%chk=000234972.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000234972

0 1
S 1.888392 -0.170927 -0.010082
F 8.023965 -1.541989 -0.276555
O -5.053303 -1.018804 0.831783
N -3.104093 -0.171078 0.036158
N -1.162955 -1.394465 -0.153173
N -2.079896 2.096753 0.371763
N 0.364384 2.011044 0.334192
C -4.548073 0.138138 0.126211
C -5.182407 0.262563 -1.267048
C -6.709164 0.297242 -1.137777
C -7.206076 -0.922179 -0.352042
C -6.491103 -1.018627 0.995472
C -2.051918 0.739898 0.173998
C -2.499182 -1.457670 -0.148625
C -0.837361 -0.042241 0.042764
C 0.374258 0.674660 0.135197
C -0.850415 2.661873 0.444129
C 3.140239 1.143484 0.175109
C 4.439905 0.424761 0.054176
C 5.047836 0.274902 -1.204794
C 5.060074 -0.106994 1.198686
C 6.267831 -0.392463 -1.329371
C 6.280085 -0.778259 1.098142
C 6.856432 -0.904092 -0.169231
H -4.700905 1.049482 0.757652
H -4.876714 -0.588134 -1.908906
H -4.807787 1.174117 -1.772761
H -7.170315 0.315976 -2.144315
H -7.031687 1.233230 -0.640794
H -8.300389 -0.867758 -0.199833
H -7.023893 -1.845004 -0.938998
H -6.762679 -0.193030 1.676427
H -6.650430 -1.991033 1.498323
H -3.110901 -2.348039 -0.250743
H -0.801903 3.751119 0.606258
H 3.016217 1.663912 1.146772
H 2.998674 1.926895 -0.597041
H 4.563624 0.679049 -2.094886
H 4.585194 0.000553 2.175024
H 6.741236 -0.510795 -2.302868
H 6.762803 -1.191970 1.982305


%chk=000234972-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000234972

0 1
S 1.888605 -0.509804 -0.084817
F 8.474476 -1.039522 -0.311448
O -5.182286 -0.944673 0.894215
N -3.160442 -0.326513 -0.105567
N -1.267675 -1.605070 -0.360338
N -2.109592 1.860905 0.401523
N 0.338623 1.723200 0.403442
C -4.574763 0.037635 -0.016651
C -5.284470 0.035781 -1.387128
C -6.791613 0.333478 -1.196630
C -7.414231 -0.657171 -0.184192
C -6.612825 -0.641741 1.129926
C -2.080114 0.533140 0.107144
C -2.612797 -1.591464 -0.375809
C -0.911666 -0.276565 -0.062424
C 0.330515 0.390747 0.101985
C -0.856563 2.382738 0.537339
C 3.126763 0.918479 0.268946
C 4.533238 0.397002 0.115399
C 5.179913 0.424853 -1.148322
C 5.235282 -0.129661 1.231297
C 6.498943 -0.053221 -1.302958
C 6.555245 -0.613386 1.100746
C 7.155291 -0.562046 -0.168943
H -4.612863 1.054208 0.431474
H -5.151209 -0.956773 -1.859089
H -4.809427 0.789152 -2.042291
H -7.313337 0.277904 -2.169002
H -6.918595 1.370852 -0.824295
H -8.468467 -0.393433 0.025967
H -7.403291 -1.681054 -0.604471
H -6.696411 0.351793 1.623404
H -6.946237 -1.420413 1.834434
H -3.241600 -2.462087 -0.541135
H -0.792620 3.446991 0.780077
H 2.905203 1.273485 1.286228
H 2.879740 1.720079 -0.442537
H 4.646096 0.822355 -2.018709
H 4.745158 -0.162191 2.210775
H 7.009677 -0.035235 -2.269877
H 7.107924 -1.018655 1.953011


