%chk=000213683.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000213683

0 1
S 3.284943 -1.727704 -0.616184
S 3.757148 1.193458 -0.459189
N -1.253600 0.403008 0.313104
N 1.594992 -0.011962 0.525104
C -0.633982 -0.897898 -0.104772
C -0.296370 1.533445 0.071473
C 0.639977 -1.138736 0.730698
C 0.984977 1.301273 0.895731
C -2.544634 0.638294 -0.415572
C 2.763413 -0.094598 -0.130096
C -3.594067 -0.306979 0.106385
C -4.567166 -0.803801 -0.653061
H -0.395689 -0.943476 -1.189896
H -1.364947 -1.712287 0.099646
H -0.777283 2.476307 0.414606
H -0.037476 1.671085 -1.001503
H 0.382597 -1.173112 1.818011
H 1.079282 -2.127891 0.483623
H 1.700730 2.143214 0.738592
H 0.750277 1.274340 1.985572
H -2.882418 1.681329 -0.201206
H -2.441657 0.564730 -1.520889
H -3.508733 -0.536968 1.171953
H -5.337165 -1.458790 -0.270275
H -4.680484 -0.598134 -1.707244
H 4.498236 -1.391447 -1.128211


%chk=000213683-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000213683

0 1
S 3.362436 -1.855354 -0.482771
S 3.947244 1.184441 -0.283768
N -1.275292 0.444448 0.270642
N 1.573302 -0.009225 0.414540
C -0.691367 -0.842284 -0.175037
C -0.317774 1.555433 0.050119
C 0.615134 -1.130476 0.591384
C 0.991278 1.297411 0.818020
C -2.611405 0.711949 -0.323326
C 2.851755 -0.109964 -0.063332
C -3.660189 -0.260894 0.175210
C -4.529609 -0.935036 -0.617629
H -0.475755 -0.842198 -1.273934
H -1.414856 -1.652286 0.025979
H -0.766475 2.494353 0.423794
H -0.079295 1.695823 -1.034119
H 0.392310 -1.231638 1.671232
H 1.056169 -2.073742 0.234631
H 1.736736 2.082085 0.613537
H 0.783500 1.262019 1.905093
H -2.899661 1.737662 -0.014180
H -2.588792 0.703021 -1.442203
H -3.697369 -0.381878 1.267817
H -5.293851 -1.598296 -0.197652
H -4.506278 -0.836338 -1.710514
H 4.619005 -1.452337 -0.887133


