%chk=000209822.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000209822

0 1
S -3.995288 0.393130 -1.989813
O -2.500406 1.815894 1.877877
O -6.219735 -1.465880 1.766903
O -4.921801 -2.471458 0.241577
O 0.558110 2.234579 -1.439383
O 5.009419 1.481481 1.480224
O 3.948483 -2.281468 -1.550190
O 5.899965 -0.987073 0.232829
N -3.350117 -0.007399 0.553489
N -0.323982 0.494537 -0.248495
C -2.728206 -0.152736 -0.800894
C -5.368638 0.610764 -0.746347
C -4.818020 0.000711 0.581961
C -1.689830 0.947502 -0.420354
C -2.501409 1.121866 0.914810
C -6.576971 -0.115829 -1.295232
C -5.605611 2.100803 -0.591485
C -5.258573 -1.449794 0.778909
C 0.750223 1.222392 -0.798912
C 2.093483 0.616872 -0.502202
C 2.462654 -0.573333 -1.122677
C 2.940924 1.274384 0.392622
C 4.208419 0.729329 0.644840
C 3.745608 -1.110480 -0.876900
C 4.640257 -0.448373 -0.007009
C 5.631235 0.761241 2.581460
C 5.201443 -2.991262 -1.359550
C 6.972894 -0.193587 -0.358400
H -2.352458 -1.164644 -1.036585
H -5.175721 0.602077 1.469466
H -1.727541 1.871706 -1.058846
H -6.970622 0.367387 -2.201722
H -6.358625 -1.158526 -1.578600
H -7.402526 -0.137928 -0.569040
H -4.736145 2.633900 -0.182773
H -6.455757 2.310353 0.073362
H -5.837647 2.582531 -1.553407
H -0.171780 -0.349352 0.299798
H -6.546379 -2.381250 1.977414
H 1.800067 -1.093329 -1.814233
H 2.647996 2.202302 0.884725
H 6.333891 1.506235 2.971352
H 6.146433 -0.140894 2.232744
H 4.858882 0.518545 3.317089
H 6.012630 -2.434782 -1.835982
H 4.997803 -3.937657 -1.874660
H 5.402062 -3.140874 -0.292613
H 7.866105 -0.737350 -0.035770
H 6.873224 -0.187945 -1.446613
H 6.953278 0.825981 0.042936


%chk=000209822-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000209822

0 1
S -3.931082 1.851842 -1.249998
O -2.771426 -1.045323 2.149901
O -6.623407 -2.013077 -1.273965
O -4.703312 -1.603464 -2.521416
O 0.450524 2.270192 0.525761
O 5.448932 1.916412 -0.509739
O 3.939181 -2.704493 0.469928
O 6.087506 -0.886015 -0.198429
N -3.524266 -0.565309 -0.117386
N -0.348682 0.120694 0.145916
C -2.734088 0.409013 -0.906427
C -5.433368 0.940700 -0.398213
C -4.972858 -0.581970 -0.272421
C -1.727456 0.508422 0.310846
C -2.693954 -0.498856 1.035876
C -6.678840 1.150830 -1.279181
C -5.635623 1.522757 1.017403
C -5.367750 -1.430477 -1.480690
C 0.688972 1.041561 0.314587
C 2.085493 0.496681 0.213237
C 2.400965 -0.866811 0.432484
C 3.121904 1.418408 -0.069562
C 4.450838 0.973488 -0.175553
C 3.733149 -1.324477 0.318404
C 4.769219 -0.409795 -0.029019
C 6.499468 2.103523 0.519703
C 5.010503 -3.138296 1.396373
C 6.610172 -0.748723 -1.583579
H -2.337757 0.040742 -1.862638
H -5.438143 -1.016945 0.628572
H -1.747508 1.513264 0.767640
H -6.945364 2.221841 -1.305946
H -6.505367 0.819855 -2.317004
H -7.539236 0.593346 -0.865096
H -4.771814 1.315828 1.672917
H -6.540885 1.088163 1.485068
H -5.762637 2.617304 0.966612
H -0.130494 -0.846329 -0.098132
H -6.882063 -2.545942 -2.074859
H 1.650579 -1.605931 0.732409
H 2.888475 2.479272 -0.193900
H 7.197569 2.838356 0.091350
H 7.019537 1.152299 0.732629
H 6.050753 2.506444 1.446868
H 5.989833 -2.749837 1.073963
H 4.990805 -4.237673 1.355126
H 4.782450 -2.796520 2.424125
H 7.643155 -1.125858 -1.543288
H 6.006257 -1.364889 -2.274207
H 6.592842 0.309075 -1.899349


