%chk=000273736.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000273736

0 1
S 0.230697 -2.074086 2.081671
O 1.904578 2.734187 -1.545126
O -0.567941 -1.186251 2.880336
O 1.118581 -3.022649 2.725856
N 2.078335 0.877032 -0.134198
N -0.139537 0.201498 -0.013095
N 1.438172 -1.101300 1.235105
C 3.540815 0.880042 0.157857
C 3.920601 2.172238 0.908384
C 4.333491 0.750660 -1.158142
C 5.426732 2.188053 1.196004
C 5.838879 0.768209 -0.866722
C 6.242771 2.032528 -0.095037
C 1.381896 1.827455 -0.949467
C -0.112607 1.409651 -0.882790
C 1.097508 -0.046343 0.400257
C -0.964383 2.552027 -0.308952
C -2.432439 2.238198 -0.417529
C -0.680376 -2.840120 0.865124
C -3.184355 2.731507 -1.493771
C -3.054657 1.449749 0.563453
C -0.311144 -4.123331 0.426668
C -1.800644 -2.212502 0.304306
C -4.549514 2.442971 -1.582287
C -4.418440 1.165150 0.469147
C -5.169051 1.661861 -0.602304
C -1.048326 -4.768927 -0.558646
C -2.544289 -2.857809 -0.686875
C -2.173838 -4.136136 -1.127369
C -2.956354 -4.836379 -2.186126
H 3.760351 -0.006215 0.811042
H 3.345616 2.259611 1.847933
H 3.642249 3.055990 0.295327
H 4.068279 1.589717 -1.837618
H 4.051918 -0.173935 -1.692703
H 5.697446 3.135894 1.699722
H 5.687236 1.381382 1.907689
H 6.400784 0.714082 -1.818867
H 6.126674 -0.132950 -0.292289
H 6.094432 2.922996 -0.737611
H 7.322375 2.001873 0.141886
H -0.474216 1.126607 -1.905281
H -0.694267 2.733663 0.754129
H -0.718401 3.494268 -0.844868
H 2.437599 -1.227804 1.452417
H -2.709605 3.340315 -2.260113
H -2.464617 1.053563 1.393298
H 0.559107 -4.621540 0.870933
H -2.099278 -1.206463 0.636374
H -5.130850 2.830412 -2.416853
H -4.898595 0.558006 1.234778
H -6.231926 1.442827 -0.670744
H -0.759700 -5.763374 -0.892898
H -3.408480 -2.354889 -1.119244
H -3.387856 -5.776184 -1.808680
H -2.322910 -5.097877 -3.047430
H -3.789924 -4.234557 -2.573960


%chk=000273736-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000273736

0 1
S 0.175657 -1.942282 1.826367
O 2.021449 3.137740 -1.389401
O -0.749195 -0.837171 2.563636
O 1.125253 -2.935524 2.695760
N 2.145909 1.036165 -0.264835
N -0.067167 0.332562 -0.348008
N 1.486434 -1.099795 0.751489
C 3.599087 1.010380 0.050559
C 3.982101 2.153196 1.026226
C 4.456046 1.043448 -1.240880
C 5.492688 2.101025 1.358358
C 5.963548 0.996753 -0.894462
C 6.355237 2.138021 0.074633
C 1.488144 2.086305 -0.949973
C 0.001364 1.668403 -0.995346
C 1.154915 0.056297 0.061276
C -0.900644 2.721114 -0.276999
C -2.377080 2.366215 -0.344048
C -0.836322 -2.969812 0.616467
C -3.216415 2.946416 -1.328830
C -2.937114 1.433016 0.568326
C -0.574268 -4.349748 0.599909
C -1.817530 -2.340557 -0.162276
C -4.586423 2.604103 -1.405995
C -4.306325 1.092674 0.495233
C -5.136122 1.675472 -0.492390
C -1.360234 -5.144967 -0.260409
C -2.587665 -3.167062 -1.011470
C -2.375299 -4.569675 -1.072755
C -3.219875 -5.446773 -1.978276
H 3.804278 0.044658 0.560200
H 3.376897 2.071949 1.949494
H 3.734063 3.119923 0.550326
H 4.225784 1.972501 -1.793786
H 4.178483 0.191207 -1.890244
H 5.753517 2.947418 2.021475
H 5.718659 1.172688 1.924245
H 6.557064 1.062625 -1.826006
H 6.210825 0.019692 -0.428199
H 6.212201 3.113077 -0.433748
H 7.428339 2.064074 0.335574
H -0.327412 1.586501 -2.049399
H -0.566131 2.792118 0.774628
H -0.703980 3.696518 -0.759554
H 2.403269 -1.217548 1.199071
H -2.797124 3.676408 -2.033219
H -2.295968 0.971829 1.329222
H 0.202081 -4.777781 1.241773
H -1.943362 -1.253667 -0.136656
H -5.223178 3.066322 -2.169178
H -4.725898 0.377260 1.212116
H -6.199530 1.414665 -0.544200
H -1.184032 -6.226161 -0.298416
H -3.360078 -2.706920 -1.637478
H -3.897368 -6.090510 -1.385563
H -2.589958 -6.116776 -2.591192
H -3.842995 -4.845406 -2.661069


