%chk=000223616.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000223616

0 1
S 1.751949 0.438958 0.447687
O 1.384591 0.072672 1.792199
O 2.589009 1.602660 0.233524
N 0.348284 0.693389 -0.536923
N 2.494320 -0.944781 -0.278537
C 0.024064 2.123725 -0.816487
C -0.967665 2.688335 0.207978
C -2.277068 1.892816 0.167712
C -0.803645 -0.141907 -0.304077
C -2.065454 0.411010 0.018392
C -0.661033 -1.533232 -0.460664
C -3.159778 -0.449982 0.182806
C -1.763972 -2.368563 -0.286287
C -3.013892 -1.830467 0.035897
C 3.092362 -0.666901 -1.609055
C 3.417244 -1.658767 0.640589
H -0.410644 2.167828 -1.842236
H 0.963122 2.726473 -0.841681
H -1.159793 3.758137 0.004338
H -0.531736 2.651936 1.227160
H -2.906882 2.248473 -0.675974
H -2.861784 2.097850 1.088975
H 0.306600 -1.966155 -0.723857
H -4.136013 -0.036930 0.433534
H -1.648069 -3.444940 -0.403407
H -3.870993 -2.485896 0.173253
H 3.518453 -1.593230 -2.030546
H 3.886823 0.099824 -1.595599
H 2.295989 -0.336373 -2.301854
H 2.913434 -1.833774 1.612691
H 4.368743 -1.135245 0.827891
H 3.651234 -2.652143 0.218957


%chk=000223616-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000223616

0 1
S 1.777916 0.424408 0.541320
O 1.383684 -0.123781 2.023972
O 2.689293 1.782291 0.409188
N 0.202861 0.650450 -0.811523
N 2.591120 -1.074056 -0.350265
C -0.024785 2.122845 -0.887231
C -0.988701 2.665088 0.185036
C -2.343650 1.939589 0.070599
C -0.908383 -0.143341 -0.405303
C -2.166101 0.431038 -0.024822
C -0.759373 -1.560954 -0.468692
C -3.250982 -0.439873 0.227509
C -1.846203 -2.402585 -0.186533
C -3.103931 -1.841302 0.153891
C 3.219542 -0.584347 -1.606496
C 3.546532 -1.731561 0.585781
H -0.428426 2.303627 -1.905148
H 0.963516 2.614775 -0.830459
H -1.118725 3.754895 0.055605
H -0.545670 2.501889 1.186318
H -2.879422 2.301176 -0.832557
H -2.992371 2.181971 0.932718
H 0.226552 -1.961202 -0.729886
H -4.221887 -0.009186 0.502975
H -1.722673 -3.489723 -0.233304
H -3.957904 -2.493235 0.367962
H 3.553270 -1.477444 -2.166662
H 4.090784 0.082691 -1.439929
H 2.458965 -0.059175 -2.206328
H 3.053069 -1.870237 1.561600
H 4.496105 -1.172580 0.724597
H 3.773775 -2.727352 0.162466


