%chk=000257330.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000257330

0 1
S -1.155879 -0.895333 0.456596
O 2.480106 -2.155088 0.033184
O 0.986597 -2.014576 1.697725
O -1.562114 2.031534 -1.616938
N -2.274557 2.096743 0.537860
C 0.389292 -1.133869 -0.519066
C 0.994087 0.195561 -0.971327
C 0.149120 -2.069517 -1.708857
C 1.342474 1.159068 0.170731
C 1.514974 2.590071 -0.359171
C 1.253766 -1.795225 0.541439
C -0.403055 -3.437754 -1.328696
C -2.284520 -0.056743 -0.672546
C 1.876588 3.564922 0.758088
C -1.986401 1.421178 -0.647680
H 1.915313 -0.010696 -1.560431
H 0.303690 0.695843 -1.689974
H -0.528424 -1.577226 -2.437658
H 1.114591 -2.205597 -2.248977
H 2.269995 0.827453 0.676411
H 0.559738 1.151025 0.954661
H 0.577697 2.917141 -0.861061
H 2.296135 2.613317 -1.143629
H -1.365760 -3.371544 -0.804588
H -0.563425 -4.054846 -2.221476
H 0.282258 -3.991758 -0.675020
H -2.208668 -0.444978 -1.710586
H -3.321372 -0.283075 -0.345118
H 2.827779 3.299660 1.233952
H 1.113326 3.585116 1.543256
H 1.978001 4.585750 0.371707
H 3.063718 -2.583487 0.716395
H -1.981601 3.060602 0.625986
H -2.418067 1.609226 1.407708


%chk=000257330-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000257330

0 1
S -1.361287 -0.941024 0.520294
O 2.510554 -2.021555 0.009207
O 1.028191 -2.007895 1.790091
O -2.895827 2.078331 -1.790887
N -2.210529 2.043805 0.436688
C 0.317294 -1.124190 -0.441133
C 0.874397 0.256959 -0.897425
C 0.155346 -2.080832 -1.660534
C 1.341213 1.200995 0.230455
C 1.704906 2.606486 -0.299555
C 1.260280 -1.752274 0.591366
C -0.330750 -3.504968 -1.330376
C -2.434809 -0.095446 -0.792343
C 2.216984 3.548123 0.811095
C -2.511696 1.441007 -0.764383
H 1.727938 0.057101 -1.576067
H 0.097013 0.756296 -1.508032
H -0.531937 -1.603696 -2.385681
H 1.143417 -2.132258 -2.157525
H 2.223658 0.764964 0.741271
H 0.545683 1.290155 0.995749
H 0.813000 3.051596 -0.785394
H 2.477046 2.513604 -1.090614
H -1.306932 -3.485577 -0.815878
H -0.436405 -4.095036 -2.258375
H 0.386275 -4.035545 -0.677262
H -2.128623 -0.408039 -1.802193
H -3.452220 -0.490904 -0.621483
H 3.127443 3.140419 1.289354
H 1.455497 3.680399 1.603164
H 2.464577 4.548011 0.410406
H 3.108186 -2.419279 0.699103
H -2.301877 3.055611 0.518924
H -1.840601 1.487554 1.210877


