%chk=000221242.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000221242

0 1
S -0.945281 -0.753464 -1.590783
O -1.339039 -2.167409 0.431512
O -2.714616 -1.923572 2.179179
O 5.396475 -0.321567 0.266812
O 4.499559 1.150150 1.576943
N 0.755304 0.476852 0.069012
N 4.443405 0.304789 0.699270
C -2.051048 0.285679 -0.682688
C -2.614032 -0.160662 0.519431
C -2.400960 1.517376 -1.231414
C 0.641843 -0.454748 -0.916015
C -3.550944 0.651309 1.178986
C -3.340140 2.319155 -0.567798
C -3.912163 1.886804 0.631817
C 1.729538 -1.185677 -1.433572
C 3.124403 0.021750 0.119105
C 2.990867 -0.938819 -0.903149
C 1.982653 0.713552 0.584911
C -2.271029 -1.457046 1.153308
H -1.947732 1.864956 -2.162135
H -3.991096 0.308819 2.121548
H -3.619217 3.286150 -0.989104
H 1.589334 -1.924271 -2.223732
H -4.639946 2.514611 1.147891
H 3.877720 -1.475060 -1.262860
H 2.060330 1.469569 1.384354
H -1.126088 -3.044127 0.871371


%chk=000221242-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000221242

0 1
S -0.898486 -0.504523 -1.927732
O -1.251144 -2.119476 0.540907
O -1.991593 -1.243858 2.546213
O 5.445584 -0.555731 0.384096
O 4.391104 0.543572 2.090159
N 0.728229 0.244456 0.170269
N 4.391437 -0.056113 0.944832
C -2.105585 0.364261 -0.832462
C -2.437668 0.004566 0.504855
C -2.757390 1.454933 -1.453329
C 0.683846 -0.369901 -1.040766
C -3.407929 0.783602 1.193165
C -3.742318 2.196020 -0.764015
C -4.062013 1.863417 0.570684
C 1.829338 -0.924671 -1.680626
C 3.110966 -0.179572 0.230193
C 3.067493 -0.825938 -1.030147
C 1.927167 0.341747 0.800395
C -1.875808 -1.129881 1.301602
H -2.477436 1.731880 -2.474326
H -3.630239 0.510115 2.229414
H -4.238095 3.034825 -1.263635
H 1.743090 -1.413618 -2.655194
H -4.811308 2.440491 1.121914
H 3.985802 -1.228954 -1.464765
H 1.949482 0.839866 1.773614
H -0.938427 -2.836416 1.156885


