%chk=000295944.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000295944

0 1
O 4.026083 -0.422849 -2.132398
O 5.495429 0.685507 1.568172
N 3.360809 0.586776 -0.161749
N -2.248340 -0.104534 -0.469497
N -2.996227 0.184960 0.496880
C 1.948430 0.386946 -0.249243
C 5.750856 0.535751 -0.795594
C 1.330553 -0.186006 -1.375584
C 1.172118 0.810514 0.853837
C 4.307915 0.163457 -1.106248
C -0.833083 0.092389 -0.307629
C -0.053417 -0.330844 -1.403253
C -0.209309 0.662564 0.820898
C 6.202756 0.359121 0.638901
C -4.418065 -0.004269 0.323355
C 7.571411 -0.208986 0.826761
C -5.161218 0.006629 1.519952
C -5.067283 -0.147429 -0.916396
C -6.548918 -0.131028 1.465782
C -6.456608 -0.279439 -0.953190
C -7.197298 -0.272792 0.233554
H 3.706070 1.003277 0.725608
H 5.910288 1.599597 -1.091701
H 6.394693 -0.041440 -1.500555
H 1.932513 -0.521188 -2.228437
H 1.646452 1.249158 1.730425
H -0.540388 -0.774926 -2.275237
H -0.817143 0.987202 1.669614
H 8.338459 0.332333 0.256440
H 7.873152 -0.183876 1.887428
H 7.618224 -1.262752 0.509885
H -4.649513 0.121024 2.476208
H -4.484942 -0.155263 -1.839074
H -7.128989 -0.126434 2.387613
H -6.963986 -0.389263 -1.910743
H -8.280483 -0.377488 0.198915


%chk=000295944-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000295944

0 1
O 4.101476 -0.113938 -2.413879
O 5.346803 0.556978 1.637971
N 3.362789 0.423318 -0.238909
N -2.285131 -0.071934 -0.560062
N -2.977237 0.147911 0.531953
C 1.956524 0.286982 -0.353652
C 5.781732 0.518108 -0.772668
C 1.298089 -0.054856 -1.567258
C 1.187858 0.516123 0.828156
C 4.325783 0.230284 -1.215626
C -0.873242 0.068424 -0.408543
C -0.104242 -0.159515 -1.580073
C -0.207055 0.409964 0.805644
C 6.168774 0.342906 0.697325
C -4.395072 0.004417 0.373959
C 7.594056 -0.086491 0.979983
C -5.160369 0.246089 1.545668
C -5.049577 -0.352317 -0.840328
C -6.566226 0.134547 1.510036
C -6.452097 -0.461773 -0.866969
C -7.216066 -0.219536 0.304213
H 3.746711 0.648527 0.698525
H 5.990386 1.578255 -1.035073
H 6.437570 -0.084897 -1.422655
H 1.888632 -0.233074 -2.467024
H 1.703035 0.776407 1.761301
H -0.635355 -0.421430 -2.501078
H -0.807000 0.582484 1.703930
H 8.312622 0.502360 0.380632
H 7.822134 0.015071 2.051718
H 7.725155 -1.145535 0.682795
H -4.629214 0.517945 2.463966
H -4.440563 -0.534325 -1.731028
H -7.153020 0.321978 2.415861
H -6.959711 -0.735979 -1.798830
H -8.307950 -0.307081 0.273721


