%chk=000207944.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000207944

0 1
N -0.408905 0.961396 1.366761
C -0.271561 0.871835 -0.111854
C 2.268412 1.486254 -0.099118
C 0.839883 1.826241 -0.603085
C 0.082358 -0.577619 -0.510962
C 2.521130 -0.017284 -0.026364
C 1.496290 -0.965490 -0.185322
C -1.605127 1.296144 -0.829772
C 3.266109 2.125869 -1.093657
C 2.494506 2.083206 1.302515
C 3.824055 -0.471671 0.245249
C -2.795694 0.488678 -0.404111
C 1.786951 -2.337854 -0.076106
C 4.109418 -1.832904 0.349108
C 3.084943 -2.771497 0.188583
C -3.151358 -0.677257 -1.101741
C -3.571417 0.896775 0.693305
C -4.259314 -1.426969 -0.699609
C -4.678355 0.142486 1.091585
C -5.024211 -1.021612 0.398929
H 0.601377 2.866967 -0.317174
H 0.840228 1.810811 -1.711002
H -0.069670 -0.707076 -1.603765
H -0.628971 -1.281636 -0.029607
H -1.467133 1.224401 -1.926610
H -1.789141 2.372701 -0.643870
H 3.219166 1.640812 -2.073835
H 3.063767 3.191875 -1.231848
H 4.298787 2.039361 -0.739926
H 3.524635 1.946589 1.642816
H 2.272506 3.152096 1.330454
H 1.842689 1.586258 2.037684
H -1.053200 0.263015 1.726671
H -0.745349 1.872989 1.656257
H 4.627993 0.251420 0.380387
H 0.990724 -3.069528 -0.195148
H 5.123954 -2.162929 0.557957
H 3.299454 -3.834345 0.272575
H -2.565693 -0.998393 -1.960580
H -3.319748 1.807095 1.232255
H -4.528745 -2.330354 -1.245073
H -5.274630 0.464866 1.944042
H -5.885712 -1.607721 0.710810


%chk=000207944-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000207944

0 1
N -0.368404 0.936660 1.383960
C -0.279003 0.871603 -0.091439
C 2.298034 1.499070 -0.115827
C 0.847078 1.810007 -0.599606
C 0.081087 -0.574736 -0.502962
C 2.550318 -0.020659 -0.012503
C 1.506876 -0.977852 -0.155090
C -1.626535 1.322493 -0.800451
C 3.267882 2.141135 -1.154367
C 2.563504 2.149383 1.277042
C 3.860357 -0.490022 0.272542
C -2.847201 0.505834 -0.418014
C 1.801255 -2.357783 -0.008459
C 4.147873 -1.863561 0.407084
C 3.107486 -2.810338 0.266494
C -3.246615 -0.621089 -1.185788
C -3.610029 0.829609 0.736788
C -4.362336 -1.402462 -0.811630
C -4.726706 0.050050 1.117445
C -5.105300 -1.072354 0.346041
H 0.605625 2.860297 -0.332565
H 0.827710 1.758869 -1.707534
H -0.063854 -0.662044 -1.600424
H -0.631807 -1.287387 -0.045328
H -1.473627 1.283680 -1.897040
H -1.785856 2.386748 -0.532535
H 3.173988 1.653455 -2.142275
H 3.036983 3.217060 -1.274985
H 4.322117 2.061275 -0.834565
H 3.610445 1.989820 1.593623
H 2.387666 3.242100 1.230381
H 1.895252 1.704975 2.032259
H -1.040460 0.269101 1.780580
H -0.525169 1.885689 1.743910
H 4.676225 0.231977 0.394695
H 0.985825 -3.085698 -0.110170
H 5.170539 -2.191837 0.624987
H 3.311135 -3.881587 0.375380
H -2.682277 -0.881974 -2.089988
H -3.342394 1.715150 1.326071
H -4.655179 -2.263583 -1.423176
H -5.304086 0.322087 2.008664
H -5.973020 -1.675158 0.636579


