%chk=000289354.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000289354

0 1
O 5.312553 2.380642 -0.658343
O -5.316805 2.330660 0.775531
O 2.197774 -0.773076 -1.585889
O -2.196371 -0.864864 1.523695
O 3.641391 -2.268359 -0.610848
O -3.636990 -2.305069 0.464906
N 4.100610 0.042295 -0.740042
N -4.100616 -0.006356 0.725021
C 5.412908 0.086005 -0.176651
C -5.412773 0.066873 0.164370
C 6.071214 1.354420 -0.125178
C -6.073401 1.334964 0.184670
C 6.074285 -1.035564 0.329101
C -6.071898 -1.025384 -0.404535
C 7.346146 1.479767 0.418203
C -7.348370 1.488626 -0.351304
C 7.359556 -0.904267 0.874567
C -7.357215 -0.865679 -0.942262
C 7.988483 0.336824 0.919555
C -7.988418 0.374814 -0.917018
C 3.372171 -1.128073 -0.921279
C -3.369973 -1.183749 0.839662
C 5.883462 3.710858 -0.651913
C -5.890265 3.657999 0.844572
C 1.194944 -1.828536 -1.719711
C -1.191605 -1.924361 1.597728
C 0.351546 -1.856852 -0.552236
C -0.348236 -1.885229 0.430543
H 5.590287 -2.019712 0.300045
H -5.586099 -2.008713 -0.431158
H 7.849167 2.440959 0.459681
H -7.853150 2.449703 -0.338390
H 7.861912 -1.788574 1.264432
H -7.857796 -1.727346 -1.381926
H 8.986598 0.430604 1.345104
H -8.986553 0.490778 -1.337016
H 3.701869 0.931495 -1.069293
H -3.703616 0.863462 1.104335
H 6.064222 4.041011 0.375244
H 6.794175 3.735468 -1.257516
H 5.082363 4.298171 -1.120032
H -6.071380 4.045706 -0.162209
H -6.801187 3.646390 1.450248
H -5.090420 4.219252 1.345644
H 1.705163 -2.803346 -1.894309
H 0.652986 -1.493449 -2.632236
H -1.700054 -2.908383 1.717018
H -0.650190 -1.640306 2.527724


%chk=000289354-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000289354

0 1
O 5.440109 2.348360 -0.703913
O -5.440915 2.296304 0.815394
O 2.387037 -0.784654 -1.501290
O -2.382683 -0.872572 1.430732
O 3.860863 -2.348310 -0.512353
O -3.857221 -2.380878 0.360275
N 4.368027 -0.041520 -0.715272
N -4.367114 -0.089859 0.693461
C 5.667908 0.041858 -0.158401
C -5.669246 0.022332 0.146983
C 6.258599 1.343294 -0.147448
C -6.260936 1.321851 0.208818
C 6.390281 -1.050944 0.372104
C -6.392781 -1.040859 -0.439150
C 7.546487 1.545344 0.384289
C -7.551126 1.551222 -0.306072
C 7.684219 -0.843891 0.904922
C -7.688861 -0.806463 -0.955049
C 8.261730 0.442866 0.913098
C -8.267474 0.478285 -0.891138
C 3.591951 -1.170602 -0.857026
C -3.588953 -1.223849 0.769426
C 5.963540 3.714229 -0.736746
C -5.964934 3.658243 0.921349
C 1.374075 -1.870679 -1.633260
C -1.367564 -1.962449 1.498790
C 0.418368 -1.878951 -0.522441
C -0.413663 -1.905604 0.387856
H 5.933152 -2.042674 0.361752
H -5.934721 -2.031175 -0.484633
H 7.997296 2.542218 0.392424
H -8.002703 2.546624 -0.257804
H 8.236541 -1.696426 1.313507
H -8.242063 -1.636002 -1.407453
H 9.263640 0.598301 1.326828
H -9.271172 0.654861 -1.291855
H 3.971641 0.841821 -1.050764
H -3.970338 0.774230 1.075419
H 6.161326 4.089281 0.285703
H 6.889028 3.770903 -1.341261
H 5.173473 4.316927 -1.207997
H -6.166729 4.085550 -0.079585
H -6.888292 3.682598 1.531269
H -5.173506 4.236212 1.420456
H 1.904052 -2.839715 -1.693274
H 0.868487 -1.656533 -2.589163
H -1.895710 -2.934317 1.504224
H -0.860720 -1.802289 2.464574


