%chk=000292379.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000292379

0 1
S 1.618583 2.684527 0.457180
O 4.253800 -1.683211 0.244864
N 2.265954 0.254169 -0.354095
C 2.030198 -1.186846 -0.646919
C 3.708656 0.621013 -0.387476
C 2.863434 -2.047759 0.319460
C 4.489907 -0.295627 0.565990
C 1.295268 1.106224 0.049946
C -4.253715 -0.579093 0.300144
C -0.110933 0.643418 0.100114
C -2.800417 -0.150351 0.218106
C -1.997814 -0.188902 1.368827
C -2.244145 0.295042 -0.991751
C -0.660824 0.209538 1.314769
C -0.908583 0.692889 -1.053483
C -4.516952 -1.773272 -0.625571
C -5.176019 0.600636 -0.029785
H 2.338944 -1.387124 -1.699807
H 0.951267 -1.445924 -0.571901
H 3.864677 1.693967 -0.111451
H 4.074668 0.505009 -1.433285
H 2.515663 -1.953175 1.363191
H 2.879521 -3.111359 0.018523
H 5.582776 -0.205100 0.426506
H 4.226601 -0.116528 1.623463
H -4.477445 -0.904627 1.350120
H -2.418800 -0.520176 2.317180
H -2.862131 0.340558 -1.887500
H -0.050466 0.199405 2.218044
H -0.488603 1.057190 -1.991144
H -4.375584 -1.513266 -1.680375
H -5.544808 -2.136797 -0.515954
H -3.843632 -2.607590 -0.399820
H -4.963109 1.462405 0.614554
H -6.228444 0.332119 0.111342
H -5.059994 0.935821 -1.066405


%chk=000292379-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000292379

0 1
S 1.759461 2.324839 1.490351
O 4.453599 -1.622157 -0.249670
N 2.254336 0.265866 -0.245557
C 2.061660 -1.118925 -0.753806
C 3.657207 0.724698 -0.402323
C 3.067750 -2.068376 -0.060800
C 4.620314 -0.258238 0.288990
C 1.338111 0.958454 0.522376
C -4.377575 -0.467288 0.258322
C -0.094615 0.529552 0.448943
C -2.886755 -0.128067 0.318258
C -2.235878 0.073719 1.562672
C -2.113022 0.014148 -0.864035
C -0.868346 0.410039 1.631056
C -0.740540 0.326722 -0.803389
C -4.626086 -1.845628 -0.411335
C -5.185127 0.647868 -0.459599
H 2.237081 -1.128831 -1.847285
H 1.033340 -1.455350 -0.555438
H 3.741701 1.732704 0.038718
H 3.883892 0.764760 -1.485544
H 2.831263 -2.130285 1.023917
H 3.015353 -3.075625 -0.506351
H 5.669454 0.011499 0.087685
H 4.438986 -0.256617 1.384277
H -4.747430 -0.529959 1.301656
H -2.813193 -0.021461 2.490504
H -2.587556 -0.111477 -1.844598
H -0.386254 0.602003 2.595203
H -0.171085 0.456370 -1.731412
H -4.289830 -1.842082 -1.464993
H -5.704203 -2.091215 -0.402889
H -4.083004 -2.650918 0.115336
H -5.031491 1.628138 0.025773
H -6.266196 0.415853 -0.441597
H -4.877824 0.742470 -1.517812


