%chk=000270322.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000270322

0 1
O -0.435850 -2.296760 0.645253
O -0.853481 0.609423 1.858305
O 2.148104 0.764280 -0.095669
O -2.643095 -1.862651 0.435399
O 3.323533 0.507416 -2.011967
C -1.013703 -0.221181 -0.401638
C -2.127686 0.225868 -1.379126
C -1.879073 1.626102 -1.947313
C 0.311920 -0.450603 -1.152573
C -1.732299 2.667313 -0.831872
C -0.837549 0.873716 0.680846
C -0.635672 2.276227 0.161159
C -1.498412 -1.516823 0.264914
C 1.539731 -0.555903 -0.253041
C -0.724096 -3.551668 1.346718
C 3.055389 1.181994 -1.046867
C -1.142809 -4.611966 0.350893
C 3.577253 2.520330 -0.657200
H -2.219666 -0.509202 -2.202207
H -3.106362 0.197122 -0.850033
H -0.971715 1.623147 -2.584274
H -2.716104 1.906789 -2.616512
H 0.468872 0.366835 -1.890370
H 0.226145 -1.376563 -1.760884
H -1.506288 3.660691 -1.265199
H -2.695906 2.784009 -0.294950
H 0.372733 2.332492 -0.306632
H -0.609694 2.987527 1.012846
H 2.294083 -1.251323 -0.662167
H 1.302115 -0.823201 0.797464
H -1.496452 -3.354175 2.112012
H 0.255300 -3.751895 1.817664
H -0.426050 -4.699856 -0.474794
H -2.123135 -4.375059 -0.090541
H -1.227809 -5.596317 0.826725
H 4.673577 2.489571 -0.543270
H 3.155518 2.877851 0.296082
H 3.356832 3.270544 -1.432079


%chk=000270322-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000270322

0 1
O -0.419160 -2.422469 0.547086
O -0.564803 0.606585 1.871844
O 2.263291 0.809345 -0.074048
O -2.598474 -1.640664 0.745544
O 3.372150 0.733787 -2.128574
C -0.929884 -0.224662 -0.409685
C -2.053486 0.178660 -1.428428
C -1.919013 1.619152 -1.965869
C 0.412186 -0.479856 -1.177983
C -1.896188 2.639757 -0.809033
C -0.733454 0.895966 0.659298
C -0.725389 2.335925 0.162032
C -1.423335 -1.479316 0.347028
C 1.700090 -0.554737 -0.337660
C -0.801357 -3.645781 1.325321
C 3.111744 1.331664 -1.058678
C -1.390385 -4.714121 0.400742
C 3.673663 2.668698 -0.625322
H -2.041933 -0.547059 -2.265655
H -3.028541 0.068021 -0.919326
H -1.000132 1.730349 -2.575782
H -2.770435 1.827652 -2.641225
H 0.546878 0.297312 -1.951667
H 0.301934 -1.439159 -1.716457
H -1.791843 3.670283 -1.196961
H -2.855493 2.596476 -0.256726
H 0.235983 2.495395 -0.367305
H -0.731838 2.998092 1.045104
H 2.465934 -1.141451 -0.873232
H 1.521748 -0.968995 0.663595
H -1.519356 -3.345474 2.107560
H 0.148824 -3.966694 1.781205
H -0.688100 -4.965316 -0.413032
H -2.342086 -4.370269 -0.037289
H -1.590766 -5.635257 0.978935
H 4.673021 2.512944 -0.179413
H 3.031721 3.145000 0.131191
H 3.794481 3.324318 -1.502032


