%chk=000095255.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000095255

0 1
O -0.463566 -1.429334 -0.061344
O -0.913683 0.845495 -0.122205
N 3.887866 0.831626 -0.466600
N -2.584851 -0.813476 -0.208063
C 5.337338 0.809196 -0.120296
C 3.266043 2.187132 -0.456741
C 3.093592 -0.293587 -0.167955
C 1.678496 -0.201000 -0.203746
C 3.689191 -1.562044 0.062592
C 5.625717 0.859536 1.379734
C 2.902236 2.703384 0.934298
C 0.939984 -1.360320 -0.023490
C 2.898031 -2.694660 0.237311
C 1.503712 -2.623804 0.202538
C -1.286128 -0.302013 -0.133109
C -3.773692 -0.016082 -0.275113
C -5.002675 -0.704511 -0.339720
C -3.735147 1.387912 -0.278614
C -6.187393 0.029266 -0.407944
C -4.934664 2.098658 -0.347455
C -6.160065 1.427979 -0.412097
H 5.785624 -0.109465 -0.567118
H 5.822660 1.670806 -0.632247
H 3.973314 2.887982 -0.954336
H 2.355099 2.153650 -1.102005
H 1.180372 0.755477 -0.373241
H 4.770252 -1.662470 0.091187
H 5.207905 1.768301 1.838887
H 5.181941 0.005289 1.907497
H 6.702354 0.848875 1.577922
H 2.163177 2.055112 1.425556
H 3.780407 2.748948 1.593912
H 2.467295 3.707334 0.881516
H 3.376090 -3.660712 0.408416
H 0.877123 -3.496427 0.340189
H -2.695261 -1.833490 -0.206362
H -5.037457 -1.790828 -0.337422
H -2.781244 1.921731 -0.228504
H -7.141505 -0.495568 -0.458382
H -4.910339 3.188893 -0.350625
H -7.088650 1.991308 -0.465523


%chk=000095255-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000095255

0 1
O -0.498765 -1.379880 -0.079897
O -0.959717 0.959553 -0.217039
N 3.932156 0.862324 -0.214440
N -2.628271 -0.719869 -0.201251
C 5.402471 0.783879 -0.108485
C 3.317051 2.199055 -0.355966
C 3.138848 -0.286299 -0.068748
C 1.709939 -0.191085 -0.125408
C 3.720047 -1.582218 0.118200
C 5.944638 0.719518 1.341684
C 2.814743 2.826133 0.968525
C 0.932096 -1.358188 -0.022107
C 2.903296 -2.725859 0.215095
C 1.497594 -2.640576 0.145712
C -1.329813 -0.238063 -0.172089
C -3.836815 0.024199 -0.288483
C -5.052317 -0.712385 -0.291483
C -3.870800 1.441549 -0.371218
C -6.288381 -0.041136 -0.376046
C -5.117958 2.097353 -0.455329
C -6.330397 1.370430 -0.458769
H 5.764343 -0.091717 -0.681909
H 5.820900 1.674308 -0.613068
H 4.073631 2.865295 -0.810363
H 2.481433 2.142691 -1.079828
H 1.206080 0.765873 -0.241976
H 4.803521 -1.705437 0.187778
H 5.682088 1.633673 1.902633
H 5.523827 -0.144227 1.885147
H 7.046670 0.622254 1.336985
H 2.066965 2.178267 1.456830
H 3.648715 2.982472 1.675426
H 2.339915 3.805219 0.770720
H 3.374782 -3.705442 0.352896
H 0.852732 -3.518925 0.225329
H -2.705746 -1.738041 -0.151100
H -5.027984 -1.807884 -0.227655
H -2.935912 2.005176 -0.368220
H -7.217594 -0.621523 -0.377261
H -5.137807 3.191176 -0.518864
H -7.290703 1.892457 -0.524658


