%chk=000228587.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000228587

0 1
O -1.679602 -0.421380 0.232689
O -4.954612 0.818368 0.094927
O -4.170424 -1.164941 0.497116
O 4.133496 1.594681 -0.474469
N 1.832443 0.195576 0.083925
N -4.044853 0.016513 0.234032
N 3.052897 -0.384915 0.220333
N 5.419660 -0.194313 0.190048
C 0.727295 -0.505348 0.153437
C 0.574540 -1.996744 0.329482
C -0.491790 0.294323 0.030490
C -0.760186 1.623785 -0.245628
C 0.850122 -2.739966 -0.973528
C -2.698763 0.534438 0.068100
C -2.179262 1.780345 -0.222025
C 4.191027 0.466164 -0.048776
H -0.456621 -2.238131 0.682098
H 1.236329 -2.359279 1.142138
H -0.030667 2.395329 -0.440847
H 0.738889 -3.823676 -0.840051
H 1.855739 -2.554367 -1.364433
H 0.140817 -2.440756 -1.758785
H -2.732061 2.690853 -0.396313
H 3.167196 -1.405389 0.257479
H 5.492810 -0.942993 0.860621
H 6.246482 0.394820 0.145840


%chk=000228587-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000228587

0 1
O -1.695687 -0.442832 0.170555
O -5.008093 0.903506 -0.091006
O -4.282330 -1.251049 0.285231
O 4.219896 1.747167 -0.128341
N 1.837831 0.295187 0.062653
N -4.075199 0.010033 0.070735
N 3.063066 -0.302902 0.154024
N 5.404968 -0.244351 0.156048
C 0.745015 -0.452682 0.193745
C 0.698635 -1.956639 0.425828
C -0.495857 0.292879 0.054303
C -0.796419 1.644470 -0.183693
C 0.810918 -2.764806 -0.898182
C -2.730453 0.486343 0.000821
C -2.218732 1.765848 -0.215809
C 4.237138 0.506888 0.046230
H -0.252593 -2.214066 0.919715
H 1.502495 -2.259175 1.128828
H -0.053980 2.427773 -0.312994
H 0.806334 -3.848755 -0.687328
H 1.733156 -2.524874 -1.458880
H -0.047683 -2.545104 -1.555158
H -2.812666 2.662110 -0.374010
H 3.154526 -1.314880 0.319263
H 5.434663 -1.253802 0.285463
H 6.281950 0.266709 0.089859


