%chk=000198059.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000198059

1 1
N -2.772785 -0.128896 -0.248872
C -1.882496 0.181159 0.970130
C -2.457151 -1.500126 -0.802442
C -4.221471 -0.098141 0.192742
C -2.568060 0.904414 -1.333614
C -0.417197 0.176853 0.641863
C 0.222843 1.366635 0.256504
C 0.334094 -1.000908 0.780611
C 1.590534 1.371760 -0.009689
C 1.702085 -0.995905 0.509986
C 2.344850 0.188584 0.107209
C 3.790322 0.216408 -0.170092
C 4.433104 -0.724111 -0.862193
H -2.104552 -0.565207 1.771643
H -2.185159 1.172158 1.388633
H -2.586738 -2.289374 -0.039475
H -3.105940 -1.757569 -1.660014
H -1.407355 -1.559328 -1.157880
H -4.507249 0.891662 0.596483
H -4.912104 -0.315186 -0.644876
H -4.427015 -0.847020 0.980959
H -2.780377 1.926665 -0.970618
H -1.521004 0.900265 -1.702040
H -3.220740 0.719956 -2.206886
H -0.337498 2.298547 0.181286
H -0.137417 -1.923620 1.118827
H 2.084111 2.300665 -0.305686
H 2.285081 -1.912481 0.628746
H 4.318228 1.087922 0.233685
H 5.499051 -0.681564 -1.060769
H 3.959806 -1.597816 -1.290660


%chk=000198059-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000198059

1 1
N -2.857679 -0.117130 -0.258060
C -1.859490 0.130787 0.954335
C -2.577372 -1.465905 -0.909085
C -4.278725 -0.106071 0.297308
C -2.710104 0.986427 -1.298283
C -0.401049 0.143393 0.583757
C 0.254801 1.357696 0.245135
C 0.372640 -1.051197 0.630018
C 1.626317 1.368395 -0.068848
C 1.742193 -1.039366 0.316598
C 2.400720 0.172162 -0.048642
C 3.837179 0.248567 -0.382726
C 4.720718 -0.786528 -0.424378
H -2.098839 -0.675612 1.668929
H -2.187701 1.095223 1.378834
H -2.697765 -2.261235 -0.157520
H -3.292796 -1.618918 -1.731971
H -1.548729 -1.471848 -1.295967
H -4.476204 0.869205 0.768058
H -4.991604 -0.272446 -0.525044
H -4.381170 -0.906909 1.045571
H -2.930255 1.957178 -0.827937
H -1.680102 0.983570 -1.681621
H -3.420761 0.800020 -2.118472
H -0.301303 2.303744 0.250098
H -0.096710 -1.994028 0.939117
H 2.115804 2.316145 -0.320143
H 2.310065 -1.973271 0.372274
H 4.208906 1.255052 -0.619340
H 5.769953 -0.617403 -0.685024
H 4.440863 -1.823296 -0.203471


