%chk=000229384.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000229384

0 1
O -1.211920 -0.096014 -0.415668
O -0.236945 1.251774 1.112553
C -2.539256 0.097063 0.203016
C -3.136910 1.382509 -0.374897
C -3.296463 -1.165314 -0.217488
C -4.621171 1.488498 -0.005409
C -4.778979 -1.038077 0.153149
C -5.397018 0.236558 -0.439242
C 2.348615 0.217049 0.188351
C 1.087698 0.221645 -0.682848
C -0.130633 0.548199 0.135075
C 3.607782 -0.006152 -0.657349
C 4.867891 -0.019889 0.218257
C 6.133360 -0.241365 -0.622152
C 7.390262 -0.255216 0.244854
H -2.395748 0.163980 1.302480
H -3.010261 1.391223 -1.474824
H -2.577939 2.260089 0.004779
H -2.846757 -2.055805 0.259330
H -3.180127 -1.319967 -1.309040
H -5.059587 2.387702 -0.477808
H -4.725908 1.637020 1.087218
H -4.892423 -1.033791 1.254768
H -5.329822 -1.927512 -0.206755
H -6.454598 0.322077 -0.127540
H -5.407085 0.167880 -1.544241
H 2.265701 -0.568514 0.965637
H 2.421271 1.176326 0.743240
H 1.175943 0.972588 -1.498166
H 0.955860 -0.754941 -1.197016
H 3.526590 -0.959704 -1.214354
H 3.693664 0.786704 -1.425657
H 4.950903 0.932694 0.776835
H 4.786029 -0.811403 0.988071
H 6.218865 0.551774 -1.390634
H 6.053655 -1.195319 -1.179338
H 7.520078 0.690643 0.783268
H 8.288683 -0.412508 -0.362398
H 7.356197 -1.055100 0.993344


%chk=000229384-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000229384

0 1
O -1.244460 -0.189516 -0.568636
O -0.240167 1.141589 1.067639
C -2.595218 0.046786 0.050151
C -3.200684 1.349318 -0.503034
C -3.447731 -1.182882 -0.289794
C -4.643269 1.536001 0.032031
C -4.890653 -0.997401 0.244036
C -5.527071 0.307505 -0.293880
C 2.386642 0.151755 0.160517
C 1.128701 0.140063 -0.735009
C -0.148465 0.434694 0.035799
C 3.689237 -0.006287 -0.653621
C 4.954533 -0.023738 0.233395
C 6.264741 -0.174099 -0.573055
C 7.522927 -0.194889 0.321750
H -2.447986 0.141345 1.144035
H -3.216993 1.291065 -1.609592
H -2.565249 2.207428 -0.218195
H -2.983532 -2.090719 0.138093
H -3.467958 -1.310580 -1.390079
H -5.083378 2.455016 -0.399365
H -4.611574 1.683875 1.131209
H -4.872308 -0.964323 1.353007
H -5.506396 -1.872414 -0.038145
H -6.539717 0.441984 0.132593
H -5.647979 0.226972 -1.393925
H 2.313885 -0.664402 0.906692
H 2.409316 1.096191 0.736217
H 1.227214 0.919546 -1.519304
H 1.012905 -0.821192 -1.266122
H 3.646944 -0.943134 -1.248120
H 3.768314 0.824186 -1.386775
H 4.997353 0.911095 0.830247
H 4.878861 -0.855237 0.965069
H 6.341516 0.658575 -1.302033
H 6.219120 -1.107147 -1.171396
H 7.607657 0.739980 0.907387
H 8.445717 -0.303198 -0.277500
H 7.484703 -1.036406 1.039114


