%chk=000187185.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000187185

0 1
O 1.311889 1.981961 -1.600383
O 1.905636 -2.562652 -0.896982
N 0.218153 -1.276939 -1.398711
N 0.722152 -2.355637 -0.808783
C -1.517200 0.194133 -0.356497
C -3.024990 0.398224 -0.164279
C -1.246249 -1.021050 -1.255077
C -3.311218 1.627224 0.710715
C 1.013970 -0.299284 -2.180844
C 2.397927 0.424582 -0.123646
C 1.562512 0.837290 -1.303497
C 3.307738 1.558603 0.363992
C -4.809871 1.838530 0.909638
C 4.070256 1.164830 1.624213
H -1.066598 1.108814 -0.795885
H -1.024909 0.058527 0.626859
H -3.476770 -0.501352 0.297492
H -3.522555 0.517799 -1.146468
H -1.731183 -1.932426 -0.830627
H -1.682529 -0.868293 -2.267817
H -2.815601 1.514218 1.695051
H -2.863973 2.530726 0.249974
H 1.870677 -0.823715 -2.672055
H 0.399868 0.130701 -3.003898
H 1.722970 0.096520 0.697621
H 2.998202 -0.483300 -0.359351
H 2.699541 2.468696 0.549993
H 4.018719 1.837790 -0.439358
H -5.004706 2.717755 1.534924
H -5.327380 1.995946 -0.043642
H -5.279715 0.978564 1.400390
H 3.394022 0.939425 2.456807
H 4.732589 1.974807 1.952482
H 4.695026 0.278380 1.461748


%chk=000187185-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000187185

0 1
O 1.682169 1.932984 -2.019090
O 1.940762 -2.708162 -1.148449
N 0.218010 -1.287101 -1.452834
N 0.689869 -2.482648 -0.930458
C -1.483973 0.191212 -0.292296
C -2.999622 0.444197 -0.123149
C -1.214903 -1.011495 -1.225045
C -3.308336 1.629217 0.820524
C 1.065132 -0.402329 -2.275431
C 2.423186 0.451271 -0.208964
C 1.719139 0.779242 -1.518008
C 3.246225 1.614402 0.376524
C -4.822072 1.886257 0.981019
C 3.908093 1.235551 1.718011
H -1.006802 1.104869 -0.699189
H -1.025934 -0.005391 0.697272
H -3.488255 -0.471910 0.269222
H -3.454997 0.641698 -1.116145
H -1.636296 -1.934904 -0.790113
H -1.703847 -0.838077 -2.204723
H -2.857754 1.430732 1.814137
H -2.815564 2.543107 0.431504
H 1.886691 -1.043921 -2.662008
H 0.473404 0.001515 -3.113984
H 1.649133 0.121866 0.518001
H 3.046476 -0.452374 -0.373698
H 2.592053 2.496524 0.506842
H 4.018183 1.917138 -0.356115
H -5.016337 2.735092 1.661554
H -5.290430 2.120876 0.006610
H -5.334920 0.997551 1.394794
H 3.149886 0.966452 2.477904
H 4.502058 2.076696 2.118969
H 4.585971 0.369260 1.600912


