%chk=000267544.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000267544

0 1
O 3.276489 -0.609047 -0.513339
O 1.444022 -2.809942 0.177857
O 2.101495 2.049543 -0.484454
O -2.496780 0.680454 2.010918
N -3.074581 -0.057444 -0.117153
N -4.467845 0.112007 0.095845
C -0.748714 0.024519 0.495181
C 1.942121 -0.392702 -0.181928
C 1.110792 -1.484326 0.150304
C 1.378458 0.903723 -0.215462
C -0.244189 -1.271838 0.487812
C 0.037730 1.120439 0.130910
C -2.182636 0.264015 0.920727
C -5.162101 -1.211860 -0.013479
C -5.019071 1.076868 -0.909765
C 4.193521 -0.129159 0.515565
C 2.794619 -3.200032 -0.185276
C 2.882009 2.036680 -1.711746
H -0.858658 -2.128649 0.762144
H -0.360475 2.134571 0.130465
H -2.736524 -0.414757 -1.013245
H -6.219343 -1.062061 0.261422
H -5.119554 -1.690637 -1.000786
H -4.733907 -1.903768 0.732465
H -4.484390 2.037981 -0.816001
H -6.072344 1.271348 -0.647513
H -4.971945 0.750190 -1.957142
H 5.170757 -0.347118 0.074620
H 4.051602 0.945836 0.674075
H 4.034350 -0.684781 1.443028
H 2.704342 -4.291685 -0.229652
H 3.072772 -2.771947 -1.154981
H 3.489372 -2.881064 0.595968
H 3.488882 2.942606 -1.604942
H 3.504077 1.137227 -1.784547
H 2.195947 2.113709 -2.559895


%chk=000267544-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000267544

0 1
O 3.411693 -0.628243 -0.134142
O 1.426729 -2.709895 0.180284
O 2.503539 2.111744 -0.225889
O -2.511516 1.851961 0.792140
N -3.095892 -0.270378 -0.008937
N -4.493141 -0.059576 0.141715
C -0.728559 0.311002 0.180232
C 2.035350 -0.309296 -0.071179
C 1.075609 -1.354011 0.054751
C 1.584645 1.042922 -0.120229
C -0.295628 -1.038007 0.182992
C 0.219604 1.349657 0.024638
C -2.173766 0.709910 0.363421
C -5.180442 -1.321933 0.462873
C -5.074639 0.708226 -0.985432
C 4.183743 -0.186905 1.057307
C 2.304233 -3.282296 -0.865167
C 3.291953 2.140876 -1.479911
H -0.985882 -1.871437 0.348437
H -0.109246 2.392567 0.029258
H -2.778441 -1.052535 -0.601550
H -6.244776 -1.103648 0.654898
H -5.127342 -2.083540 -0.357436
H -4.741679 -1.754755 1.376687
H -4.533027 1.663525 -1.071423
H -6.130214 0.929754 -0.751732
H -5.028515 0.165749 -1.960954
H 5.226609 -0.472729 0.852201
H 4.098302 0.906289 1.187674
H 3.814960 -0.710403 1.957983
H 2.468686 -4.326096 -0.557465
H 1.791467 -3.256660 -1.846395
H 3.259219 -2.735352 -0.921216
H 3.964898 3.005827 -1.379423
H 3.872462 1.209349 -1.604846
H 2.619301 2.287235 -2.346168


