%chk=000232176.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000232176

0 1
O 2.531335 -1.208423 -1.645097
N 0.138741 -0.194589 -0.287501
N -1.556461 -1.564891 -1.025058
N -1.246830 1.424429 1.045277
N -3.637170 0.889145 0.968174
N -4.510930 -0.967784 -0.207126
C 1.493667 0.328746 -0.014463
C 2.418359 0.165270 -1.254491
C 2.102132 -0.352534 1.226688
C 3.802441 0.756540 -0.949520
C 3.482737 0.244442 1.522908
C 4.422538 0.146443 0.313981
C -1.046440 0.323398 0.244418
C -0.236206 -1.353626 -1.045114
C -2.096130 -0.540058 -0.229574
C -3.428463 -0.215759 0.168323
C -2.551652 1.635201 1.356080
H 1.383211 1.433147 0.198657
H 1.957236 0.623701 -2.160882
H 2.168992 -1.446272 1.077412
H 1.430111 -0.209869 2.098000
H 3.725153 1.856113 -0.844651
H 4.469150 0.581701 -1.818064
H 3.932889 -0.272760 2.392390
H 3.373937 1.304186 1.829868
H 5.379044 0.656693 0.541078
H 4.687964 -0.912825 0.127468
H 0.512193 -1.938793 -1.576895
H 3.062261 -1.714204 -0.991955
H -2.778217 2.505696 1.995377
H -4.389228 -1.762376 -0.815662
H -5.442863 -0.702388 0.067254


%chk=000232176-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000232176

0 1
O 2.608067 -1.242107 -1.693430
N 0.117219 -0.309900 -0.266368
N -1.621383 -1.644038 -0.965151
N -1.174848 1.416829 0.970861
N -3.597254 0.982374 0.901575
N -4.539134 -0.876591 -0.216493
C 1.472101 0.217745 0.004281
C 2.395011 0.152683 -1.240107
C 2.131794 -0.462366 1.230260
C 3.740230 0.845786 -0.925136
C 3.488104 0.215442 1.548075
C 4.430286 0.226922 0.319333
C -1.054087 0.277596 0.226871
C -0.284745 -1.462678 -0.967982
C -2.113425 -0.557599 -0.217578
C -3.431543 -0.159507 0.151767
C -2.482112 1.692072 1.261176
H 1.315728 1.287140 0.251921
H 1.894246 0.631095 -2.099454
H 2.273450 -1.543010 1.026085
H 1.451037 -0.385220 2.096664
H 3.553281 1.922127 -0.741453
H 4.395852 0.774437 -1.812569
H 3.974550 -0.296959 2.399132
H 3.299621 1.259839 1.870180
H 5.352656 0.792492 0.547898
H 4.765640 -0.810432 0.099410
H 0.441733 -2.093122 -1.472723
H 3.307594 -1.658167 -1.128742
H -2.666217 2.592517 1.854996
H -4.431354 -1.719869 -0.775868
H -5.458596 -0.547832 0.069867


