%chk=000219554.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000219554

0 1
S 4.960489 -0.285167 0.432446
N -0.860160 -1.384301 0.040198
N 5.402541 2.238557 -0.822392
C -1.821152 -0.954575 1.086632
C -1.458827 -2.086536 -1.126488
C 0.496329 -1.103225 0.119600
C -2.610783 0.262641 0.657633
C -1.422713 -3.602684 -0.943833
C 1.029557 -0.390218 1.233210
C 1.387383 -1.528074 -0.909366
C -1.950260 1.451221 0.314954
C -4.010942 0.207009 0.618852
C 2.386873 -0.117819 1.305404
C 2.741273 -1.243608 -0.821420
C 3.246790 -0.545419 0.284524
C -2.687964 2.576286 -0.061758
C -4.744592 1.336888 0.244660
C -4.085450 2.521874 -0.096181
C 5.188106 1.220163 -0.322296
H -1.281057 -0.729200 2.040576
H -2.496446 -1.811113 1.320716
H -2.508200 -1.734400 -1.258961
H -0.917292 -1.794517 -2.056913
H -0.398099 -3.969894 -0.796883
H -2.002355 -3.924588 -0.070866
H -1.834266 -4.114701 -1.821313
H 0.370963 -0.057872 2.033475
H 1.010205 -2.073551 -1.770344
H -0.860569 1.496339 0.335489
H -4.533029 -0.710875 0.881191
H 2.783038 0.432772 2.162845
H 3.414491 -1.568205 -1.619443
H -2.171927 3.497950 -0.328905
H -5.832314 1.292390 0.218284
H -4.658041 3.400452 -0.388031


%chk=000219554-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000219554

0 1
S 4.967480 -0.107509 0.912598
N -0.895978 -1.442866 -0.179628
N 5.459221 2.272892 -0.769553
C -1.953625 -1.118429 0.788647
C -1.322255 -2.175123 -1.391288
C 0.445708 -1.129165 0.061535
C -2.671009 0.219879 0.561801
C -1.297095 -3.713425 -1.233158
C 0.821478 -0.253404 1.133477
C 1.494906 -1.661367 -0.758265
C -2.153186 1.203876 -0.313333
C -3.879490 0.484735 1.256002
C 2.170379 0.061375 1.374978
C 2.841349 -1.334655 -0.517298
C 3.181581 -0.475867 0.549581
C -2.828330 2.434115 -0.489121
C -4.553969 1.713107 1.083929
C -4.029212 2.693824 0.208958
C 5.227578 1.306866 -0.097351
H -1.530785 -1.145560 1.811616
H -2.705108 -1.932101 0.758680
H -2.349158 -1.843739 -1.634327
H -0.691539 -1.865725 -2.244802
H -0.279277 -4.079186 -1.012204
H -1.958014 -4.036473 -0.408353
H -1.648089 -4.201475 -2.161059
H 0.058144 0.219086 1.757762
H 1.266501 -2.346403 -1.578613
H -1.223218 1.005083 -0.856876
H -4.296033 -0.273039 1.932868
H 2.430986 0.740669 2.192883
H 3.625097 -1.755242 -1.155575
H -2.414471 3.187992 -1.168119
H -5.487025 1.904238 1.625991
H -4.551947 3.647015 0.072910


