%chk=000279459.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000279459

0 1
O 2.392030 1.500077 0.000072
O -4.732644 -0.754189 -0.000589
O -4.416247 1.385061 -0.000482
N 1.588728 -0.685123 0.000191
N 3.952680 -0.169280 0.000905
N -4.011618 0.232928 -0.000488
N 4.394794 -1.508170 0.000962
C 0.198860 -0.395001 -0.000013
C -0.681994 -1.506843 -0.000373
C -0.314320 0.918481 0.000149
C -2.559554 0.015736 -0.000340
C -2.053972 -1.296895 -0.000528
C -1.687356 1.120911 -0.000013
C 2.627097 0.304756 0.000382
C 5.073877 0.810987 0.000470
H -0.297680 -2.524386 -0.000537
H 0.366467 1.781764 0.000387
H 1.830441 -1.675217 0.000149
H -2.751504 -2.143325 -0.000792
H -2.102840 2.136573 0.000113
H 5.702663 0.670948 0.896424
H 4.671339 1.841761 0.000370
H 5.702377 0.670646 -0.895631
H 4.063936 -2.006155 0.834047
H 4.064440 -2.006144 -0.832333


%chk=000279459-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000279459

0 1
O 2.464230 1.677543 0.000177
O -4.798293 -0.912265 0.000100
O -4.555382 1.358918 0.000110
N 1.578612 -0.528185 -0.000476
N 3.888830 -0.180000 -0.000071
N -4.067959 0.158997 0.000028
N 3.977124 -1.598665 -0.000117
C 0.194397 -0.299912 -0.000367
C -0.658641 -1.445361 -0.000168
C -0.383149 1.005134 -0.000443
C -2.606205 0.001238 -0.000146
C -2.051815 -1.300696 -0.000064
C -1.779222 1.148725 -0.000324
C 2.610014 0.420432 -0.000527
C 5.105308 0.644178 0.001201
H -0.217608 -2.449133 -0.000082
H 0.274216 1.876305 -0.000587
H 1.938403 -1.494745 -0.000354
H -2.718964 -2.166461 0.000084
H -2.243694 2.138487 -0.000373
H 5.716310 0.446256 0.903103
H 4.796949 1.700870 0.001177
H 5.717864 0.446672 -0.899725
H 4.418700 -1.964313 0.855230
H 4.419977 -1.964120 -0.854880


