%chk=000276765.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000276765

0 1
S -1.140462 1.165248 1.131776
O -0.906044 2.223831 -0.171042
O -2.293288 1.749806 1.789877
O 0.110582 1.179329 1.869605
N 0.676130 -0.474878 -0.406389
N 2.979014 -0.290652 -1.056646
N 1.476843 -1.138261 -2.611219
N 4.876643 0.063683 0.251447
N 2.791695 0.766322 1.153737
C -1.546440 -0.291932 0.382745
C -0.600469 -1.007952 -0.390272
C -2.854254 -0.796551 0.519626
C -0.987486 -2.233959 -1.005575
C -3.224520 -1.985774 -0.087181
C -2.277072 -2.705627 -0.846313
C 1.657542 -0.632452 -1.310866
C 3.467428 0.172001 0.120879
H -3.584831 -0.233486 1.115715
H -0.252749 -2.811667 -1.561641
H -4.234827 -2.370619 0.020644
H -2.574551 -3.648347 -1.310646
H -1.254047 3.116663 -0.033817
H 2.243410 -1.050572 -3.268351
H 0.558068 -1.084181 -3.027429
H 5.365355 -0.266005 -0.579553
H 5.364094 0.820521 0.712668
H 3.234830 0.979344 2.033969
H 1.740710 0.754068 1.188553


%chk=000276765-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000276765

0 1
S -1.259672 1.288078 1.191928
O -0.946789 2.333492 -0.316943
O -2.618695 1.803957 1.898196
O 0.102087 1.326513 2.080953
N 0.728110 -0.482238 -0.320046
N 2.998954 -0.347378 -1.094470
N 1.378034 -1.037582 -2.575469
N 4.852526 0.336468 0.098707
N 2.740539 0.555186 1.133086
C -1.613124 -0.334484 0.340403
C -0.555452 -1.000938 -0.350673
C -2.933936 -0.800045 0.448417
C -0.935215 -2.260344 -0.936109
C -3.260807 -2.032548 -0.152679
C -2.248174 -2.754235 -0.834378
C 1.662000 -0.628292 -1.279637
C 3.480571 0.170723 0.055387
H -3.675012 -0.205956 0.993025
H -0.163401 -2.858385 -1.432115
H -4.279788 -2.423944 -0.083776
H -2.487685 -3.724140 -1.285632
H -0.291640 3.035152 -0.032341
H 2.144515 -1.023162 -3.244706
H 0.418209 -1.136979 -2.897404
H 5.374683 0.055089 -0.726886
H 5.340288 0.678019 0.921714
H 3.148963 1.018457 1.942751
H 1.711214 0.417419 1.082998


