%chk=000237068.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000237068

0 1
O -4.940366 0.413954 1.376635
O -4.301715 -2.011895 -1.037272
O 3.660526 1.852465 0.275211
O -3.011652 1.490642 1.733614
O -4.359350 0.106222 -1.772437
O 4.761483 -0.666523 -0.759039
C -1.612451 -0.230689 -0.222509
C -0.651182 -0.316281 0.982167
C -3.074860 -0.491546 0.259055
C -1.492914 1.109415 -0.940869
C 0.782064 -0.386133 0.532577
C -3.592276 0.597137 1.171304
C -3.972277 -0.679700 -0.946353
C 1.581316 0.765092 0.555446
C 1.318824 -1.603771 0.081928
C 2.916553 0.690133 0.141849
C 2.653500 -1.686652 -0.318414
C 3.459327 -0.543154 -0.282549
C 4.313935 2.300577 -0.944604
C 5.771364 -0.501620 0.275494
H -1.357300 -1.053611 -0.940271
H -0.812904 0.563027 1.647992
H -0.887806 -1.199142 1.609567
H -3.085923 -1.452856 0.856722
H -1.662107 1.957040 -0.261017
H -0.489439 1.239160 -1.366830
H -2.214363 1.206397 -1.763889
H 1.184076 1.723150 0.890567
H 0.695319 -2.495125 0.051126
H 3.082836 -2.628052 -0.659877
H -5.341854 1.111274 1.964993
H -4.892870 -2.212067 -1.814588
H 4.897048 1.492152 -1.401119
H 4.957091 3.107733 -0.578425
H 3.553513 2.678185 -1.633603
H 5.651104 0.464369 0.778289
H 6.702105 -0.546026 -0.299461
H 5.702421 -1.330082 0.985289


%chk=000237068-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000237068

0 1
O -4.845143 0.180289 1.854107
O -3.960354 -1.907904 -1.444196
O 3.810235 1.819335 0.315065
O -3.160777 1.729393 1.485275
O -4.914343 0.207351 -1.322556
O 4.834090 -0.737674 -0.694669
C -1.683492 -0.254116 -0.221156
C -0.686520 -0.217892 0.980991
C -3.147250 -0.472937 0.298791
C -1.540093 0.981486 -1.137636
C 0.767206 -0.336742 0.544433
C -3.666975 0.616990 1.237607
C -4.115752 -0.637489 -0.871797
C 1.644001 0.772530 0.616186
C 1.271297 -1.561588 0.031951
C 2.988644 0.671777 0.199225
C 2.619280 -1.679393 -0.365957
C 3.492939 -0.574439 -0.271235
C 4.344907 2.326706 -0.970269
C 5.844459 -0.540531 0.371644
H -1.452067 -1.160005 -0.816896
H -0.840798 0.720719 1.541772
H -0.933816 -1.055924 1.665310
H -3.172144 -1.423594 0.865692
H -1.782432 1.908045 -0.590765
H -0.502412 1.052810 -1.506509
H -2.206970 0.917849 -2.016571
H 1.293837 1.741751 0.988214
H 0.611260 -2.435039 -0.036519
H 3.024451 -2.625048 -0.740633
H -5.209964 0.906321 2.429525
H -4.565574 -1.989867 -2.230695
H 4.929432 1.547708 -1.492161
H 4.987195 3.179865 -0.703724
H 3.514641 2.668496 -1.617027
H 5.747002 0.459976 0.830216
H 6.820364 -0.645210 -0.126576
H 5.732433 -1.320806 1.148243


