%chk=000268178.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000268178

0 1
O 0.499576 -0.735978 -0.054083
O -0.307836 -2.318229 1.345615
O -6.645423 0.163532 -0.343968
O -5.707454 1.659557 -1.594747
N -5.670440 0.707952 -0.833129
C 1.895825 -1.159490 0.230337
C 2.642969 -0.634199 -0.996266
C 2.325957 -0.588413 1.583425
C 4.125134 -1.027239 -0.954181
C 2.021241 0.896162 1.813921
C 5.031544 -0.051831 -1.717592
C 2.923629 1.866683 1.036764
C 5.017208 1.379301 -1.152611
C 4.385415 1.633566 1.275935
C 5.298165 1.421038 0.321273
C -0.509453 -1.397861 0.584829
C -1.835903 -0.829523 0.197270
C -2.987838 -1.424089 0.734839
C -1.931377 0.264019 -0.674733
C -4.246837 -0.923567 0.399766
C -3.186736 0.770863 -1.015210
C -4.331508 0.170323 -0.472947
H 1.890884 -2.273638 0.264136
H 2.535584 0.475366 -1.038370
H 2.163474 -1.010690 -1.919374
H 3.417251 -0.767128 1.703826
H 1.830300 -1.180179 2.383811
H 4.253048 -2.046867 -1.365778
H 4.473009 -1.078922 0.100753
H 2.104520 1.107435 2.899072
H 0.964477 1.096474 1.541803
H 4.737386 -0.020537 -2.784622
H 6.068308 -0.443182 -1.699498
H 2.671929 2.909711 1.321453
H 2.686773 1.785650 -0.051830
H 4.036725 1.852680 -1.376626
H 5.769526 1.993007 -1.689383
H 4.675355 1.650452 2.328084
H 6.344404 1.253458 0.581216
H -2.890555 -2.278032 1.414920
H -1.020004 0.712886 -1.084084
H -5.159651 -1.372591 0.807920
H -3.285298 1.624473 -1.695337


%chk=000268178-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000268178

0 1
O 0.435028 -0.592719 -0.061794
O -0.387502 -2.346391 1.246125
O -6.880303 -0.081721 -0.319718
O -5.984199 1.555242 -1.631214
N -5.876829 0.544251 -0.835991
C 1.859940 -1.027970 0.215529
C 2.655186 -0.584947 -1.024904
C 2.297448 -0.481880 1.595551
C 4.132017 -1.065508 -0.996637
C 2.139721 1.033406 1.886841
C 5.115258 -0.136013 -1.750792
C 3.113736 2.018799 1.165728
C 5.186985 1.313931 -1.173205
C 4.576977 1.648331 1.312575
C 5.463001 1.353812 0.318700
C -0.580782 -1.343425 0.513418
C -1.937888 -0.821078 0.145896
C -3.071695 -1.482135 0.685442
C -2.105258 0.293421 -0.716648
C -4.368792 -1.039490 0.369627
C -3.397420 0.745870 -1.043159
C -4.508925 0.070223 -0.493022
H 1.839953 -2.134335 0.280420
H 2.605557 0.512739 -1.109037
H 2.146117 -0.988112 -1.921016
H 3.354583 -0.773328 1.748305
H 1.715083 -1.037331 2.355132
H 4.196706 -2.085930 -1.422688
H 4.482850 -1.141396 0.049067
H 2.278176 1.160060 2.979814
H 1.099596 1.346811 1.670122
H 4.839108 -0.073038 -2.822819
H 6.125408 -0.590997 -1.711091
H 2.950492 3.020372 1.616226
H 2.839180 2.117219 0.102113
H 4.251774 1.852863 -1.409262
H 5.994039 1.852976 -1.708622
H 4.943462 1.611586 2.351599
H 6.490166 1.086875 0.613811
H -2.911664 -2.339359 1.346561
H -1.220816 0.789483 -1.123606
H -5.260952 -1.527632 0.769597
H -3.561219 1.598870 -1.706378


