%chk=000216219.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000216219

0 1
S -3.735956 -2.529967 0.859230
S -1.076443 -3.888784 1.056072
N -1.530362 -1.268238 0.492776
N -0.249601 -0.807457 0.276813
C -2.589736 -0.300762 0.299845
C -2.299211 1.105664 -0.029909
C 2.125707 -0.798117 0.386625
C -3.822486 -0.839116 0.472304
C -2.761190 2.115641 0.829894
C -1.599253 1.440055 -1.199352
C 4.652655 0.302246 -0.174439
C -1.972000 -2.550391 0.803463
C 3.283526 -1.593858 0.480223
C 2.244243 0.550024 0.010161
C 0.821992 -1.419718 0.698944
C 4.533976 -1.048570 0.200418
C 3.498957 1.095365 -0.266315
C -2.526031 3.455584 0.513116
C -1.371404 2.783564 -1.509032
C -1.834120 3.790488 -0.655887
C 5.999959 0.874216 -0.469380
H -4.770452 -0.331542 0.383093
H -3.295187 1.854227 1.742830
H -1.226695 0.651519 -1.855343
H 3.203614 -2.643083 0.767503
H 1.349194 1.173239 -0.066051
H 0.882012 -2.363011 1.270773
H 5.424122 -1.670979 0.271986
H 3.578036 2.141844 -0.554643
H -2.881589 4.240319 1.179293
H -0.830666 3.044701 -2.417737
H -1.654488 4.836419 -0.900635
H 6.479277 0.351217 -1.310166
H 6.672521 0.780034 0.395874
H 5.963778 1.939329 -0.732946


%chk=000216219-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000216219

0 1
S -3.768959 -2.486509 1.231187
S -1.056097 -3.968262 1.204644
N -1.531580 -1.248863 0.585131
N -0.230068 -0.743835 0.399788
C -2.568490 -0.255676 0.463588
C -2.313026 1.138925 0.031547
C 2.158852 -0.868949 0.232783
C -3.806881 -0.750457 0.774918
C -2.958973 2.195908 0.728204
C -1.516130 1.452145 -1.103344
C 4.759152 0.275565 -0.133566
C -1.944656 -2.540454 0.966494
C 3.319964 -1.691041 0.212289
C 2.314771 0.536783 0.071047
C 0.846554 -1.505874 0.420820
C 4.596911 -1.125889 0.031375
C 3.595065 1.092129 -0.108792
C -2.815296 3.534202 0.301162
C -1.373321 2.789767 -1.526543
C -2.021095 3.836810 -0.827984
C 6.138469 0.878282 -0.328463
H -4.751454 -0.217027 0.710554
H -3.553721 1.966405 1.619496
H -1.015012 0.649696 -1.651373
H 3.214103 -2.775584 0.339356
H 1.423325 1.171883 0.096897
H 0.821218 -2.593351 0.569475
H 5.480613 -1.775468 0.018641
H 3.701687 2.177002 -0.228745
H -3.313811 4.337357 0.854871
H -0.759928 3.014622 -2.406015
H -1.905389 4.874755 -1.159098
H 6.622680 0.483260 -1.241606
H 6.805380 0.637119 0.520607
H 6.091841 1.976724 -0.419947


