%chk=000273970.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000273970

0 1
O -5.395032 -1.290950 -0.001033
O 6.387324 0.533337 -0.000825
O 5.917940 -1.578334 0.000442
N 5.601379 -0.400182 -0.000107
N -0.898257 -0.048944 0.000135
N -2.217378 0.393661 0.000145
C 1.435774 0.529790 0.000256
C 4.155527 -0.078039 0.000025
C 2.390364 1.565373 -0.000187
C 1.857676 -0.811204 0.000588
C 3.751104 1.265984 -0.000309
C 3.217587 -1.120551 0.000478
C 0.001056 0.898053 0.000383
C -4.513825 -0.182265 -0.000285
C -5.235110 0.990076 0.000482
C -6.626397 0.624399 0.000259
C -3.113631 -0.561363 -0.000512
C -6.676841 -0.747223 -0.000703
H 2.070680 2.608743 -0.000445
H 1.113436 -1.614622 0.000929
H 4.504430 2.061906 -0.000668
H 3.558290 -2.162309 0.000744
H -0.214654 1.982004 0.000498
H -4.841891 1.991770 0.001153
H -7.449047 1.314627 0.000733
H -2.916579 -1.650470 -0.001057
H -7.446728 -1.488465 -0.001220


%chk=000273970-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000273970

0 1
O -5.429535 -1.291753 -0.000077
O 6.469650 0.594930 0.000608
O 5.984088 -1.635536 0.000290
N 5.633653 -0.391351 0.000174
N -0.910514 -0.084764 -0.000197
N -2.226754 0.464559 -0.000050
C 1.439640 0.517989 -0.000124
C 4.185825 -0.076868 0.000002
C 2.405744 1.564868 0.000041
C 1.882783 -0.838897 -0.000203
C 3.781757 1.276286 0.000109
C 3.252310 -1.141416 -0.000143
C 0.014933 0.859198 -0.000206
C -4.540040 -0.183345 -0.000014
C -5.288494 0.998563 0.000034
C -6.676372 0.625958 -0.000012
C -3.138341 -0.499909 -0.000011
C -6.722893 -0.764374 -0.000032
H 2.069527 2.608007 0.000113
H 1.130099 -1.632622 -0.000322
H 4.539946 2.063285 0.000242
H 3.617665 -2.171518 -0.000205
H -0.272923 1.925096 -0.000051
H -4.867931 2.001205 0.000082
H -7.534193 1.294705 0.000001
H -2.853126 -1.565353 -0.000097
H -7.529307 -1.492140 -0.000052


