%chk=000298736.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000298736

0 1
O 0.609191 1.567781 1.233751
O -4.607425 0.879739 -0.679210
O -4.354355 -1.961405 -0.503512
O 2.413430 1.026453 0.152159
O 1.567327 -0.470714 1.722613
C -1.551044 0.460479 1.408869
C -2.580285 1.107308 0.701021
C -0.523389 1.273392 2.133179
C -3.543783 0.352437 0.036148
C -1.483224 -0.936089 1.434510
C -3.485010 -1.070765 0.074185
C -2.446888 -1.701326 0.774307
C 3.543602 0.271480 -0.224261
C 1.530929 0.566233 1.107630
C -4.621234 2.312748 -0.888626
C -5.446717 -1.437569 -1.301272
C 4.318092 0.970051 -1.165071
C 3.874308 -0.998299 0.243947
C 5.470706 0.351500 -1.646488
C 5.038526 -1.592289 -0.258454
C 5.832327 -0.926110 -1.195671
H -2.609081 2.194041 0.673760
H -0.849062 2.306205 2.365111
H -0.139086 0.778587 3.044861
H -0.663467 -1.435135 1.960174
H -2.405499 -2.790667 0.788096
H -3.718393 2.632470 -1.417380
H -4.743408 2.833863 0.065065
H -5.510796 2.435358 -1.519600
H -5.053064 -0.868086 -2.149276
H -6.100862 -0.816630 -0.679408
H -5.947281 -2.356871 -1.625626
H 4.011957 1.960230 -1.496697
H 3.252691 -1.518884 0.977427
H 6.093406 0.866499 -2.377959
H 5.322303 -2.585807 0.089744
H 6.734556 -1.398708 -1.578544


%chk=000298736-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000298736

0 1
O 0.588255 1.531689 1.244927
O -4.682214 1.027962 -0.609315
O -4.768163 -1.806841 -0.242935
O 2.406916 0.984942 0.122638
O 1.604135 -0.518643 1.773121
C -1.644113 0.439003 1.552186
C -2.615036 1.117496 0.771423
C -0.535337 1.214900 2.216258
C -3.662415 0.413159 0.139258
C -1.735946 -0.964255 1.704632
C -3.738386 -1.011134 0.277485
C -2.774219 -1.674401 1.067417
C 3.573237 0.266558 -0.298423
C 1.540537 0.543531 1.115511
C -4.649716 2.488332 -0.726074
C -5.156082 -1.635464 -1.659291
C 4.266454 0.923061 -1.339045
C 4.024792 -0.960923 0.236726
C 5.440080 0.340849 -1.859821
C 5.205632 -1.526099 -0.300877
C 5.915469 -0.887775 -1.341956
H -2.541653 2.204935 0.666375
H -0.850845 2.223039 2.526927
H -0.100433 0.662984 3.066133
H -0.983998 -1.496539 2.295560
H -2.865001 -2.760511 1.164091
H -3.730058 2.831890 -1.238049
H -4.725536 2.970151 0.267826
H -5.530847 2.746873 -1.331444
H -4.282691 -1.801027 -2.319066
H -5.577515 -0.633965 -1.837562
H -5.910907 -2.416647 -1.836202
H 3.876203 1.871743 -1.718741
H 3.474763 -1.455920 1.037781
H 5.980603 0.846478 -2.667141
H 5.566782 -2.477554 0.104993
H 6.827251 -1.340376 -1.745825


