%chk=000264010.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000264010

0 1
S 4.460480 -0.951066 -1.405462
O -2.537258 -1.454083 1.184165
O -0.665237 -2.502234 0.372316
O -0.301992 0.594674 -1.451286
O -2.374982 1.876691 0.679177
O -1.694960 2.349471 -1.452182
O 2.176325 -0.238467 -0.215759
N 4.040602 0.440027 0.851003
C -1.607435 -0.386630 0.896003
C -0.351352 -1.094683 0.342786
C -2.343102 0.607879 -0.012559
C -1.701680 0.935859 -1.386142
C 0.026833 -0.764080 -1.114656
C -2.079985 -2.708480 0.621264
C -1.675260 2.895333 -0.093713
C 1.532134 -0.847670 -1.392377
C -2.801708 -2.985848 -0.685772
C -2.216958 -3.773424 1.687441
C -0.250623 3.036657 0.396306
C -2.525323 4.143461 -0.105072
C 3.540541 -0.226894 -0.219289
C 3.176944 1.079964 1.867016
C 5.506783 0.506451 1.051820
H -1.421390 0.095873 1.886298
H 0.522624 -0.990244 1.027271
H -3.414726 0.307552 -0.104417
H -2.210573 0.570968 -2.293408
H -0.514856 -1.451092 -1.811707
H 1.816001 -0.250780 -2.282631
H 1.878305 -1.896117 -1.479039
H -2.312991 -3.799341 -1.237805
H -3.844742 -3.277987 -0.508558
H -2.819336 -2.105849 -1.336686
H -1.456056 -3.640467 2.470883
H -3.199203 -3.714503 2.175579
H -2.090647 -4.782148 1.277643
H 0.360913 2.182127 0.049980
H 0.226012 3.939931 -0.002738
H -0.206925 3.072855 1.489582
H -2.305055 4.758088 -0.989516
H -3.595607 3.889885 -0.142151
H -2.364754 4.755221 0.790452
H 3.172950 0.494496 2.802861
H 2.132852 1.157685 1.504977
H 3.530187 2.102011 2.086754
H 5.752064 0.998874 2.004173
H 5.986320 1.068384 0.225842
H 5.951142 -0.509229 1.057131


%chk=000264010-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000264010

0 1
S 4.424985 -1.493827 -1.369353
O -2.753985 -1.619434 0.066687
O -0.586889 -2.476591 0.501058
O -0.220686 0.848608 -1.215115
O -2.044955 1.880421 0.973669
O -1.762842 2.632327 -1.263582
O 2.232804 -0.256968 -0.252912
N 4.234385 0.311588 0.683587
C -1.949751 -0.533203 0.682264
C -0.502918 -0.999731 0.400038
C -2.387946 0.785022 0.039922
C -1.651632 1.201246 -1.257902
C -0.033023 -0.604300 -1.018446
C -2.031188 -2.878751 0.365258
C -1.751469 3.101999 0.164564
C 1.426673 -0.934345 -1.290912
C -2.201833 -3.817802 -0.826363
C -2.483753 -3.475934 1.703690
C -0.361371 3.608039 0.550174
C -2.877904 4.124247 0.308594
C 3.614631 -0.444924 -0.278178
C 3.517238 1.268315 1.551686
C 5.696674 0.209267 0.846341
H -2.139779 -0.481734 1.771854
H 0.216850 -0.647461 1.154290
H -3.480798 0.755893 -0.142272
H -2.109905 0.817691 -2.188174
H -0.644763 -1.165442 -1.760738
H 1.739444 -0.570277 -2.284660
H 1.599437 -2.023504 -1.230079
H -1.622536 -4.741800 -0.661545
H -3.265549 -4.082858 -0.953856
H -1.842759 -3.334314 -1.749447
H -2.406709 -2.728090 2.510987
H -3.529983 -3.820934 1.635749
H -1.839795 -4.332280 1.967300
H 0.386798 2.835349 0.312607
H -0.121981 4.525400 -0.014655
H -0.332239 3.836549 1.630090
H -2.713413 4.965613 -0.386398
H -3.849934 3.658922 0.076171
H -2.905564 4.514682 1.340113
H 3.560052 0.941754 2.608429
H 2.467200 1.336650 1.239269
H 3.982856 2.268267 1.470870
H 5.988927 0.766865 1.751366
H 6.223690 0.625661 -0.031823
H 6.000507 -0.846771 0.945579


