%chk=000277903.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000277903

0 1
S -0.712851 -2.010767 -0.101368
O -0.361505 -2.327156 -1.463833
O -1.262506 -3.059105 0.741107
N 1.391422 -0.524841 0.210313
N 0.722630 -1.571562 0.787312
C 3.212290 1.054643 -0.130205
C 2.598691 -0.180714 0.557918
C 4.485794 0.608669 -0.872291
C 2.240580 1.687901 -1.142060
C 3.552063 2.093296 0.955140
C 3.440375 -0.896765 1.574107
C -1.711414 -0.616589 -0.041909
C -1.458023 0.469886 -0.887028
C -2.787032 -0.567636 0.853862
C -3.357512 1.650494 0.054017
C -2.276523 1.599216 -0.842415
C -3.608848 0.556975 0.902789
C -4.244790 2.849359 0.093980
H 5.243612 0.208108 -0.192420
H 4.259821 -0.170782 -1.609757
H 4.941439 1.446187 -1.411006
H 2.684931 2.561095 -1.627875
H 1.311321 2.008551 -0.657044
H 1.962709 0.973667 -1.927446
H 3.956649 3.008562 0.510330
H 2.660206 2.371859 1.527797
H 4.296268 1.720836 1.665617
H 4.426822 -0.433043 1.707966
H 2.955787 -0.899095 2.561057
H 3.620944 -1.940535 1.281029
H 1.217732 -2.261724 1.369025
H -0.613913 0.435944 -1.586266
H -2.986628 -1.419608 1.515788
H -2.076313 2.438843 -1.504623
H -4.445561 0.587263 1.597650
H -5.089289 2.729318 -0.603372
H -4.674658 3.022139 1.090497
H -3.721118 3.771712 -0.193185


%chk=000277903-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000277903

0 1
S -0.711550 -1.840695 -0.364374
O -0.265764 -1.890720 -1.928164
O -1.241213 -3.162459 0.428363
N 1.537766 -0.326985 0.143308
N 0.745740 -1.257096 0.790966
C 3.577672 0.998797 -0.141714
C 2.761819 -0.090176 0.572316
C 4.902038 0.370883 -0.674556
C 2.789767 1.597120 -1.333204
C 3.912698 2.134659 0.872347
C 3.349735 -0.846259 1.753261
C -1.935862 -0.439425 -0.145441
C -1.954222 0.584570 -1.104783
C -2.803565 -0.488650 0.956737
C -3.804059 1.620997 0.158545
C -2.901314 1.618921 -0.937723
C -3.741002 0.557071 1.098399
C -4.838845 2.721431 0.305798
H 5.518805 -0.058775 0.136039
H 4.690765 -0.426844 -1.409467
H 5.505088 1.149964 -1.176659
H 3.407324 2.362697 -1.839345
H 1.850693 2.066496 -0.993489
H 2.521908 0.815694 -2.064811
H 4.524571 2.910382 0.375446
H 2.987755 2.611391 1.244530
H 4.484287 1.763042 1.742463
H 4.344980 -0.471693 2.033616
H 2.683222 -0.765414 2.634192
H 3.455293 -1.928157 1.525272
H 1.182602 -2.159045 1.093380
H -1.262239 0.561950 -1.952282
H -2.754504 -1.321725 1.665076
H -2.938242 2.434090 -1.669473
H -4.432682 0.545875 1.948553
H -5.780332 2.445337 -0.207482
H -5.086025 2.907583 1.365367
H -4.489504 3.669771 -0.137814


