%chk=000296237.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000296237

0 1
S 4.452570 -0.714760 1.349447
F -4.492654 1.977508 0.002521
O 1.876844 -0.077027 0.773583
O 0.701668 2.901183 1.365129
O 1.787040 2.153215 -1.847944
N -0.368005 -0.364319 0.255276
N -1.231855 -2.268941 -0.704939
N -2.436339 1.053793 0.217624
N -4.370385 -0.149002 -0.761239
N -4.230058 -2.361926 -1.571015
C 0.631892 1.948760 0.309057
C 1.980933 2.023547 -0.449029
C 0.601523 0.529667 0.947942
C 2.735518 0.711879 -0.115884
C 4.011389 0.913401 0.677125
C -1.711213 -0.096242 -0.010600
C -0.134360 -1.714919 -0.184032
C -2.239069 -1.292015 -0.614352
C 5.711105 -1.305363 0.161737
C -3.618080 -1.289455 -0.989013
C -3.729687 0.915684 -0.185967
C 6.090977 -2.698104 0.618132
H -0.233582 2.170761 -0.354398
H 2.542094 2.951751 -0.185448
H 0.401165 0.532389 2.047808
H 2.883079 0.082865 -1.020794
H 3.851519 1.588639 1.545519
H 4.817170 1.359413 0.070175
H -0.208359 3.214481 1.591959
H 1.238426 1.423031 -2.211478
H 0.845439 -2.169123 -0.070340
H 5.297515 -1.312583 -0.862250
H 6.583435 -0.626835 0.164471
H 6.509499 -2.703183 1.635022
H 5.233209 -3.385734 0.617793
H 6.852510 -3.134438 -0.043030
H -3.715510 -3.216157 -1.731921
H -5.210463 -2.331742 -1.810245


%chk=000296237-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000296237

0 1
S 4.378938 -1.051497 1.641746
F -4.007572 2.502053 0.747300
O 1.814173 -0.637374 -0.391426
O 0.346462 2.543109 0.470843
O 2.414266 1.882632 -2.332846
N -0.553665 -0.637831 -0.249676
N -1.992697 -2.307126 -0.882774
N -2.198505 1.135674 0.319521
N -4.503853 0.380863 -0.015817
N -5.066618 -1.772317 -0.794820
C 0.737019 1.530329 -0.486370
C 2.233109 1.682641 -0.892181
C 0.661671 0.092344 0.126499
C 2.921942 0.373096 -0.397601
C 3.580955 0.526682 0.983164
C -1.835892 -0.117164 -0.108863
C -0.702601 -1.959846 -0.711251
C -2.713906 -1.160133 -0.503275
C 6.050356 -0.935317 0.743025
C -4.109846 -0.867444 -0.444979
C -3.544311 1.258651 0.323186
C 6.910847 -2.148245 1.125315
H 0.113923 1.572407 -1.404386
H 2.655339 2.588563 -0.432930
H 0.702611 0.175085 1.233376
H 3.650537 0.001822 -1.136762
H 2.856347 0.848420 1.750355
H 4.368272 1.300308 0.925744
H -0.640904 2.420283 0.620664
H 2.060514 1.091160 -2.815837
H 0.160343 -2.591608 -0.900125
H 5.862349 -0.911867 -0.344850
H 6.531639 0.010923 1.047530
H 7.091456 -2.182527 2.214312
H 6.423574 -3.093239 0.826712
H 7.891323 -2.093039 0.617467
H -4.792079 -2.700330 -1.111980
H -6.048614 -1.510042 -0.731609


