%chk=000295335.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000295335

0 1
S -0.730677 -2.364919 -0.459069
O -0.708519 -3.695123 0.116872
O -1.147229 -2.162389 -1.828066
N -1.786265 -1.509539 0.591055
C 0.796479 -1.592933 -0.217778
C -2.233098 -0.170264 0.389629
C 2.377667 0.202373 -0.656607
C 1.110641 -0.424478 -0.868281
C 3.309003 -0.401021 0.230195
C -2.567201 0.634854 1.513326
C 1.731703 -2.201415 0.667355
C 2.956004 -1.622365 0.887298
C -2.339182 0.362666 -0.905031
C -2.978711 1.952772 1.302064
C -3.062668 2.492467 0.007576
C -2.741784 1.686219 -1.090831
C 2.728353 1.423219 -1.318158
C 4.577805 0.228511 0.440796
C -2.486507 0.094134 2.904780
C 3.950992 2.004314 -1.097687
C 4.886480 1.398025 -0.206782
C -3.501773 3.908780 -0.180287
H -2.200963 -1.996913 1.393379
H 0.403861 0.047417 -1.561426
H 1.460502 -3.142509 1.160259
H 3.677920 -2.082933 1.560664
H -2.140955 -0.261450 -1.784970
H -3.238225 2.576281 2.156533
H -2.817061 2.082041 -2.102196
H 2.005391 1.877193 -1.996372
H 5.287342 -0.239914 1.121537
H -1.495322 -0.334100 3.113652
H -2.662487 0.868266 3.663868
H -3.237053 -0.690922 3.074254
H 4.228326 2.932507 -1.595487
H 5.850286 1.884009 -0.052925
H -2.881928 4.602672 0.404077
H -3.448967 4.232739 -1.227466
H -4.542884 4.045527 0.146250


%chk=000295335-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000295335

0 1
S -0.936086 -2.551393 -0.621073
O -0.833153 -4.048793 0.007970
O -1.237489 -2.261874 -2.190061
N -2.434164 -1.712205 0.371809
C 0.658318 -1.626502 -0.185762
C -2.510495 -0.297560 0.266325
C 2.201240 0.192387 -0.621574
C 1.003438 -0.523194 -0.953041
C 3.009391 -0.262596 0.494455
C -2.181015 0.578713 1.353641
C 1.425442 -2.107100 0.911899
C 2.597007 -1.421380 1.236477
C -2.967077 0.244378 -0.968332
C -2.359018 1.968485 1.168002
C -2.807949 2.522104 -0.058961
C -3.098220 1.634446 -1.129976
C 2.619925 1.341703 -1.369089
C 4.207883 0.454788 0.816823
C -1.671433 0.030760 2.675004
C 3.792513 2.019514 -1.028861
C 4.591581 1.572710 0.071940
C -3.000664 4.019368 -0.213884
H -2.272950 -2.066514 1.333111
H 0.384754 -0.221464 -1.805421
H 1.110845 -3.010457 1.444203
H 3.223177 -1.772806 2.064510
H -3.216476 -0.448406 -1.777681
H -2.126918 2.644422 2.001099
H -3.447659 2.037385 -2.087977
H 2.006429 1.679682 -2.211908
H 4.822972 0.111932 1.657112
H -0.749290 -0.568039 2.541454
H -1.434258 0.850588 3.372980
H -2.419137 -0.616284 3.174529
H 4.108195 2.896134 -1.604395
H 5.509947 2.113039 0.325720
H -2.386258 4.586013 0.507311
H -2.736710 4.358445 -1.231465
H -4.057343 4.303370 -0.040911


