.771417
H 1.705639 2.574476 -1.510210
H 3.036507 3.044257 -0.366416
H -3.609495 -2.024077 0.924958
H -2.892641 -0.500102 1.611227
H 0.289873 1.938729 0.579870
H 1.535175 2.643186 1.597899
H -2.797026 -1.262379 -1.396667
H -2.208670 0.241601 -0.691528
H -0.063835 4.175750 -0.570152
H 1.215201 4.899400 0.418383
H -4.573954 0.829953 0.043415
H -5.170921 -0.678651 -0.666898
H -1.376974 3.645476 1.541877
H -1.062775 5.378318 1.375284
H -0.116291 4.408807 2.511764
H -3.765561 1.579907 -2.242611
H -5.501346 1.245785 -2.242576
H -4.374152 0.082175 -2.949985


%chk=000199344-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000199344

0 1
O 2.450356 1.142629 -0.423959
O -1.579099 -2.142276 0.723966
O 0.592065 0.318214 -1.564289
O -0.460863 -0.257707 1.509245
C 2.238578 -1.245844 -0.538686
C 0.801742 -2.355859 1.126816
C 2.091292 -1.508104 1.003899
C 1.486120 -2.423087 -1.238374
C 0.889520 -3.305109 -0.100775
C 1.646889 0.115172 -0.916198
C -0.441106 -1.457096 1.139628
C 1.913475 2.533683 -0.555954
C -2.839303 -1.339804 0.613573
C 1.036753 2.883253 0.654113
C -2.940989 -0.697928 -0.776483
C 0.441033 4.305853 0.533075
C -4.231806 0.142965 -0.920356
C -0.425546 4.680930 1.754891
C -4.363174 0.771630 -2.324517
H 3.310493 -1.209605 -0.802153
H 0.780583 -2.930834 2.073609
H 2.952056 -2.106156 1.353500
H 2.054899 -0.576416 1.589578
H 0.679955 -2.007503 -1.867971
H 2.159069 -3.002661 -1.893335
H 1.577693 -4.134975 0.147903
H -0.086681 -3.739503 -0.366259
H 1.340778 2.602754 -1.498718
H 2.817219 3.163383 -0.610481
H -3.639058 -2.078339 0.790107
H -2.841088 -0.573469 1.409902
H 0.224497 2.138291 0.744668
H 1.643161 2.809617 1.577981
H -2.926544 -1.492508 -1.547873
H -2.054153 -0.060591 -0.952519
H -0.173272 4.369944 -0.388109
H 1.258776 5.046971 0.418018
H -4.235147 0.945167 -0.154701
H -5.117992 -0.492307 -0.714713
H -1.263154 3.969209 1.875775
H -0.851633 5.695797 1.651633
H 0.170636 4.655960 2.686266
H -3.501065 1.428399 -2.543401
H -5.284479 1.376274 -2.411492
H -4.394688 -0.009912 -3.106728


