%chk=000228329.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000228329

0 1
O 0.489046 -2.010096 0.476160
C 0.881577 0.242060 -0.349824
C 2.398184 0.115116 0.010027
C 0.200287 1.443592 0.333677
C -2.077520 0.332659 0.210528
C -1.257557 1.597349 -0.115216
C -1.410721 -0.904486 -0.417862
C 0.054272 -0.999442 -0.029745
C -3.530309 0.493749 -0.280405
C 3.130922 1.405061 -0.414738
C 2.592018 -0.115027 1.516557
C 2.999807 -1.067977 -0.772633
C -4.458563 -0.583913 0.272895
H 0.822662 0.391234 -1.458936
H 0.761246 2.370415 0.102788
H 0.250634 1.327367 1.434516
H -2.090028 0.194731 1.320637
H -1.707950 2.476496 0.383028
H -1.300241 1.810664 -1.199866
H -1.500251 -0.880112 -1.520317
H -1.939759 -1.825206 -0.097199
H -3.561595 0.484128 -1.386961
H -3.910089 1.491011 0.019652
H 3.011199 1.606784 -1.483039
H 4.205522 1.324756 -0.217885
H 2.768514 2.279996 0.133949
H 2.081379 -1.035709 1.837257
H 2.198575 0.710220 2.115009
H 3.650256 -0.231053 1.769588
H 2.538132 -2.018404 -0.465124
H 4.073509 -1.163256 -0.584188
H 2.863557 -0.963353 -1.851202
H -4.158087 -1.586713 -0.053016
H -4.467912 -0.587409 1.369213
H -5.490117 -0.427329 -0.062825


%chk=000228329-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000228329

0 1
O 0.431664 -2.002898 0.722908
C 0.892291 0.228366 -0.265722
C 2.431122 0.101936 0.017112
C 0.187927 1.456492 0.409395
C -2.129037 0.350958 0.238194
C -1.278043 1.610948 -0.053116
C -1.430439 -0.899406 -0.380147
C 0.026673 -0.999540 0.073228
C -3.582398 0.517923 -0.272377
C 3.152357 1.377729 -0.504635
C 2.738901 -0.068684 1.529815
C 2.996590 -1.117254 -0.766344
C -4.534043 -0.636046 0.111744
H 0.777501 0.381699 -1.364177
H 0.750975 2.375485 0.166884
H 0.217807 1.338874 1.510407
H -2.165376 0.204855 1.340002
H -1.735246 2.489054 0.444493
H -1.300493 1.816058 -1.144750
H -1.465435 -0.803764 -1.486045
H -1.945264 -1.831873 -0.093770
H -3.563362 0.634326 -1.376267
H -3.985346 1.468544 0.133576
H 2.900905 1.580008 -1.564259
H 4.247685 1.239743 -0.440145
H 2.899104 2.275174 0.088376
H 2.265192 -0.982455 1.923805
H 2.383227 0.797599 2.118399
H 3.831961 -0.146692 1.682731
H 2.554478 -2.061125 -0.408547
H 4.093277 -1.177185 -0.633421
H 2.794424 -1.021522 -1.851515
H -4.227944 -1.591592 -0.351040
H -4.553885 -0.784648 1.207982
H -5.567152 -0.423184 -0.218274


