%chk=000233085.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000233085

0 1
S 0.808816 -1.985985 0.331903
O -3.260235 1.679577 0.740816
O 0.224491 -2.535691 -0.882789
O 0.883860 -2.782255 1.538967
N -0.107982 -0.602024 0.767734
C -0.955298 0.093206 -0.239126
C -0.894911 1.575491 0.066937
C -2.382065 -0.414456 -0.214408
C -2.014568 2.269839 0.545729
C -3.429027 0.372129 0.282791
C 0.300107 2.294508 -0.087597
C -2.702176 -1.698587 -0.683447
C 2.358243 -1.338801 -0.052837
C -1.981199 3.635594 0.871435
C -4.756324 -0.078439 0.358055
C 0.357790 3.653495 0.225469
C -4.014261 -2.168994 -0.624905
C -0.779352 4.319596 0.706511
C -5.036008 -1.364324 -0.099127
C 3.245782 -0.983273 0.968748
C 2.736053 -1.177999 -1.391121
C 4.878831 -0.285249 -0.685114
C 4.499615 -0.456710 0.657733
C 3.987251 -0.652100 -1.709422
C 6.224339 0.263109 -1.021680
H -0.525746 -0.090199 -1.265243
H -0.508055 -0.563210 1.714466
H 1.191779 1.777322 -0.444837
H -1.906148 -2.337173 -1.095408
H -2.878895 4.126377 1.240406
H -5.528799 0.571832 0.760927
H 1.289884 4.199841 0.100171
H -4.245497 -3.169001 -0.987628
H -0.723330 5.380183 0.951908
H -6.056482 -1.744697 -0.051665
H 2.962866 -1.124525 2.017556
H 2.049493 -1.475609 -2.193259
H 5.185946 -0.183888 1.457345
H 4.276001 -0.532270 -2.752012
H 6.231885 0.809345 -1.975300
H 6.603523 0.952881 -0.254620
H 6.962403 -0.550264 -1.113160


%chk=000233085-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000233085

0 1
S 0.792899 -1.721145 -0.323157
O -3.374812 1.663183 1.038315
O 0.322460 -1.854108 -1.886005
O 0.594735 -2.935158 0.748474
N -0.032769 -0.159182 0.355605
C -1.205680 0.327460 -0.478469
C -1.267429 1.832940 -0.259077
C -2.524275 -0.353792 -0.133273
C -2.310069 2.417313 0.500233
C -3.507737 0.312653 0.639112
C -0.260701 2.688145 -0.770705
C -2.788034 -1.689694 -0.531097
C 2.613661 -1.247906 -0.327707
C -2.349886 3.804678 0.764018
C -4.698116 -0.327434 1.045819
C -0.287793 4.075284 -0.529314
C -3.975040 -2.342247 -0.143131
C -1.335391 4.632544 0.248242
C -4.927218 -1.661198 0.656457
C 3.381489 -1.572632 0.801444
C 3.137351 -0.618392 -1.466581
C 5.332888 -0.582112 -0.339548
C 4.750531 -1.229279 0.783337
C 4.510635 -0.287267 -1.459063
C 6.812411 -0.244586 -0.351745
H -0.923519 0.096279 -1.523439
H -0.329022 -0.432263 1.316480
H 0.561431 2.243738 -1.343245
H -2.045418 -2.211811 -1.146216
H -3.176026 4.205431 1.358676
H -5.422062 0.232224 1.645456
H 0.499488 4.719374 -0.934102
H -4.156572 -3.375271 -0.456158
H -1.361420 5.709406 0.446526
H -5.848602 -2.165478 0.966893
H 2.928997 -2.094289 1.650859
H 2.500903 -0.419578 -2.334774
H 5.374616 -1.469863 1.651747
H 4.948182 0.202920 -2.336113
H 7.050071 0.516937 -1.113747
H 7.148650 0.135122 0.629301
H 7.418795 -1.142343 -0.579424


