%chk=000233468.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000233468

0 1
S -0.935424 0.792014 0.354570
O -0.541086 1.512229 -0.846865
O -0.937841 1.486135 1.629702
N 0.099305 -0.579420 0.541778
C 2.271247 -1.160024 -0.465825
C 2.505220 -0.733168 1.028965
C 3.092632 -0.094739 -1.268281
C 3.401132 0.544611 0.892147
C 2.846508 1.194002 -0.417681
C 0.751506 -1.100537 -0.701681
C 1.115627 -0.493820 1.638093
C 4.561449 -0.358610 -0.912004
C 4.746013 0.024446 0.365550
C -2.483109 0.066686 0.074374
C -3.151944 -0.582074 1.115876
C -3.064312 0.146501 -1.195221
C -4.404420 -1.161219 0.885655
C -4.315796 -0.431117 -1.426503
C -4.983936 -1.085658 -0.385197
H 2.655723 -2.176723 -0.665282
H 3.042103 -1.516727 1.596168
H 2.856849 -0.032654 -2.332204
H 3.440445 1.181101 1.777824
H 3.427993 2.059733 -0.756179
H 1.797603 1.513421 -0.374962
H 0.505201 -0.484167 -1.594025
H 0.342582 -2.119668 -0.878537
H 0.866904 -1.293800 2.370969
H 1.058663 0.469903 2.191830
H 5.253089 -0.780882 -1.610295
H 5.625755 -0.006272 0.973331
H -2.704290 -0.634962 2.112867
H -2.542479 0.668409 -2.006422
H -4.927234 -1.666834 1.695903
H -4.770756 -0.368464 -2.413715
H -5.960823 -1.536152 -0.564921


%chk=000233468-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000233468

0 1
S -0.886926 0.682599 -0.058196
O -0.639798 1.324545 -1.546666
O -0.677786 1.575244 1.300243
N 0.169837 -0.983723 0.109650
C 2.531980 -1.103552 -0.673202
C 2.531643 -0.933106 0.898131
C 3.336386 0.168047 -1.161853
C 3.328847 0.419061 1.101061
C 2.848141 1.239359 -0.136842
C 1.040815 -1.149959 -1.106872
C 1.041352 -0.903657 1.334060
C 4.780252 -0.033111 -0.676591
C 4.775766 0.118115 0.680461
C -2.649965 0.021269 -0.027004
C -3.277656 -0.123404 1.220136
C -3.264470 -0.269888 -1.254890
C -4.605809 -0.608928 1.231051
C -4.592936 -0.753877 -1.222230
C -5.256892 -0.926888 0.015370
H 3.043194 -2.028918 -0.987727
H 3.052603 -1.764601 1.401994
H 3.205518 0.396897 -2.230532
H 3.191346 0.875949 2.092966
H 3.383761 2.197277 -0.241170
H 1.763141 1.432780 -0.164612
H 0.794013 -0.365703 -1.852622
H 0.779735 -2.127951 -1.551405
H 0.787051 -1.778738 1.960329
H 0.787083 0.007321 1.914990
H 5.618268 -0.334833 -1.311140
H 5.609303 -0.036508 1.371343
H -2.755206 0.154518 2.141004
H -2.731080 -0.102002 -2.195976
H -5.128882 -0.732303 2.185008
H -5.106169 -0.989088 -2.160403
H -6.286361 -1.300741 0.031938


