%chk=000215778.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000215778

0 1
O 0.268228 -1.157670 1.342697
N -0.756867 2.867504 -0.823360
C 0.535396 0.979708 0.142280
C 0.780503 -0.565327 0.139527
C 1.895899 1.628765 -0.228941
C -0.599540 1.384379 -0.823936
C 2.281328 -0.720134 0.146934
C 2.907794 0.528022 -0.088333
C -1.890745 0.661215 -0.466457
C 3.028583 -1.872106 0.334765
C 4.291431 0.617981 -0.157474
C 4.430399 -1.778237 0.268968
C 5.049769 -0.552448 0.022401
C -2.498130 -0.183737 -1.405451
C -2.491003 0.830679 0.789326
C -3.684691 -0.850742 -1.095633
C -3.676847 0.165521 1.103243
C -4.285359 -0.681023 0.162072
C -5.546057 -1.405642 0.501621
H 0.272362 1.276601 1.184982
H 0.313620 -1.077196 -0.728399
H 2.119096 2.488022 0.427795
H 1.884238 2.040857 -1.257070
H -0.293462 1.106252 -1.871268
H 2.541562 -2.823226 0.540933
H 4.783194 1.568959 -0.340439
H -0.931689 3.219927 0.112915
H -1.552434 3.139042 -1.395796
H -0.711936 -1.108930 1.344771
H 5.033145 -2.671854 0.415836
H 6.136015 -0.495515 -0.027899
H -2.045617 -0.324581 -2.386997
H -2.031234 1.483177 1.531319
H -4.144602 -1.505237 -1.834039
H -4.131225 0.304871 2.082718
H -6.164626 -0.854748 1.223014
H -6.173562 -1.590054 -0.380868
H -5.322832 -2.385975 0.949847


%chk=000215778-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000215778

0 1
O 0.176926 -1.284194 1.115507
N -0.766138 2.901227 -0.717736
C 0.594000 0.975421 0.003166
C 0.831212 -0.572710 0.007996
C 1.937884 1.596781 -0.497511
C -0.636906 1.424772 -0.820644
C 2.338071 -0.701996 0.134653
C 2.970819 0.530021 -0.161439
C -1.922664 0.663385 -0.447388
C 3.086408 -1.843719 0.477263
C 4.376692 0.629966 -0.123845
C 4.498440 -1.742490 0.520105
C 5.138371 -0.514758 0.218174
C -2.636549 -0.068415 -1.428582
C -2.455903 0.700799 0.869909
C -3.842464 -0.735118 -1.112203
C -3.657856 0.031993 1.186162
C -4.373822 -0.701041 0.201651
C -5.651839 -1.442779 0.553080
H 0.450881 1.258513 1.067983
H 0.484488 -1.007802 -0.959131
H 2.151939 2.574456 -0.033257
H 1.887518 1.777927 -1.590241
H -0.418220 1.198431 -1.885011
H 2.578288 -2.780704 0.727478
H 4.876990 1.580041 -0.345967
H -0.814315 3.230119 0.254755
H -1.545323 3.278427 -1.270323
H -0.805660 -1.205391 0.998126
H 5.101432 -2.615925 0.793663
H 6.231969 -0.449217 0.258099
H -2.247527 -0.110830 -2.454277
H -1.931623 1.260280 1.654778
H -4.376573 -1.289290 -1.893978
H -4.047951 0.075558 2.210745
H -6.203226 -0.937662 1.365650
H -6.325049 -1.524390 -0.318309
H -5.432615 -2.472585 0.896505


