%chk=000254169.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000254169

0 1
O -4.006822 0.043046 0.000463
N 2.430148 1.654312 0.000031
N -2.439484 1.752605 -0.000226
C -0.135093 -2.665409 -0.000134
C -0.071310 -1.146220 -0.000122
C 1.192966 -0.468567 -0.000087
C 1.218636 0.958083 -0.000021
C -1.231918 -0.409161 -0.000135
C -0.000804 1.716716 -0.000005
C -1.208794 1.017387 -0.000106
C -0.836075 -3.167954 -1.267634
C -0.835764 -3.167946 1.267541
C 2.446550 -1.158003 -0.000118
C 0.047958 3.210528 0.000043
C 3.625532 -0.460181 -0.000080
C 3.568297 0.971349 0.000002
C -3.746695 1.229059 0.000058
H 0.908973 -3.081742 -0.000266
H -2.204319 -0.921572 -0.000159
H -1.885665 -2.849423 -1.307011
H -0.827593 -4.261837 -1.317840
H -0.348317 -2.786209 -2.171653
H -0.347734 -2.786265 2.171440
H -0.827351 -4.261831 1.317711
H -1.885320 -2.849334 1.307215
H 2.436309 -2.253095 -0.000175
H -0.424127 3.634226 0.895630
H 1.088309 3.586496 0.001265
H -0.421966 3.634095 -0.896757
H -2.340217 2.771399 -0.000485
H 4.590682 -0.957565 -0.000109
H 4.498129 1.554342 0.000045
H -4.517920 2.020371 -0.000023


%chk=000254169-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000254169

0 1
O -4.129261 0.097175 0.001317
N 2.420204 1.701970 0.000098
N -2.420880 1.743593 -0.000508
C -0.153333 -2.712787 -0.000208
C -0.044931 -1.181582 -0.000199
C 1.219273 -0.484462 -0.000076
C 1.232204 0.973603 -0.000051
C -1.224662 -0.431809 -0.000301
C 0.006148 1.722323 -0.000163
C -1.206017 0.997909 -0.000302
C -0.868250 -3.228657 -1.278696
C -0.867944 -3.228650 1.278458
C 2.496644 -1.138520 0.000031
C 0.037990 3.238612 -0.000155
C 3.676297 -0.392249 0.000162
C 3.585553 1.033857 0.000201
C -3.736871 1.295437 -0.000478
H 0.861447 -3.150774 -0.000334
H -2.197880 -0.927487 -0.000412
H -1.908564 -2.859928 -1.328865
H -0.900533 -4.334021 -1.281427
H -0.345515 -2.894178 -2.192949
H -0.344959 -2.894212 2.192583
H -0.900282 -4.334014 1.281180
H -1.908224 -2.859862 1.328895
H 2.551553 -2.230729 0.000015
H -0.453305 3.666482 0.897232
H 1.088903 3.564641 0.000386
H -0.452286 3.666439 -0.898124
H -2.308193 2.760956 -0.000540
H 4.657067 -0.877455 0.000241
H 4.495893 1.646170 0.000322
H -4.448086 2.153909 0.000963


