%chk=000212996.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000212996

0 1
O -2.601801 1.106559 1.401609
O -3.038281 0.655908 -1.094890
C 0.602481 -0.153046 -0.286091
C -0.929077 -0.051430 -0.017998
C 1.240573 1.213852 -0.616170
C 1.365273 -0.800064 0.889156
C 2.726731 1.053324 -0.966075
C 2.853488 -0.968617 0.550853
C -1.546956 -1.438274 0.296422
C 3.497111 0.372474 0.173364
C -1.194776 0.881299 1.189826
C -1.625459 0.537670 -1.275698
C -1.331599 -2.492384 -0.784627
H 0.732693 -0.814274 -1.181003
H 1.136911 1.902985 0.243305
H 0.710779 1.694696 -1.460452
H 0.927501 -1.786418 1.133139
H 1.260795 -0.181848 1.800230
H 3.169515 2.043737 -1.181699
H 2.832951 0.462453 -1.896080
H 2.970326 -1.687776 -0.282477
H 3.385117 -1.412299 1.413310
H -2.642177 -1.295013 0.441133
H -1.149228 -1.813547 1.259407
H 4.550933 0.216402 -0.122846
H 3.522696 1.037587 1.057727
H -0.811485 1.905280 1.023957
H -0.767143 0.479612 2.124942
H -1.214193 1.528020 -1.542511
H -1.540014 -0.142677 -2.143527
H -1.788769 -2.190790 -1.736358
H -1.790850 -3.445547 -0.496844
H -0.268546 -2.682558 -0.970449
H -3.079629 0.242929 1.437786
H -3.232492 1.314175 -0.369368


%chk=000212996-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000212996

0 1
O -2.716631 1.113534 1.423456
O -3.115972 0.540758 -1.273894
C 0.590013 -0.099041 -0.278924
C -0.968398 -0.007346 -0.041858
C 1.285854 1.263759 -0.575546
C 1.364503 -0.820305 0.862304
C 2.775346 1.067453 -0.949859
C 2.856977 -1.020832 0.501694
C -1.587030 -1.408159 0.279149
C 3.546062 0.320341 0.161891
C -1.261683 0.952428 1.148985
C -1.651172 0.575321 -1.323991
C -1.291754 -2.527543 -0.743647
H 0.721131 -0.719518 -1.193527
H 1.231331 1.918138 0.319164
H 0.773288 1.798865 -1.396354
H 0.908148 -1.803491 1.081107
H 1.302279 -0.222291 1.795638
H 3.245078 2.050631 -1.147902
H 2.839474 0.486352 -1.893389
H 2.930074 -1.699481 -0.373786
H 3.382213 -1.521935 1.338275
H -2.687708 -1.289334 0.321489
H -1.255492 -1.734160 1.286847
H 4.595107 0.145987 -0.146845
H 3.580729 0.955126 1.071904
H -0.929368 1.977589 0.917538
H -0.750767 0.612032 2.071664
H -1.306883 1.618423 -1.487406
H -1.372030 -0.020355 -2.211215
H -1.668255 -2.259707 -1.746570
H -1.798448 -3.462590 -0.442119
H -0.212269 -2.748099 -0.827450
H -3.047840 0.303391 1.885504
H -3.372510 0.956460 -0.401326


