%chk=000227484.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000227484

0 1
O 1.629585 -2.473488 0.000237
O 2.103502 2.117209 0.000446
N -0.048021 1.319107 0.000298
N -2.260120 0.066348 0.000024
N 1.871766 -0.191667 0.000415
N -2.622520 -1.267531 -0.000084
C -0.873954 0.199403 0.000149
C -0.347104 -1.122193 0.000196
C 1.063979 -1.403216 0.000398
C 1.385974 1.134569 0.000523
C -1.483940 -1.995617 -0.000016
C -0.580327 2.699976 0.000188
C -3.300833 1.102039 -0.000241
C 3.355335 -0.328535 0.000180
H -1.466469 -3.077630 -0.000040
H 0.266060 3.423491 0.000256
H -1.179842 2.893031 0.904292
H -1.179658 2.892966 -0.904049
H -4.305434 0.625812 -0.000233
H -3.232130 1.733181 0.903239
H -3.232003 1.732872 -0.903928
H 3.788450 0.151463 0.894201
H 3.787804 0.147654 -0.896177
H 3.630399 -1.401245 0.002326


%chk=000227484-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000227484

0 1
O 1.628760 -2.526257 0.000276
O 2.149029 2.145148 0.000370
N -0.046923 1.317730 -0.000051
N -2.239489 0.087604 -0.000004
N 1.865471 -0.175225 0.000068
N -2.646814 -1.273280 -0.000027
C -0.861150 0.192749 -0.000040
C -0.348395 -1.124184 -0.000051
C 1.075283 -1.389485 -0.000123
C 1.373732 1.144725 -0.000157
C -1.489648 -1.981432 0.000128
C -0.551328 2.706915 0.000088
C -3.308414 1.093311 -0.000093
C 3.341457 -0.309457 0.000455
H -1.511602 -3.068694 0.000209
H 0.331393 3.363588 -0.000066
H -1.150353 2.911038 0.903481
H -1.150695 2.911086 -0.903065
H -4.252778 0.530238 0.000104
H -3.269846 1.727914 0.900759
H -3.270021 1.727566 -0.901201
H 3.766897 0.177299 0.893019
H 3.767215 0.174590 -0.893459
H 3.568717 -1.385486 0.001979


