%chk=000180214.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000180214

0 1
S -0.471919 -0.873722 1.023090
O -0.814268 -2.248053 0.697783
O -0.463811 -0.465312 2.419226
N -1.540630 0.112188 0.132353
C -1.687251 1.575684 0.389417
C -2.781837 -0.453482 -0.490357
C -2.768756 2.022010 -0.626051
C -3.630616 0.778928 -0.899154
C -2.099067 1.907093 1.825261
C -2.419020 -1.338263 -1.684740
C 1.068642 -0.471256 0.347450
C 2.005895 0.224773 1.118480
C 1.388726 -0.854424 -0.958418
C 3.255085 0.544628 0.586989
C 2.636492 -0.538554 -1.497956
C 3.579505 0.162762 -0.726805
C 4.910627 0.512727 -1.303476
H -0.704539 2.061076 0.161601
H -3.341229 -1.068478 0.261355
H -2.293617 2.375825 -1.557506
H -3.372316 2.859059 -0.241863
H -4.562819 0.811864 -0.310000
H -3.933706 0.731680 -1.957558
H -1.403902 1.474577 2.566321
H -2.128272 2.986476 1.995084
H -3.087226 1.501955 2.071260
H -3.316875 -1.700351 -2.195131
H -1.804310 -0.805638 -2.417009
H -1.856566 -2.227758 -1.353414
H 1.759294 0.514881 2.147688
H 0.662869 -1.407961 -1.562565
H 3.979295 1.085627 1.192425
H 2.879312 -0.839824 -2.514638
H 4.872829 1.494289 -1.801202
H 5.698015 0.570543 -0.538887
H 5.248467 -0.215367 -2.054153


%chk=000180214-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000180214

0 1
S -0.495930 -1.037997 0.883285
O -0.804033 -2.551052 0.361835
O -0.510814 -0.756749 2.498743
N -1.577212 0.058512 -0.151552
C -1.609198 1.527301 0.186929
C -2.973465 -0.477325 -0.432125
C -2.742685 1.961273 -0.778874
C -3.800933 0.833077 -0.624660
C -1.919335 1.912389 1.654977
C -2.955570 -1.378442 -1.680636
C 1.193970 -0.474090 0.260347
C 2.052296 0.159062 1.169989
C 1.552741 -0.763609 -1.067027
C 3.336451 0.536772 0.712702
C 2.838673 -0.377430 -1.499139
C 3.746155 0.276710 -0.620154
C 5.131367 0.668094 -1.102363
H -0.635627 1.960741 -0.109258
H -3.350908 -1.059912 0.431448
H -2.360383 1.994849 -1.814290
H -3.137298 2.957817 -0.516549
H -4.440384 1.024196 0.254980
H -4.456182 0.756556 -1.508569
H -1.170980 1.502830 2.352099
H -1.922008 3.014923 1.741873
H -2.907831 1.536865 1.973826
H -3.974265 -1.755730 -1.890310
H -2.602456 -0.809588 -2.560101
H -2.287357 -2.239571 -1.517875
H 1.726581 0.331733 2.201139
H 0.852703 -1.274602 -1.734870
H 4.027341 1.033602 1.403107
H 3.145107 -0.589233 -2.530342
H 5.080082 1.267871 -2.029572
H 5.674333 1.258331 -0.345180
H 5.739557 -0.227972 -1.328932


