%chk=000229553.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000229553

0 1
O -5.515596 -0.313643 -1.696112
O -6.126698 0.367857 0.494010
O 2.044329 0.937843 1.044577
O -0.049185 1.459592 1.716280
N 1.680997 -0.714814 -0.495599
C -2.128886 -0.470402 -0.170079
C -4.393152 -0.284582 -0.878208
C -4.764373 0.127099 0.441158
C -3.099624 -0.594258 -1.212037
C -2.501389 -0.069114 1.115706
C -3.840145 0.238416 1.453578
C -0.751523 -0.814548 -0.522139
C 0.385594 -0.291270 -0.028728
C -6.641006 0.102839 -0.854972
C 2.590359 0.000247 0.125929
C 4.045542 -0.010561 0.031988
C 0.613449 0.780867 0.994487
C 4.679874 -0.909981 -0.843308
C 4.807920 0.875666 0.813913
C 6.073510 -0.917958 -0.931425
C 6.199913 0.858426 0.717250
C 6.832259 -0.036579 -0.153699
H -2.822557 -0.906751 -2.215708
H -1.747702 0.020078 1.904252
H -4.111268 0.551891 2.458903
H -0.652537 -1.589044 -1.305575
H -7.342212 -0.739381 -0.787425
H -7.032618 1.046901 -1.256626
H 4.080715 -1.595718 -1.448053
H 4.303079 1.570659 1.490838
H 6.569255 -1.613094 -1.608246
H 6.794124 1.543426 1.321267
H 7.919953 -0.046610 -0.226096


%chk=000229553-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000229553

0 1
O -5.543461 -0.930073 -1.623382
O -6.290508 0.214552 0.352446
O 2.197760 0.787200 1.448111
O 0.047800 1.268389 2.262199
N 1.694947 -0.350744 -0.505180
C -2.134354 -0.133659 -0.183579
C -4.437795 -0.494563 -0.851604
C -4.884941 0.178186 0.310312
C -3.088956 -0.666748 -1.126109
C -2.607428 0.544841 0.988244
C -3.987630 0.706594 1.246176
C -0.734749 -0.336403 -0.513063
C 0.458945 0.012355 0.105777
C -6.751872 -0.475828 -0.888912
C 2.660766 0.102203 0.278852
C 4.102726 -0.010000 0.095140
C 0.742934 0.744827 1.371779
C 4.609298 -0.686778 -1.049819
C 5.002750 0.548538 1.044157
C 5.999489 -0.801014 -1.238734
C 6.393454 0.429175 0.845845
C 6.895929 -0.244005 -0.292884
H -2.756673 -1.189279 -2.027813
H -1.882862 0.947922 1.700471
H -4.341426 1.224183 2.140932
H -0.557625 -0.881132 -1.451724
H -7.354961 -1.353426 -0.602452
H -7.305648 0.247785 -1.510799
H 3.900259 -1.109538 -1.768759
H 4.602929 1.066767 1.921014
H 6.388193 -1.322034 -2.120299
H 7.085711 0.859807 1.577248
H 7.977399 -0.334604 -0.443488


