%chk=000291234.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000291234

0 1
S -1.515868 2.187734 0.003199
O -0.740369 0.610730 0.001197
O -1.249806 2.811867 -1.253396
O -1.249034 2.809071 1.261017
O 7.170143 1.748429 0.000029
O 5.460463 3.074193 0.001896
O -7.536242 -0.416589 1.085079
O -7.536474 -0.415218 -1.080678
N 0.614084 0.845312 0.001039
N 5.968743 1.966902 0.000573
N -7.026416 -0.191545 0.002288
C 3.411391 -1.430354 -0.002412
C 2.302595 -2.401045 -0.003145
C 2.855321 -0.106047 -0.000751
C 1.068793 -1.671978 -0.001932
C 1.366435 -0.212361 -0.000384
C 3.667736 1.010651 0.000237
C 4.784527 -1.620473 -0.003067
C 2.301492 -3.784702 -0.004699
C -0.146435 -2.330455 -0.002282
C 5.065293 0.794020 -0.000452
C 5.619686 -0.490729 -0.002068
C 1.058605 -4.451792 -0.005050
C -0.138861 -3.741178 -0.003868
C -3.114679 1.500663 0.002933
C -3.748866 1.231305 1.218809
C -3.749402 1.233471 -1.213140
C -5.656826 0.406235 0.002519
C -5.033213 0.677657 1.226332
C -5.033750 0.679832 -1.221083
H 3.259838 2.029909 0.001510
H 5.215719 -2.620757 -0.004328
H 3.230092 -4.352069 -0.005635
H -1.084244 -1.774273 -0.001352
H 6.710568 -0.610148 -0.002549
H 1.043072 -5.542336 -0.006270
H -1.088672 -4.276689 -0.004163
H -3.249956 1.458245 2.170690
H -3.250920 1.462114 -2.164835
H -5.548959 0.458982 2.169101
H -5.549904 0.462816 -2.164012


%chk=000291234-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000291234

0 1
S -1.623704 2.365145 0.000265
O -0.657602 0.557760 -0.000266
O -1.361452 3.100773 -1.415651
O -1.358843 3.101068 1.415538
O 7.356003 1.722752 0.003255
O 5.546574 3.112994 0.004281
O -7.714190 -0.449502 1.147457
O -7.716282 -0.449762 -1.135110
N 0.712168 0.805672 -0.000063
N 6.080851 1.937091 0.002981
N -7.172801 -0.198071 0.005647
C 3.513208 -1.478842 -0.002064
C 2.398444 -2.446540 -0.003648
C 2.960942 -0.155484 -0.000716
C 1.161321 -1.718833 -0.003513
C 1.480628 -0.273603 -0.001258
C 3.779245 0.981666 0.000925
C 4.910861 -1.665087 -0.001768
C 2.395730 -3.854064 -0.005335
C -0.075736 -2.392640 -0.005151
C 5.177255 0.761797 0.001204
C 5.752281 -0.532606 -0.000109
C 1.150670 -4.530579 -0.006906
C -0.069809 -3.809576 -0.006789
C -3.329260 1.571228 0.001906
C -3.922494 1.297470 1.246007
C -3.924736 1.297086 -1.241038
C -5.816597 0.427577 0.004329
C -5.205405 0.711915 1.244653
C -5.207649 0.711540 -1.237183
H 3.376932 1.997329 0.002018
H 5.347106 -2.668727 -0.002799
H 3.331678 -4.422592 -0.005537
H -1.015378 -1.833962 -0.005029
H 6.841345 -0.624547 0.000197
H 1.128705 -5.625644 -0.008272
H -1.018713 -4.356311 -0.008019
H -3.409277 1.548800 2.179144
H -3.413198 1.548115 -2.175176
H -5.729598 0.474622 2.173671
H -5.733524 0.473975 -2.165180


