%chk=000186525.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000186525

0 1
O 1.956777 2.603370 -0.130002
O 1.741915 -1.672180 -0.751989
O 3.669139 -1.251987 -1.811863
N 1.800747 0.507810 0.766219
C -1.115217 1.045354 0.667346
C -0.089946 2.076723 1.037057
C -1.547356 0.933807 -0.663613
C -1.651616 0.192832 1.642387
C -3.046236 -0.872365 -0.037899
C 1.284716 1.782389 0.467541
C -2.504401 -0.018390 -1.013266
C -2.611014 -0.759219 1.291780
C 3.071111 0.088440 0.156487
C -4.063185 -1.899107 -0.415588
C 2.912282 -0.967401 -0.918073
H -0.408498 3.081270 0.667753
H -0.009094 2.199864 2.139252
H -1.133929 1.593325 -1.426984
H -1.327779 0.272160 2.678818
H -2.833053 -0.097510 -2.048271
H -3.023014 -1.415241 2.056521
H 1.179964 -0.251132 1.054525
H 3.751593 -0.311567 0.950091
H 3.597814 0.981338 -0.289790
H -4.747172 -2.134446 0.410919
H -4.685737 -1.578104 -1.261838
H -3.575717 -2.840324 -0.710835
H 1.608302 -2.366310 -1.452484


%chk=000186525-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000186525

0 1
O 2.293629 2.648389 0.997145
O 1.835306 -1.809952 -0.864214
O 4.152821 -1.755219 -1.057095
N 1.610905 0.587244 0.193464
C -1.150585 1.116611 0.676366
C -0.118388 2.171339 1.034477
C -1.741679 1.079657 -0.613619
C -1.545972 0.129858 1.616215
C -3.087627 -0.896353 -0.011158
C 1.359493 1.826335 0.741796
C -2.693263 0.092471 -0.949835
C -2.498228 -0.857240 1.278838
C 2.983299 0.187667 -0.111171
C -4.095880 -1.970193 -0.382160
C 3.090092 -1.198342 -0.718034
H -0.314911 3.118189 0.498299
H -0.159176 2.418137 2.111583
H -1.461855 1.837962 -1.355557
H -1.112383 0.142611 2.623994
H -3.142253 0.092932 -1.950822
H -2.793568 -1.602016 2.028096
H 0.850420 -0.066523 -0.009383
H 3.615150 0.213755 0.798676
H 3.458823 0.905992 -0.808040
H -4.629453 -2.349538 0.506852
H -4.848290 -1.590004 -1.095692
H -3.598468 -2.835915 -0.861497
H 1.943434 -2.714457 -1.263324


