%chk=000270064.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000270064

0 1
O -3.014153 0.901151 2.427695
O -6.264295 0.692412 -1.112747
O -0.668731 -1.519567 -0.716379
O -5.138108 -1.328040 -1.016124
N -2.987695 -0.106555 0.317220
N -0.156802 -0.614246 1.379048
N 2.313226 0.112280 0.535185
N 3.196925 -0.507730 -2.133755
C -1.438842 -0.979900 2.016095
C -4.023479 0.753023 -0.257232
C -2.558483 0.035950 1.618836
C -1.278803 -1.053121 3.539427
C -3.461544 1.691722 -1.360030
C 0.142910 -0.932385 0.082046
C -5.163648 -0.107905 -0.817819
C 1.528957 -0.533977 -0.355125
C 3.581102 0.476504 0.110465
C 4.026147 0.161313 -1.236027
C 1.971561 -0.841809 -1.688922
C 4.459084 1.166743 1.002121
C 5.338037 0.545365 -1.648356
C 5.737194 1.530805 0.571110
C 6.177990 1.219218 -0.757082
C -7.432774 -0.011496 -1.697710
H -1.725605 -1.966673 1.603084
H -4.424334 1.369211 0.568176
H -2.524062 -0.813440 -0.276222
H 0.561579 -0.103312 1.906873
H -0.466896 -1.750590 3.810558
H -2.216253 -1.405756 3.999395
H -1.070752 -0.053649 3.958683
H -2.680038 2.337138 -0.924854
H -4.265333 2.327242 -1.767503
H -3.015112 1.107882 -2.184888
H 1.295395 -1.366170 -2.369775
H 4.100925 1.394631 2.010811
H 5.649405 0.296062 -2.667235
H 6.413145 2.059986 1.251097
H 7.184385 1.515148 -1.071679
H -8.165337 0.782115 -1.899775
H -7.140591 -0.532950 -2.624497
H -7.830399 -0.746633 -0.978291


%chk=000270064-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000270064

0 1
O -2.962153 1.023721 2.551485
O -6.093934 0.549327 -1.397620
O -0.773983 -1.662461 -0.478279
O -4.611293 -1.245872 -1.494639
N -3.091588 -0.173712 0.555865
N -0.179350 -0.584826 1.509458
N 2.240615 0.092013 0.498652
N 3.003757 -0.708944 -2.159320
C -1.431389 -0.910372 2.221858
C -4.149169 0.678933 0.000180
C -2.566046 0.077235 1.801794
C -1.210227 -0.877613 3.739089
C -3.588228 1.982493 -0.634851
C 0.064936 -1.003151 0.228336
C -4.940458 -0.133747 -1.024582
C 1.423335 -0.624380 -0.303938
C 3.481842 0.436831 -0.011972
C 3.866018 0.031077 -1.352936
C 1.805873 -1.023138 -1.632461
C 4.392252 1.197028 0.785123
C 5.151090 0.398479 -1.855071
C 5.643035 1.542565 0.267665
C 6.023660 1.142323 -1.055451
C -6.934794 -0.119844 -2.422004
H -1.728003 -1.923414 1.887540
H -4.825232 0.969456 0.825749
H -2.684215 -0.921228 -0.030118
H 0.553246 -0.026136 1.963612
H -0.382329 -1.550277 4.024081
H -2.125096 -1.202498 4.261221
H -0.992896 0.149809 4.078567
H -3.045291 2.546578 0.141482
H -4.411790 2.606127 -1.020983
H -2.894133 1.747659 -1.460879
H 1.104751 -1.602163 -2.239923
H 4.079910 1.492124 1.791601
H 5.416289 0.080497 -2.867882
H 6.343834 2.125338 0.874812
H 7.009719 1.425302 -1.438904
H -7.763559 0.578435 -2.602094
H -6.350109 -0.293908 -3.340655
H -7.302999 -1.085670 -2.037709


