%chk=000181983.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000181983

0 1
O -1.687964 2.435247 0.069310
O 3.049971 1.819339 -0.050171
N 0.823586 1.430078 0.002939
C -0.067780 -0.848214 0.012300
C -0.262134 0.550553 0.024531
C 1.304443 -1.350446 -0.023657
C -1.606803 1.059210 0.059945
C -1.206622 -1.697480 0.035281
C 2.346069 -0.479399 -0.044615
C 2.179953 0.968567 -0.033088
C 1.539939 -2.823697 -0.036616
C -2.701204 0.218467 0.082016
C -2.485702 -1.180009 0.069166
H 0.641507 2.440374 0.013016
H -1.060749 -2.777341 0.025745
H 3.385481 -0.811520 -0.071679
H 1.120853 -3.305969 0.859640
H 2.609092 -3.081480 -0.063552
H 1.078295 -3.297252 -0.916438
H -3.715105 0.608653 0.108830
H -3.350427 -1.842321 0.086492
H -2.627400 2.745539 0.094405


%chk=000181983-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000181983

0 1
O -1.666322 2.481151 0.069379
O 3.097691 1.857520 -0.051042
N 0.806176 1.408900 0.003148
C -0.079101 -0.873728 0.012416
C -0.279770 0.541168 0.025017
C 1.300723 -1.364467 -0.023531
C -1.601066 1.073153 0.060164
C -1.223115 -1.725531 0.035455
C 2.343974 -0.456984 -0.044136
C 2.160203 0.999833 -0.032258
C 1.570017 -2.855236 -0.037652
C -2.714547 0.220892 0.082593
C -2.518968 -1.187266 0.069957
H 0.622229 2.418063 0.012906
H -1.086607 -2.810817 0.026142
H 3.385068 -0.792568 -0.071079
H 1.150822 -3.347119 0.860472
H 2.652508 -3.058800 -0.065043
H 1.107653 -3.338164 -0.919288
H -3.729927 0.636097 0.109663
H -3.390966 -1.848372 0.087503
H -2.599374 2.803172 0.093013


