%chk=000273985.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000273985

0 1
I -4.826435 -2.866331 -0.000550
O 4.491940 -1.303069 -0.000279
N 0.025051 0.042795 0.000201
N 1.354979 0.454016 0.000719
C -2.291861 0.694297 0.000494
C -2.755912 -0.634003 0.000216
C -3.217158 1.754440 0.000469
C -4.127502 -0.871976 -0.000120
C -4.587922 1.489818 0.000121
C -5.053617 0.169019 -0.000176
C 3.637741 -0.174015 0.000120
C -0.849342 1.014626 0.000808
C 4.386249 0.980346 0.000142
C 5.769170 0.581818 -0.000048
C 5.787171 -0.790199 -0.000438
C 2.227856 -0.520787 0.000274
H -2.035391 -1.459990 0.000318
H -2.867519 2.787244 0.000764
H -5.301583 2.313567 0.000121
H -6.126498 -0.031722 -0.000425
H -0.600704 2.091418 0.001710
H 4.017080 1.990718 0.000422
H 6.607176 1.252706 -0.000022
H 6.538468 -1.549597 -0.000710
H 2.005764 -1.604639 -0.000629


%chk=000273985-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000273985

0 1
I -4.922989 -2.912242 -0.000625
O 4.531368 -1.302845 -0.000318
N 0.030053 -0.005298 0.000000
N 1.362216 0.512244 0.000364
C -2.305784 0.679801 0.000168
C -2.794224 -0.661136 -0.000141
C -3.230053 1.760115 0.000517
C -4.179877 -0.886827 -0.000107
C -4.617556 1.509971 0.000546
C -5.107586 0.183210 0.000237
C 3.663009 -0.177902 0.000172
C -0.867040 0.963630 0.000112
C 4.433018 0.988983 0.000172
C 5.815015 0.590469 0.000235
C 5.836122 -0.799726 -0.000312
C 2.253181 -0.468326 0.000326
H -2.070064 -1.480404 -0.000415
H -2.856218 2.790841 0.000753
H -5.328725 2.342679 0.000808
H -6.183924 -0.009743 0.000261
H -0.545052 2.020348 0.000491
H 4.031402 1.999540 0.000393
H 6.684688 1.244333 0.000458
H 6.628436 -1.543113 -0.000570
H 1.947786 -1.528100 -0.000022


