%chk=000278809.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000278809

0 1
O -2.483431 -2.883167 0.000460
O -3.462221 2.426922 -0.000554
N 1.678408 1.834840 0.000263
N -0.258117 -1.200521 -0.000042
N -0.790441 1.644807 0.000153
C 2.185342 -0.447612 -0.000012
C 0.742009 -0.309370 0.000002
C 0.467887 1.136289 0.000152
C 2.732576 0.881925 0.000154
C -1.519824 -0.686316 0.000022
C -1.778328 0.714275 0.000038
C 3.039991 -1.553145 -0.000141
C 4.114818 1.104773 0.000193
C -2.643035 -1.688864 0.000177
C -3.195733 1.252690 -0.000175
C 4.414729 -1.326187 -0.000094
C 4.940045 -0.018155 0.000070
C -4.022755 -1.099340 0.000203
C -4.267610 0.209096 0.000133
H 1.773563 2.837184 0.000374
H 2.623703 -2.562481 -0.000257
H 4.527108 2.109428 0.000324
H 5.101289 -2.172569 -0.000188
H 6.023588 0.115618 0.000105
H -4.822867 -1.848169 0.000319
H -5.284094 0.618551 0.000223


%chk=000278809-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000278809

0 1
O -2.491327 -2.933643 0.000081
O -3.461227 2.483962 0.000108
N 1.662809 1.811718 0.000086
N -0.252588 -1.219522 0.000161
N -0.775212 1.653441 0.000161
C 2.187044 -0.450338 0.000083
C 0.744627 -0.306518 0.000132
C 0.460565 1.122266 0.000127
C 2.729105 0.883962 0.000054
C -1.525036 -0.697614 0.000198
C -1.783382 0.719215 0.000200
C 3.054754 -1.566919 0.000061
C 4.118285 1.119683 0.000007
C -2.665905 -1.678650 0.000175
C -3.196289 1.245291 0.000372
C 4.444939 -1.336841 0.000014
C 4.965868 -0.010163 -0.000012
C -4.042406 -1.110166 0.000017
C -4.286911 0.234309 0.000045
H 1.742734 2.828447 0.000069
H 2.643190 -2.580732 0.000081
H 4.531890 2.133299 -0.000014
H 5.138151 -2.184103 0.000000
H 6.051378 0.137708 -0.000049
H -4.853408 -1.847495 -0.000147
H -5.305046 0.639907 -0.000108


