%chk=000229761.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000229761

0 1
O -4.597375 -0.169226 -0.131675
O -1.761120 1.895701 1.507332
O -4.257634 -1.005065 -2.175355
O 2.308297 -2.228433 0.422392
O 4.081966 -0.061535 -0.151792
C -2.377552 -0.310705 0.831271
C -2.354819 -0.815201 -0.617037
C -3.836088 0.141508 1.071640
C -1.383768 0.830184 1.068908
C -3.779792 -0.705240 -1.116658
C 0.048610 0.579182 0.745479
C 0.590365 -0.717156 0.715019
C 0.866941 1.684363 0.489509
C 1.941982 -0.902198 0.415038
C 2.221816 1.513172 0.180670
C 2.768008 0.229866 0.139757
C 3.695275 -2.557865 0.157394
C 4.972919 1.050163 -0.427300
H -2.120496 -1.136876 1.538484
H -1.999243 -1.861250 -0.696372
H -1.675899 -0.228851 -1.270697
H -4.339879 -0.405779 1.882607
H -3.938534 1.235616 1.214559
H -0.016419 -1.596895 0.930797
H 0.442722 2.692043 0.535826
H 2.833808 2.389507 -0.020349
H 4.342811 -2.100699 0.912566
H 3.972377 -2.233919 -0.851407
H 3.683544 -3.651046 0.242366
H 5.050356 1.701882 0.447845
H 4.639977 1.593041 -1.316711
H 5.921045 0.529413 -0.615906


%chk=000229761-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000229761

0 1
O -4.701242 -0.706192 0.614694
O -1.796482 2.153716 0.305388
O -4.818059 -2.123024 -1.224529
O 2.470529 -2.165436 0.628545
O 4.304746 0.000611 0.375018
C -2.330039 -0.196272 0.618564
C -2.725356 -0.833685 -0.745241
C -3.702945 0.248272 1.184209
C -1.347272 0.973976 0.449416
C -4.165774 -1.325712 -0.534864
C 0.117733 0.697445 0.411829
C 0.662187 -0.613263 0.494133
C 1.008829 1.794445 0.270196
C 2.050284 -0.839653 0.454325
C 2.397695 1.589940 0.237350
C 2.937211 0.281608 0.344642
C 3.483262 -2.717070 -0.298644
C 5.243936 1.130554 0.332998
H -1.899605 -0.977036 1.269174
H -2.079796 -1.664694 -1.067700
H -2.737393 -0.078267 -1.554117
H -3.777332 0.167625 2.278671
H -3.957443 1.268874 0.853614
H 0.029719 -1.500584 0.591484
H 0.584872 2.800309 0.193158
H 3.064343 2.452035 0.143383
H 4.451279 -2.206046 -0.178067
H 3.134699 -2.629503 -1.345588
H 3.564848 -3.778241 -0.019777
H 5.081157 1.812047 1.188631
H 5.155143 1.688856 -0.617862
H 6.240468 0.672068 0.405167


