%chk=000290475.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000290475

0 1
S 5.105005 -0.850657 0.702935
O -1.375647 0.032629 -1.265855
O 4.967200 1.243374 -1.782264
O 7.140324 0.780186 -1.508044
N -3.104829 -0.513190 0.160493
N -0.847788 -0.699370 0.885798
C -4.136466 0.017955 -0.784353
C -4.415634 1.514152 -0.534325
C -5.413671 -0.833392 -0.646284
C -5.183159 1.768242 0.767228
C -6.187861 -0.555824 0.648046
C -6.474091 0.941017 0.824962
C -1.746311 -0.341441 -0.166307
C 0.573502 -0.701846 0.781415
C 1.296460 -1.151146 1.911158
C 1.254617 -0.263248 -0.370450
C 2.690059 -1.152252 1.878857
C 2.646850 -0.281240 -0.392861
C 3.357577 -0.724243 0.727551
C 5.655779 0.857223 0.436590
C 6.059649 0.933803 -0.994786
H -3.721809 -0.101527 -1.825385
H -4.994414 1.911357 -1.391825
H -3.462831 2.079008 -0.534544
H -5.158120 -1.909420 -0.711376
H -6.063659 -0.624526 -1.519576
H -4.543588 1.534377 1.638666
H -5.423264 2.845751 0.852565
H -5.623751 -0.938118 1.519279
H -7.139976 -1.121107 0.637603
H -7.172072 1.283486 0.036254
H -6.992691 1.115598 1.786102
H -3.403694 -0.590067 1.128657
H -1.230112 -1.085533 1.750554
H 0.780609 -1.492680 2.804195
H 0.694869 0.083696 -1.247772
H 3.249362 -1.491161 2.753658
H 3.179691 0.061727 -1.287852
H 4.867960 1.595107 0.693573
H 6.521500 1.058384 1.104616
H 5.193922 1.278216 -2.750395


%chk=000290475-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000290475

0 1
S 5.189108 -0.840051 0.853977
O -1.459153 0.233158 -1.340596
O 5.286870 1.156107 -1.914983
O 7.500846 1.054619 -1.217156
N -3.148437 -0.481663 0.099416
N -0.909473 -0.801602 0.718307
C -4.235275 -0.036473 -0.804340
C -4.517492 1.485259 -0.662106
C -5.515097 -0.863224 -0.527575
C -5.160391 1.834909 0.700027
C -6.171393 -0.510000 0.832246
C -6.447541 1.009379 0.943699
C -1.812838 -0.308737 -0.248699
C 0.508382 -0.757172 0.687871
C 1.203861 -1.309996 1.798914
C 1.253549 -0.194117 -0.385355
C 2.611121 -1.294076 1.846840
C 2.662859 -0.203622 -0.341583
C 3.348015 -0.743260 0.771747
C 5.692138 0.962797 0.455082
C 6.284596 1.061908 -0.930424
H -3.877026 -0.229893 -1.832042
H -5.203500 1.784027 -1.481092
H -3.573109 2.038447 -0.813005
H -5.284151 -1.944351 -0.586366
H -6.239574 -0.642661 -1.335765
H -4.432699 1.633906 1.513442
H -5.387114 2.917218 0.742479
H -5.516323 -0.823500 1.674525
H -7.110748 -1.083111 0.950504
H -7.208406 1.292943 0.187239
H -6.877457 1.248084 1.935615
H -3.411050 -0.863118 1.009213
H -1.308681 -1.260120 1.540059
H 0.643516 -1.742596 2.638221
H 0.720797 0.224488 -1.240817
H 3.133471 -1.701118 2.718698
H 3.229763 0.212421 -1.180861
H 4.789508 1.581803 0.558903
H 6.453616 1.243671 1.195995
H 5.714410 1.172620 -2.813752


