%chk=000269869.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000269869

0 1
O -5.290059 1.068844 0.019641
O -5.502707 -1.146589 0.415292
N 0.887521 -0.327326 -0.297899
N 5.529970 0.528366 0.781416
N 4.923401 -0.513342 -1.370973
N 3.909386 1.239029 2.293442
N 7.179112 -0.088937 -0.786651
C -3.304684 -0.186589 0.086225
C -0.517692 -0.244542 -0.096427
C -2.613602 -1.400184 0.261220
C -2.596741 0.994036 -0.188671
C -1.226375 -1.434625 0.172849
C -1.206710 0.972774 -0.274058
C 3.177841 0.143299 0.194280
C -4.777697 -0.201169 0.193634
C 1.754458 0.238254 0.487337
C 4.188838 0.617773 1.086600
C -6.743796 1.226116 0.058498
C 3.627978 -0.422875 -1.027606
C 5.851712 -0.017910 -0.446209
C -7.342870 0.783539 -1.260214
H -3.180212 -2.313987 0.467016
H -3.145916 1.929593 -0.331745
H -0.684590 -2.372112 0.293434
H -0.656989 1.883950 -0.499638
H 1.490593 0.804832 1.397999
H -7.137361 0.653417 0.917420
H -6.829193 2.313559 0.234966
H 2.897390 -0.817165 -1.757104
H -8.408415 1.031790 -1.321845
H -6.836514 1.255292 -2.111980
H -7.248620 -0.305524 -1.391265
H 4.676796 1.465930 2.913727
H 3.007061 1.131237 2.723002
H 7.889666 0.239520 -0.152965
H 7.457719 -0.504173 -1.662349


%chk=000269869-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000269869

0 1
O -5.283965 1.029420 0.168854
O -5.540525 -1.293234 0.173532
N 0.927456 -0.649384 -0.253520
N 5.494342 0.805888 0.688788
N 5.093320 -0.827691 -1.106397
N 3.786754 1.702240 1.970180
N 7.247422 -0.087162 -0.574853
C -3.307676 -0.320304 0.036278
C -0.470654 -0.498889 -0.136486
C -2.667749 -1.589311 -0.019924
C -2.519368 0.859535 -0.015943
C -1.271282 -1.678323 -0.118544
C -1.118827 0.774594 -0.100624
C 3.202718 0.092955 0.170853
C -4.790733 -0.283539 0.127824
C 1.763298 0.147358 0.379021
C 4.151061 0.864901 0.939971
C -6.768134 1.173686 0.237427
C 3.770093 -0.739356 -0.837957
C 5.903232 -0.026290 -0.314299
C -7.382829 1.145621 -1.165097
H -3.290382 -2.489468 0.007802
H -3.019253 1.831991 0.003046
H -0.766832 -2.647585 -0.176250
H -0.519141 1.688646 -0.182220
H 1.379779 0.889577 1.114382
H -7.172531 0.361316 0.866578
H -6.912136 2.147723 0.732658
H 3.096558 -1.352131 -1.445641
H -8.469073 1.344029 -1.101041
H -6.927890 1.917139 -1.810197
H -7.240504 0.157756 -1.634222
H 4.531088 2.202151 2.453130
H 2.826623 1.797919 2.285665
H 7.892319 0.475445 -0.026284
H 7.572121 -0.703123 -1.316091


