%chk=000216920.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000216920

0 1
O -0.540554 1.831032 -0.861513
O 1.585012 -1.494116 0.582267
N 1.399255 0.622792 -0.293510
N -1.924465 1.703153 -0.815793
C -3.600302 0.030158 -0.073173
C -2.228973 0.507513 -0.277818
C 0.004632 0.643171 -0.318723
C -1.009374 -0.204580 0.055568
C 3.619505 -0.275069 0.128425
C -3.869707 -1.349121 -0.081953
C -4.646392 0.946107 0.131240
C 2.143423 -0.496893 0.189458
C 4.398388 -1.143035 -0.648614
C 4.218527 0.753506 0.867935
C -5.175060 -1.803936 0.116874
C -5.948875 0.481873 0.330311
C -6.214761 -0.891052 0.324464
C 5.784394 -0.968556 -0.695186
C 5.605255 0.917697 0.819773
C 6.386558 0.060138 0.036934
H -0.926179 -1.175972 0.507972
H 1.878419 1.448580 -0.665943
H -3.062876 -2.062609 -0.248724
H -4.439324 2.017853 0.130787
H 3.925220 -1.953007 -1.206767
H 3.610839 1.414045 1.487183
H -5.382857 -2.872885 0.109488
H -6.758179 1.193123 0.489112
H -7.230886 -1.249783 0.480298
H 6.395515 -1.639107 -1.299211
H 6.078331 1.712983 1.395412
H 7.468389 0.192097 0.000728


%chk=000216920-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000216920

0 1
O -0.564184 2.062196 0.053157
O 1.595618 -1.563182 -0.132352
N 1.378709 0.753356 -0.011312
N -2.032495 1.919863 0.078796
C -3.621247 0.041970 0.069244
C -2.241640 0.571171 0.054016
C -0.010667 0.777049 0.014394
C -1.009363 -0.180126 0.012970
C 3.635409 -0.236460 -0.034214
C -3.855738 -1.358632 0.065192
C -4.733449 0.928468 0.088225
C 2.146707 -0.424934 -0.059238
C 4.430988 -1.328544 -0.468056
C 4.272438 0.949830 0.420264
C -5.173609 -1.863087 0.079688
C -6.047546 0.421193 0.102881
C -6.274506 -0.976455 0.098546
C 5.836744 -1.230400 -0.470291
C 5.680532 1.044777 0.420712
C 6.465804 -0.041579 -0.030245
H -0.859705 -1.252687 -0.020951
H 1.842741 1.663703 -0.042790
H -3.011851 -2.056568 0.051876
H -4.551602 2.007957 0.090899
H 3.922367 -2.241580 -0.793783
H 3.692608 1.792210 0.817545
H -5.340572 -2.945751 0.076518
H -6.896512 1.113489 0.117246
H -7.297423 -1.368630 0.109720
H 6.441805 -2.076588 -0.812521
H 6.164020 1.958913 0.781094
H 7.558519 0.035155 -0.029931


