%chk=000210178.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000210178

1 1
O -0.279444 0.990618 0.606160
O -0.408090 -1.232003 0.923945
N -3.594481 0.150037 -0.307197
N 4.439441 -0.219629 -0.390276
C -2.555825 1.262444 -0.148600
C -4.428363 0.024539 0.948382
C -4.503983 0.513332 -1.464793
C -2.930359 -1.171239 -0.605369
C -1.637929 1.138707 1.073812
C 0.289307 -0.283373 0.638742
C 1.720583 -0.230130 0.277332
C 2.430312 -1.438042 0.205567
C 2.374308 0.982463 0.020930
C 3.794457 -1.384744 -0.133740
C 3.740466 0.940226 -0.311403
H -1.911708 1.301941 -1.066931
H -3.085641 2.245876 -0.116399
H -4.897145 0.985341 1.231125
H -5.245021 -0.714020 0.825522
H -3.823237 -0.319393 1.811182
H -3.939098 0.632650 -2.409363
H -5.266135 -0.269896 -1.646784
H -5.050927 1.457668 -1.283501
H -2.315871 -1.130207 -1.523005
H -2.240764 -1.489702 0.216682
H -3.665300 -1.986471 -0.734452
H -1.584797 2.096783 1.637499
H -1.900833 0.315308 1.767002
H 1.941599 -2.392382 0.413494
H 1.842583 1.933096 0.082598
H 4.401060 -2.300275 -0.203396
H 4.305436 1.860478 -0.521665


%chk=000210178-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000210178

1 1
O -0.364049 1.188633 0.358240
O -0.558387 -0.875983 1.420500
N -3.480904 0.165416 -0.369502
N 4.288784 -0.700051 -0.297659
C -2.825306 1.541460 -0.069486
C -3.817714 -0.583005 0.923343
C -4.773558 0.445502 -1.142165
C -2.575483 -0.711516 -1.238808
C -1.665895 1.595208 0.931179
C 0.158886 -0.053304 0.793873
C 1.574593 -0.243904 0.402404
C 2.204389 -1.475853 0.721556
C 2.322414 0.759077 -0.267870
C 3.555324 -1.653967 0.352461
C 3.668598 0.481785 -0.594324
H -2.508353 1.954063 -1.042790
H -3.638533 2.174848 0.328924
H -4.412592 0.075152 1.575781
H -4.406520 -1.476076 0.662849
H -2.881244 -0.884222 1.416848
H -4.535615 1.024754 -2.047760
H -5.236043 -0.512145 -1.424568
H -5.463645 1.015753 -0.501816
H -2.270045 -0.143477 -2.130291
H -1.700068 -1.018122 -0.653648
H -3.143789 -1.605137 -1.539638
H -1.529774 2.658740 1.192018
H -1.864826 1.024811 1.853703
H 1.653138 -2.260697 1.247708
H 1.873543 1.723025 -0.518651
H 4.082029 -2.586146 0.580239
H 4.285243 1.225378 -1.109549


