%chk=000259579.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000259579

0 1
O 2.846895 1.350445 0.721640
O 0.046910 -2.577922 0.331110
O -2.257233 1.503960 0.184426
O 1.709135 -1.423374 1.297936
N -0.266269 0.520843 -0.244569
N -3.835472 -0.739798 -0.348837
C 0.609655 -0.549477 -0.762362
C 1.903951 0.158200 -1.198102
C 1.962708 1.471879 -0.380817
C 0.516730 1.743868 0.099112
C -1.667551 0.507046 -0.193449
C 0.901625 -1.507629 0.406376
C -2.379295 -0.782430 -0.597499
H 0.131344 -1.117818 -1.599759
H 2.810856 -0.449939 -1.016128
H 1.888905 0.368951 -2.282356
H 2.396614 2.320409 -0.951440
H 0.482896 1.925899 1.196774
H 0.063189 2.634562 -0.385531
H 2.630686 0.552024 1.274549
H -1.946607 -1.661839 -0.054823
H -2.212906 -0.985784 -1.681905
H 0.170704 -3.235970 1.071226
H -4.253290 0.057375 -0.827956
H -4.021879 -0.606780 0.643684


%chk=000259579-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000259579

0 1
O 2.828689 1.231410 0.857646
O 0.257511 -2.749181 0.300641
O -2.276356 1.599212 0.158327
O 1.611427 -1.265593 1.448756
N -0.261518 0.548825 -0.257658
N -3.841998 -0.701398 -0.351622
C 0.595705 -0.572274 -0.719959
C 1.874977 0.155798 -1.214714
C 1.992553 1.428624 -0.322613
C 0.520628 1.788375 0.019651
C -1.649431 0.554304 -0.197433
C 0.896992 -1.523926 0.449649
C -2.404355 -0.735357 -0.631882
H 0.102675 -1.152416 -1.516022
H 2.788594 -0.457140 -1.152409
H 1.717371 0.446601 -2.268417
H 2.485969 2.250771 -0.863747
H 0.429009 2.095502 1.075190
H 0.122189 2.608447 -0.604861
H 2.515537 0.411003 1.335424
H -1.960360 -1.627716 -0.155700
H -2.251471 -0.863120 -1.724194
H 0.460499 -3.342484 1.075762
H -4.272900 0.170125 -0.685246
H -4.049634 -0.821692 0.646732


