%chk=000197508.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000197508

0 1
O 0.140520 0.531531 -0.680648
O 0.382352 -2.633852 1.061153
O 2.977488 -2.462185 -0.368883
O -1.884973 -1.238770 -1.415981
O 1.606695 1.876860 -1.681357
O -2.348570 0.927059 1.509500
O 2.895472 2.010671 1.086222
O -4.387649 -0.062757 -1.316163
O 0.688138 2.250478 1.406127
C -0.221725 -0.533910 0.242064
C 0.689622 -1.745983 -0.020964
C 2.189881 -1.357850 0.067080
C 2.528370 -0.103079 -0.744766
C -1.706908 -0.792262 -0.069581
C 1.490782 0.997757 -0.592212
C -2.547279 0.494262 0.160589
C 1.594680 1.822249 0.734512
C -4.057500 0.211193 0.044963
H -0.108055 -0.165469 1.291473
H 0.441843 -2.243068 -0.985691
H 2.501617 -1.258322 1.137569
H 3.536643 0.278795 -0.456903
H 2.626387 -0.345978 -1.827084
H -2.071442 -1.656226 0.541078
H -2.238815 1.289494 -0.553645
H 0.961720 -3.432132 1.011168
H 2.888917 -2.617342 -1.333530
H -4.652061 1.112076 0.290907
H -4.375439 -0.623446 0.693373
H -1.507203 -0.577893 -2.046561
H 0.732055 2.309729 -1.881325
H -1.590240 1.562952 1.557520
H 3.000302 2.565991 1.912855
H -3.898124 -0.870473 -1.626658


%chk=000197508-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000197508

0 1
O 0.151055 0.533740 -0.830164
O 0.307993 -2.755867 0.897371
O 3.041220 -2.484821 -0.109103
O -1.954107 -1.265919 -1.516911
O 1.772832 1.972939 -1.684931
O -2.200109 1.118436 1.407058
O 2.832764 1.842369 1.253728
O -4.591629 -0.270991 -1.102871
O 0.565627 2.324919 1.266594
C -0.240745 -0.544713 0.127832
C 0.682045 -1.752398 -0.094967
C 2.153772 -1.326333 0.104243
C 2.535863 -0.124770 -0.782468
C -1.727331 -0.782605 -0.133859
C 1.516825 1.015341 -0.638268
C -2.569746 0.506970 0.127256
C 1.556022 1.779859 0.726435
C -4.075844 0.182778 0.192026
H -0.129587 -0.198207 1.174379
H 0.542309 -2.142369 -1.128228
H 2.307154 -1.091513 1.173476
H 3.547708 0.230215 -0.531242
H 2.514805 -0.411789 -1.851690
H -2.062312 -1.610769 0.513388
H -2.391949 1.207380 -0.717201
H 1.030199 -3.437292 0.916689
H 3.088839 -2.682357 -1.080616
H -4.633926 1.099376 0.440405
H -4.255867 -0.567840 0.991524
H -1.550935 -0.598428 -2.132597
H 1.010409 2.609814 -1.730225
H -1.391894 1.688401 1.286784
H 2.841909 2.392065 2.085144
H -3.945869 -0.935520 -1.472790


