%chk=000237463.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000237463

0 1
O -1.233429 -0.786016 1.119976
O -0.858439 0.007465 -1.054776
C -3.144050 0.129068 -0.139952
C -4.610657 -0.156332 -0.531565
C -2.657932 -0.892474 0.917284
C -2.256995 -0.058063 -1.400226
C -2.962854 1.553121 0.392960
C -5.596337 -0.062364 0.640888
C -0.456385 -0.964768 -0.075325
C -7.033640 -0.303423 0.184053
C 0.957373 -0.647925 0.313179
C 1.892811 -0.319280 -0.583029
C 3.290964 -0.022126 -0.229044
C 3.603112 0.769244 0.888396
C 4.328491 -0.529325 -1.031090
C 4.937070 1.044200 1.201303
C 5.659287 -0.255550 -0.709141
C 5.966478 0.531453 0.406311
H -4.689089 -1.159255 -0.994262
H -4.916964 0.559470 -1.320608
H -3.045762 -0.672650 1.928100
H -2.902727 -1.931003 0.640187
H -2.452902 -1.012686 -1.915513
H -2.355692 0.779434 -2.113558
H -3.511672 1.718004 1.324942
H -1.895589 1.735949 0.602437
H -3.292702 2.307004 -0.327422
H -5.519680 0.935135 1.118548
H -5.329422 -0.796014 1.425916
H -0.615565 -1.986943 -0.475626
H -7.351357 0.435157 -0.560892
H -7.156628 -1.295371 -0.265047
H -7.731797 -0.237319 1.026537
H 1.144231 -0.705000 1.388453
H 1.654834 -0.250839 -1.650553
H 2.802789 1.175770 1.505589
H 4.094275 -1.140618 -1.900513
H 5.173663 1.660184 2.067381
H 6.460196 -0.654562 -1.329271
H 7.004295 0.745049 0.652973


%chk=000237463-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000237463

0 1
O -1.252211 -0.262432 1.402875
O -0.811999 -0.261059 -0.979109
C -3.166100 0.111691 -0.179431
C -4.621907 -0.342152 -0.493503
C -2.696125 -0.490041 1.174883
C -2.240035 -0.488556 -1.277120
C -3.023134 1.652121 -0.164414
C -5.717602 0.140896 0.486989
C -0.469846 -0.856427 0.309284
C -7.120615 -0.349456 0.066278
C 0.984368 -0.639015 0.614977
C 1.893260 -0.222475 -0.307811
C 3.336662 0.000997 -0.091821
C 3.978345 -0.177735 1.168002
C 4.133870 0.417606 -1.195311
C 5.361130 0.049401 1.312707
C 5.519190 0.645923 -1.052256
C 6.140724 0.461947 0.203938
H -4.653603 -1.452842 -0.535423
H -4.883187 0.012139 -1.513569
H -3.193452 -0.009985 2.032280
H -2.904764 -1.585430 1.195810
H -2.425462 -1.583391 -1.372981
H -2.410859 -0.005786 -2.253921
H -3.587247 2.102383 0.671979
H -1.963414 1.934938 -0.049960
H -3.401593 2.090343 -1.107565
H -5.717317 1.246544 0.535907
H -5.499265 -0.221112 1.511162
H -0.736332 -1.945916 0.264369
H -7.382881 0.021265 -0.942641
H -7.164569 -1.454746 0.038874
H -7.898297 0.002288 0.768495
H 1.255345 -0.854888 1.655292
H 1.518823 -0.024783 -1.320892
H 3.392564 -0.491857 2.039081
H 3.655329 0.562847 -2.171841
H 5.836204 -0.092474 2.290207
H 6.111773 0.966835 -1.916374
H 7.215834 0.638197 0.320554


