%chk=000257995.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000257995

0 1
O 1.986512 -0.432851 -0.159764
N -7.030150 1.892024 -0.403954
C 3.340312 -0.181620 -0.052918
C 6.114125 0.078149 -0.046977
C -2.738209 -0.187572 0.443400
C 1.075673 0.406378 0.613141
C 3.926339 0.808480 0.739387
C 4.114715 -1.052269 -0.849097
C 5.322494 0.927904 0.732699
C 5.495872 -0.913115 -0.837843
C -1.406164 0.330451 0.794657
C -0.273469 -0.129827 0.253359
C -3.800540 0.713728 0.264918
C 7.603027 0.206116 -0.054065
C -2.966695 -1.566789 0.296671
C -5.073498 0.227252 -0.066213
C -4.239913 -2.040868 -0.029811
C -5.300413 -1.151080 -0.215057
C -6.156984 1.149270 -0.253502
H 1.211141 1.458752 0.299250
H 1.311589 0.287609 1.687272
H 3.334998 1.478960 1.351828
H 3.619092 -1.809342 -1.452108
H 5.789372 1.697036 1.346977
H 6.109718 -1.576479 -1.446663
H -1.407541 1.136192 1.533450
H -0.251189 -0.927294 -0.498462
H -3.637050 1.786022 0.375577
H -2.146980 -2.270591 0.444921
H 8.084769 -0.723699 0.280257
H 7.979148 0.425453 -1.063500
H 7.962738 1.007868 0.603252
H -4.407274 -3.112793 -0.140731
H -6.293564 -1.519653 -0.471252


%chk=000257995-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000257995

0 1
O 2.015932 -0.626966 -0.059608
N -6.983854 1.094704 2.322188
C 3.389371 -0.322753 0.036171
C 6.210006 0.054857 0.255845
C -2.765553 -0.147937 0.096518
C 1.087420 0.504646 -0.259205
C 3.931508 0.983877 0.006259
C 4.248118 -1.441158 0.176851
C 5.332925 1.155321 0.116128
C 5.636672 -1.247153 0.284818
C -1.379116 0.338588 0.250107
C -0.284941 -0.076675 -0.446098
C -3.780583 0.427162 0.904597
C 7.712870 0.245024 0.372728
C -3.137205 -1.172784 -0.821908
C -5.129326 -0.003600 0.802903
C -4.474630 -1.603493 -0.923643
C -5.480618 -1.027184 -0.118234
C -6.142176 0.596904 1.633484
H 1.403037 1.068171 -1.165170
H 1.120675 1.191167 0.611465
H 3.291334 1.865559 -0.094614
H 3.807196 -2.442618 0.200129
H 5.744827 2.171560 0.092560
H 6.290619 -2.121281 0.393636
H -1.238635 1.119382 1.012764
H -0.353053 -0.864117 -1.207841
H -3.524157 1.216101 1.620712
H -2.376703 -1.637921 -1.457599
H 8.100700 -0.172585 1.321194
H 8.250188 -0.264690 -0.449515
H 7.988944 1.313252 0.340226
H -4.739042 -2.393554 -1.634100
H -6.520748 -1.358004 -0.194650


