%chk=000184147.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000184147

0 1
O -0.134808 1.131985 -2.003064
N -2.271664 1.094589 0.651259
C 0.542516 0.006254 -1.402039
C -0.378087 -1.113068 -0.969226
C -1.245800 0.104982 1.122206
C -1.214090 -1.062898 0.160835
C -1.679098 2.068981 -0.320383
C -1.512563 1.400034 -1.690715
C 1.513001 0.488438 -0.339302
C -0.397269 -2.258554 -1.786195
C -2.064771 -2.149773 0.436209
C -2.866202 1.820247 1.814729
C -1.231312 -3.337146 -1.495858
C -2.074601 -3.278761 -0.380987
C 2.123596 -0.431589 0.526448
C 1.866525 1.843021 -0.273593
C 3.065093 0.007234 1.460825
C 2.806322 2.278267 0.664088
C 3.405955 1.362018 1.533954
H 1.165673 -0.319022 -2.284641
H -1.519951 -0.264196 2.136845
H -0.234276 0.553227 1.244215
H -0.702636 2.487775 0.009133
H -2.372670 2.932054 -0.422870
H -2.121332 0.483343 -1.791825
H -1.762824 2.098842 -2.513511
H 0.245803 -2.303697 -2.665931
H -2.735298 -2.099187 1.293616
H -2.154262 2.413185 2.406727
H -3.353768 1.090561 2.481320
H -3.659451 2.492374 1.448597
H -1.231520 -4.216274 -2.136603
H -2.738717 -4.111184 -0.154650
H 1.861652 -1.487907 0.473229
H 1.402789 2.547820 -0.968077
H 3.536115 -0.708734 2.131981
H 3.076031 3.331658 0.712400
H 4.139500 1.700801 2.262254


%chk=000184147-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000184147

0 1
O -0.156874 1.561874 -1.163977
N -2.763426 1.163871 0.518593
C 0.539357 0.262069 -1.165508
C -0.339154 -0.920748 -0.748114
C -1.587765 0.432544 1.091843
C -1.285555 -0.850039 0.313379
C -2.445261 2.145884 -0.543026
C -1.545440 1.608220 -1.663023
C 1.790358 0.443754 -0.285197
C -0.186787 -2.134557 -1.465972
C -2.028296 -2.014118 0.635050
C -3.631610 1.767426 1.549674
C -0.926073 -3.288029 -1.128885
C -1.853820 -3.227107 -0.064425
C 2.508769 -0.683233 0.187819
C 2.275142 1.741936 0.013940
C 3.689680 -0.516200 0.945383
C 3.454469 1.907486 0.774722
C 4.168630 0.780445 1.242372
H 0.887993 0.057879 -2.204357
H -1.861153 0.146610 2.124357
H -0.689994 1.081908 1.156828
H -1.940373 3.058858 -0.131634
H -3.404712 2.477274 -0.990378
H -1.893262 0.617072 -2.007025
H -1.560668 2.313906 -2.515862
H 0.521751 -2.170556 -2.303692
H -2.765447 -1.957484 1.445261
H -3.146313 2.602428 2.116623
H -3.944928 0.996585 2.275879
H -4.543479 2.172858 1.073069
H -0.786343 -4.216877 -1.692802
H -2.440540 -4.110954 0.209989
H 2.138771 -1.692767 -0.021921
H 1.715494 2.608059 -0.347998
H 4.230821 -1.397888 1.307634
H 3.816202 2.917306 1.000914
H 5.083435 0.910004 1.831867


