%chk=000232826.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000232826

0 1
O -2.949732 0.607862 0.005664
O 2.949738 -0.607871 -0.001900
O -6.662026 2.748015 -0.010486
O -4.439017 -1.351431 0.016473
O 6.662020 -2.748108 0.001221
O 4.439034 1.351440 0.001031
O -3.750381 2.747032 -0.002947
O 3.750372 -2.747062 -0.004474
N -5.198980 0.883561 0.002820
N 5.198984 -0.883599 0.000296
C -0.747521 -0.158902 -0.002196
C 0.747525 0.158901 0.003451
C -1.568398 1.125534 0.005658
C 1.568403 -1.125532 -0.004776
C -7.501939 0.447645 0.001474
C -6.830077 -0.802301 0.009547
C 7.501946 -0.447713 0.004166
C 6.830091 0.802263 0.004172
C -6.502390 1.565298 -0.003272
C -5.349845 -0.577523 0.010658
C 6.502391 -1.565368 0.001801
C 5.349857 0.577505 0.001772
C -3.937445 1.557714 0.001325
C 3.937445 -1.557740 -0.002299
C -8.880272 0.519437 -0.001093
C -7.530647 -1.991479 0.015116
C 8.880279 -0.519528 0.006152
C 7.530669 1.991448 0.006167
C -9.601523 -0.696765 0.004599
C -8.942907 -1.922156 0.012504
C 9.601537 0.696681 0.008200
C 8.942927 1.922101 0.008208
H -1.024021 -0.769925 -0.887797
H -1.027966 -0.782859 0.873209
H 1.024090 0.769624 0.889264
H 1.027904 0.783156 -0.871737
H -1.435309 1.746986 -0.895704
H -1.433142 1.737202 0.913343
H 1.434139 -1.747960 0.895733
H 1.434322 -1.736214 -0.913303
H -9.399751 1.479290 -0.007294
H -7.016896 -2.954212 0.021325
H 9.399753 -1.479404 0.006150
H 7.016923 2.954204 0.006175
H -10.692864 -0.663895 0.002702
H -9.517663 -2.850410 0.016804
H 10.692877 0.663794 0.009791
H 9.517689 2.850361 0.009807


%chk=000232826-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000232826

0 1
O -3.070275 0.400686 0.012949
O 3.070279 -0.400718 -0.002420
O -6.746912 2.682456 -0.013813
O -4.798342 -1.679829 0.028865
O 6.747007 -2.682577 0.002921
O 4.798285 1.679842 -0.006696
O -3.920506 2.574421 0.011093
O 3.920493 -2.574459 -0.007607
N -5.360737 0.690785 0.008633
N 5.360751 -0.690840 -0.002928
C -0.738059 -0.231999 0.004008
C 0.738063 0.231974 0.006166
C -1.685893 0.966768 0.013477
C 1.685894 -0.966792 -0.003635
C -7.697238 0.412977 -0.002691
C -7.116757 -0.872180 0.009511
C 7.697280 -0.413047 0.002647
C 7.116755 0.872145 -0.000037
C -6.620334 1.444195 -0.006073
C -5.629228 -0.752180 0.015491
C 6.620401 -1.444296 0.001300
C 5.629219 0.752145 -0.003802
C -4.086489 1.339574 0.014360
C 4.086485 -1.339610 -0.005875
C -9.090565 0.590848 -0.010153
C -7.905730 -2.034555 0.014781
C 9.090621 -0.590924 0.006217
C 7.905698 2.034552 0.000753
C -9.897202 -0.574221 -0.005061
C -9.313020 -1.868632 0.007223
C 9.897229 0.574176 0.007040
C 9.313003 1.868623 0.004348
H -0.948791 -0.850054 -0.889049
H -0.947456 -0.862876 0.888363
H 0.948862 0.849826 0.899344
H 0.947393 0.863052 -0.878065
H -1.567373 1.608045 -0.879188
H -1.563756 1.596234 0.914053
H 1.567165 -1.608418 0.888760
H 1.563962 -1.595907 -0.904476
H -9.525964 1.594692 -0.019663
H -7.441260 -3.025327 0.024380
H 9.526052 -1.594797 0.008328
H 7.441195 3.025353 -0.001421
H -10.988071 -0.478414 -0.010648
H -9.962952 -2.750033 0.010941
H 10.988108 0.478366 0.009809
H 9.962913 2.750048 0.005040


