%chk=000205896.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000205896

0 1
O 2.115894 -2.773325 -0.181498
N -0.711558 1.095805 -0.282258
C 2.981176 0.737721 0.276317
C 1.709420 1.360146 -0.373203
C 3.207790 -0.669400 -0.310319
C 4.189436 1.631956 -0.052626
C 2.801070 0.656316 1.799826
C 0.523667 0.429415 -0.292299
C 1.981666 -1.565927 -0.238949
C 0.672711 -0.917265 -0.269700
C -1.997716 0.495367 -0.086358
C -3.090878 1.040281 -0.791085
C -2.192127 -0.554691 0.827489
C -4.367418 0.517586 -0.581380
C -3.477209 -1.066760 1.016168
C -4.565814 -0.536392 0.316828
H 1.916009 1.581510 -1.441960
H 1.506166 2.337658 0.105440
H 4.052360 -1.172158 0.202436
H 3.519524 -0.606448 -1.372080
H 4.355680 1.722194 -1.130712
H 4.067204 2.642942 0.349248
H 5.110611 1.224898 0.381240
H 2.643123 1.641824 2.247515
H 1.941787 0.029943 2.071055
H 3.679946 0.215446 2.283677
H -0.169650 -1.608102 -0.285292
H -0.720841 2.084536 -0.531635
H -2.947282 1.851069 -1.500224
H -1.352387 -0.964229 1.389867
H -5.214969 0.932926 -1.126616
H -3.629534 -1.886193 1.719544
H -5.563157 -0.942148 0.470345


%chk=000205896-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000205896

0 1
O 2.274201 -2.877548 -0.148540
N -0.708570 0.959059 -0.269562
C 3.016776 0.767771 0.271956
C 1.708905 1.294330 -0.388615
C 3.289390 -0.660040 -0.277906
C 4.188049 1.707483 -0.106306
C 2.870036 0.732315 1.816288
C 0.535467 0.328769 -0.260113
C 2.089829 -1.615809 -0.190708
C 0.747354 -1.037629 -0.193510
C -2.019086 0.428869 -0.087083
C -3.098805 1.107357 -0.716621
C -2.293830 -0.689770 0.744031
C -4.425539 0.670874 -0.526806
C -3.625322 -1.124162 0.917588
C -4.697975 -0.454819 0.285338
H 1.904188 1.475158 -1.466881
H 1.443918 2.273840 0.059996
H 4.140099 -1.133327 0.245816
H 3.575370 -0.593384 -1.349326
H 4.324772 1.759636 -1.203360
H 4.014477 2.734820 0.267664
H 5.134801 1.345035 0.335040
H 2.666668 1.743710 2.216905
H 2.050603 0.064400 2.134900
H 3.803932 0.366232 2.281068
H -0.075027 -1.756539 -0.175663
H -0.684544 1.957469 -0.490484
H -2.893700 1.969100 -1.364440
H -1.486327 -1.193648 1.279939
H -5.245032 1.204216 -1.021000
H -3.823060 -1.987026 1.563114
H -5.727318 -0.800237 0.426082


