%chk=000291663.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000291663

0 1
O -2.473043 1.957134 -0.459688
O -5.033119 -1.613877 -0.398307
O 3.824062 -0.873522 -0.220892
O 2.171488 4.276413 -0.004663
O 2.615352 -2.782891 -0.066756
N -3.180147 -0.293147 -0.228871
N 0.440331 2.789105 -0.051571
C -1.809438 -0.193836 0.026882
C -1.385032 1.140441 -0.111195
C -0.042181 1.483522 0.084619
C -0.964316 -1.262172 0.366050
C 0.848703 0.397788 0.441053
C 0.377889 -0.918404 0.580791
C -3.672380 1.081168 -0.549475
C -1.607951 -2.572531 0.426360
C 2.255300 0.727602 0.633523
C -3.844404 -1.570605 -0.168738
C -2.943309 -2.675152 0.174097
C 1.824085 3.119010 0.134427
C 2.697807 1.996780 0.485539
C 3.244651 -0.352201 1.009320
C -0.773659 -3.755935 0.765807
C -0.512297 3.869884 -0.411732
C 3.414254 -2.109018 -0.678387
C 4.118551 -2.400721 -1.952621
H 1.081577 -1.717824 0.857597
H -4.035898 1.168661 -1.589726
H -4.383809 1.461635 0.206348
H -3.452832 -3.641658 0.211467
H 3.748362 2.275074 0.606221
H 4.131162 0.047092 1.541987
H 2.797213 -1.173585 1.603693
H 0.199920 -3.744013 0.241942
H -1.257768 -4.710516 0.515571
H -0.547800 -3.784188 1.843984
H -1.308658 3.956760 0.348774
H 0.021245 4.838443 -0.478483
H -0.989026 3.661456 -1.386162
H 3.399273 -2.497384 -2.783602
H 4.838201 -1.611320 -2.230381
H 4.670239 -3.353067 -1.889901


%chk=000291663-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000291663

0 1
O -2.562574 1.972621 -0.436172
O -5.078821 -1.613290 -0.456178
O 3.776572 -0.878539 -0.387005
O 2.130281 4.447405 0.167004
O 2.901593 -2.955368 0.237852
N -3.159008 -0.292713 -0.255982
N 0.384579 2.876796 0.010193
C -1.800976 -0.164656 -0.014735
C -1.416797 1.176309 -0.117051
C -0.071087 1.551418 0.087476
C -0.945100 -1.241504 0.291117
C 0.854682 0.457904 0.394569
C 0.410874 -0.888565 0.495164
C -3.736445 1.042207 -0.537864
C -1.571154 -2.562995 0.347088
C 2.257557 0.810932 0.599500
C -3.831184 -1.538320 -0.225490
C -2.933922 -2.666084 0.094372
C 1.750986 3.235358 0.233455
C 2.657143 2.127327 0.528308
C 3.305489 -0.243798 0.894275
C -0.730515 -3.773643 0.685555
C -0.550352 3.985263 -0.305753
C 3.529117 -2.241105 -0.581684
C 4.107250 -2.708579 -1.897692
H 1.134157 -1.675354 0.724195
H -4.155409 1.104096 -1.557166
H -4.490073 1.333024 0.214334
H -3.432732 -3.639397 0.126073
H 3.700546 2.418663 0.679736
H 4.210641 0.224908 1.310008
H 2.950849 -1.041485 1.569033
H 0.146609 -3.858487 0.017686
H -1.317553 -4.703305 0.614453
H -0.329414 -3.697474 1.714254
H -1.346987 4.048033 0.452324
H 0.043734 4.911018 -0.305595
H -1.011423 3.832015 -1.294257
H 3.287734 -3.046519 -2.556188
H 4.670125 -1.906272 -2.394534
H 4.763605 -3.577443 -1.719777


