%chk=000266855.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000266855

0 1
S -0.391974 0.001292 -1.152639
O 3.022269 1.523207 -1.028413
O -0.453954 -1.058981 -2.129157
O 0.189853 1.289901 -1.522133
N 0.513410 -0.597805 0.195007
C 1.253216 1.526956 1.381696
C 0.502025 0.192013 1.452837
C 2.767884 1.338977 1.405047
C 3.348868 0.740085 0.110900
C 1.740548 -1.305066 -0.103000
C 3.024424 -0.728605 -0.112604
C 1.570886 -2.677747 -0.385966
C 4.121723 -1.563987 -0.394635
C -1.954617 0.283373 -0.482971
C 2.673885 -3.478726 -0.667677
C 3.957579 -2.921180 -0.665123
C -2.795844 -0.792920 -0.178968
C -2.400370 1.595145 -0.278754
C -4.068827 -0.563426 0.342653
C -3.671631 1.831844 0.241176
C -4.517398 0.752278 0.554787
C -5.874250 1.001331 1.120858
H 0.946218 2.165527 2.232750
H 0.967915 2.096259 0.466625
H 0.934543 -0.445817 2.260166
H -0.561403 0.362256 1.738712
H 3.247125 2.328005 1.563862
H 3.069286 0.709776 2.264241
H 4.465345 0.872351 0.137511
H 0.566754 -3.103307 -0.399902
H 5.125396 -1.135529 -0.416739
H 2.039994 1.537312 -1.223197
H 2.536619 -4.535315 -0.892670
H 4.823148 -3.543109 -0.884416
H -2.460087 -1.820542 -0.354818
H -1.748629 2.440224 -0.535551
H -4.717718 -1.405126 0.578413
H -4.012210 2.854056 0.397043
H -6.593647 0.213614 0.854821
H -5.836762 1.042667 2.221039
H -6.305593 1.953343 0.779589


%chk=000266855-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000266855

0 1
S -0.384918 -0.151153 -1.138035
O 2.969232 1.557141 -1.057023
O -0.510701 -1.418354 -2.144370
O 0.244856 1.270829 -1.704086
N 0.600799 -0.842388 0.452532
C 1.250101 1.483601 1.498285
C 0.524290 0.123342 1.584589
C 2.783074 1.375460 1.431370
C 3.347801 0.768080 0.124426
C 1.849000 -1.413850 0.021727
C 3.111099 -0.734703 -0.087392
C 1.747733 -2.786364 -0.342546
C 4.229482 -1.502558 -0.498812
C -2.078297 0.252623 -0.435794
C 2.873888 -3.517594 -0.763192
C 4.128276 -2.870848 -0.831664
C -2.950381 -0.812631 -0.154118
C -2.429168 1.602397 -0.273449
C -4.235510 -0.495613 0.336782
C -3.722362 1.891615 0.214382
C -4.637147 0.853339 0.534921
C -6.012364 1.176565 1.088262
H 0.966640 2.057175 2.403284
H 0.878906 2.060946 0.630656
H 0.921265 -0.452126 2.446072
H -0.551892 0.283941 1.783987
H 3.211077 2.392302 1.517288
H 3.161972 0.787851 2.293771
H 4.443626 0.905911 0.164936
H 0.762861 -3.255470 -0.268365
H 5.199712 -0.998901 -0.585168
H 2.006029 1.420511 -1.318191
H 2.774488 -4.573935 -1.033482
H 5.018855 -3.422155 -1.152821
H -2.644177 -1.847978 -0.332018
H -1.721960 2.391697 -0.548772
H -4.937743 -1.306389 0.561917
H -4.025243 2.937228 0.340805
H -6.754416 0.410244 0.805332
H -5.989786 1.219478 2.194479
H -6.374997 2.155338 0.729898


