%chk=000112047.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000112047

0 1
O 1.753586 -1.818427 0.402779
N 2.020582 0.465962 0.365162
C -0.082184 1.128580 -0.593099
C 0.191500 -0.375217 -0.883856
C -1.124581 1.380549 0.508203
C -0.991563 -1.332992 -0.740013
C 1.310225 1.668735 -0.138264
C -2.351465 0.475057 0.366244
C -1.923591 -0.995111 0.426341
C 1.367153 -0.728707 0.035963
H -0.409696 1.631133 -1.527490
H 0.574977 -0.464802 -1.933858
H -1.431460 2.442898 0.490889
H -0.668171 1.209114 1.504967
H -0.601083 -2.367366 -0.616896
H -1.569752 -1.332914 -1.685225
H 1.867349 2.110519 -0.990917
H 1.230866 2.448474 0.643068
H -2.876255 0.682284 -0.585515
H -3.077822 0.695368 1.170894
H -1.414154 -1.204649 1.387990
H -2.810088 -1.656037 0.402311
H 2.796528 0.540450 1.001424


%chk=000112047-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000112047

0 1
O 1.673544 -1.823071 0.569640
N 1.936746 0.522928 0.445823
C -0.084664 1.144784 -0.615660
C 0.202929 -0.366722 -0.876058
C -1.099134 1.362540 0.538230
C -1.000320 -1.328381 -0.797575
C 1.323816 1.690288 -0.219082
C -2.347758 0.460271 0.414693
C -1.932740 -1.028963 0.398031
C 1.333701 -0.688494 0.132185
H -0.455601 1.640414 -1.531692
H 0.667489 -0.469903 -1.880876
H -1.388108 2.431457 0.568685
H -0.598566 1.137144 1.502680
H -0.610044 -2.361609 -0.730949
H -1.582702 -1.252510 -1.737604
H 1.907128 1.999998 -1.110515
H 1.253204 2.554167 0.467522
H -2.898885 0.702090 -0.518300
H -3.038433 0.659995 1.256285
H -1.413327 -1.276784 1.345390
H -2.825999 -1.680089 0.342436
H 2.758625 0.573350 1.047815


