%chk=000214584.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000214584

0 1
O 1.221104 -1.938366 -0.840509
O -3.261747 2.175367 0.009961
O 3.203755 -0.569696 0.026846
O 3.032084 1.690333 0.014874
N -0.873713 -1.071255 -0.608868
N -1.164175 1.301202 0.015507
C -1.775790 -0.083089 0.030861
C -1.496778 -2.428013 -0.795258
C -2.105822 -0.487388 1.487464
C -2.579379 -2.681892 0.280007
C -2.223721 -2.014919 1.613780
C -2.075013 -2.525789 -2.208215
C 0.541677 -0.980946 -0.527359
C 0.225623 1.428357 0.018296
C 1.051145 0.360009 -0.162211
C -2.076762 2.420556 -0.018773
C 2.501295 0.594647 -0.040929
C -1.487094 3.789092 -0.089665
C 4.663102 -0.479476 0.135518
C 5.056469 -0.109063 1.550075
H -2.725465 -0.035250 -0.582480
H -0.672248 -3.189010 -0.681731
H -3.051767 0.005116 1.787126
H -1.335576 -0.117579 2.189585
H -2.696552 -3.773083 0.420912
H -3.567601 -2.322704 -0.066787
H -2.984861 -2.268333 2.375832
H -1.266518 -2.431099 1.989076
H -2.850651 -1.776633 -2.398669
H -1.288675 -2.368669 -2.960427
H -2.509260 -3.514719 -2.389727
H 0.648049 2.436375 0.180936
H -2.293981 4.544479 -0.134549
H -0.867828 3.943012 -0.987573
H -0.874347 4.041016 0.789167
H 4.941261 -1.514008 -0.141738
H 5.028718 0.243821 -0.613807
H 6.139048 -0.190699 1.699468
H 4.765436 0.926441 1.782892
H 4.565756 -0.759046 2.285993


%chk=000214584-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000214584

0 1
O 1.171994 -2.047133 -1.011213
O -3.299637 2.156895 0.006017
O 3.286916 -0.559317 0.077615
O 2.978964 1.745061 -0.092885
N -0.913618 -1.116062 -0.565804
N -1.165107 1.249951 -0.046362
C -1.770514 -0.105089 0.077921
C -1.605750 -2.417010 -0.817906
C -2.060102 -0.500743 1.554973
C -2.680701 -2.644230 0.288832
C -2.213182 -2.050456 1.641891
C -2.188070 -2.477692 -2.244248
C 0.487970 -1.061655 -0.597063
C 0.218120 1.356097 -0.056345
C 1.053475 0.271266 -0.213297
C -2.054999 2.359135 -0.061650
C 2.508450 0.571011 -0.090176
C -1.445287 3.747658 -0.162973
C 4.760411 -0.338311 0.214333
C 5.135160 -0.084552 1.677392
H -2.729857 -0.061218 -0.466616
H -0.812174 -3.181362 -0.724688
H -2.981153 0.016958 1.877762
H -1.233517 -0.158317 2.204838
H -2.861182 -3.730520 0.383438
H -3.646390 -2.189716 -0.012292
H -2.922033 -2.315888 2.446868
H -1.239901 -2.505369 1.907091
H -2.914971 -1.661456 -2.416246
H -1.383362 -2.393692 -2.994011
H -2.712844 -3.438277 -2.402216
H 0.659236 2.347956 0.073972
H -2.271258 4.470761 -0.220062
H -0.807886 3.856570 -1.058154
H -0.829077 3.988102 0.723041
H 5.191583 -1.277092 -0.167580
H 5.052672 0.510304 -0.428548
H 6.235225 -0.023342 1.774330
H 4.703975 0.866086 2.033223
H 4.777619 -0.906216 2.321698


