%chk=000251668.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000251668

0 1
S -1.028946 -0.725845 1.049136
O 0.237422 -1.346886 -2.271756
N -1.889663 -2.970964 2.127717
N -1.321697 -3.048798 -0.239970
C -1.007142 -0.059394 -0.650117
C 0.351313 -0.256738 -1.361976
C -1.375110 1.382565 -0.462237
C 1.527287 -0.431184 -0.423696
C -0.680282 2.201046 0.441760
C -2.437518 1.919958 -1.208174
C 2.285909 0.691945 -0.062749
C 1.892223 -1.696992 0.054533
C -1.048875 3.540372 0.597872
C -2.797461 3.260292 -1.050681
C 3.384048 0.551254 0.790472
C 2.992215 -1.834081 0.905458
C -2.105324 4.072958 -0.146793
C 3.737191 -0.710643 1.278355
C -1.479478 -2.449155 0.890835
H -1.779338 -0.599683 -1.264995
H 0.532713 0.597621 -2.067457
H 0.148884 1.802143 1.029368
H -2.981906 1.293774 -1.914062
H 2.027840 1.676240 -0.450714
H 1.320295 -2.577208 -0.242585
H -0.022323 -2.185630 -1.803336
H -0.509252 4.170060 1.303962
H -3.620116 3.672245 -1.633451
H 3.967857 1.425802 1.070676
H 3.268905 -2.818686 1.277793
H -2.388785 5.116472 -0.023808
H 4.591864 -0.819133 1.942489
H -2.384316 -3.850459 2.142481
H -2.160270 -2.341848 2.871164
H -1.578461 -4.025520 -0.351317


%chk=000251668-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000251668

0 1
S -1.282693 -1.258395 1.211047
O 0.352095 -2.166807 -1.454669
N -2.982840 -3.313305 1.562292
N -1.915678 -3.199643 -0.609584
C -0.996654 -0.330081 -0.464550
C 0.348928 -0.752939 -1.161742
C -1.195385 1.155678 -0.234466
C 1.621762 -0.370763 -0.406555
C -0.522984 1.860200 0.798379
C -2.067329 1.873483 -1.093811
C 2.258791 0.872691 -0.641686
C 2.194577 -1.272017 0.524061
C -0.721430 3.247442 0.966327
C -2.258814 3.264573 -0.933420
C 3.433305 1.225088 0.061649
C 3.366262 -0.921366 1.231077
C -1.586832 3.956229 0.100311
C 3.987734 0.330354 1.006354
C -2.148826 -2.761300 0.606158
H -1.808256 -0.727609 -1.101449
H 0.331637 -0.175032 -2.116661
H 0.156449 1.324298 1.469934
H -2.598407 1.339060 -1.891322
H 1.836699 1.567452 -1.378370
H 1.725529 -2.251280 0.654718
H -0.563476 -2.608355 -1.236138
H -0.197596 3.775931 1.770623
H -2.934488 3.803546 -1.607100
H 3.917351 2.189223 -0.132584
H 3.802914 -1.627241 1.947423
H -1.737956 5.033602 0.231733
H 4.901397 0.598825 1.549590
H -3.374917 -4.244927 1.435555
H -3.198263 -2.805100 2.418270
H -2.472903 -4.005615 -0.937196


