%chk=000231933.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000231933

0 1
O 0.302872 -0.970340 1.295568
O 0.911450 0.365077 -3.153739
O -1.140631 2.210787 -2.629843
N 2.730084 -1.056523 0.308424
C 1.949397 -1.165968 -1.019480
C 0.678257 -0.398941 -0.938749
C 3.514964 0.248384 0.409241
C 3.650010 -2.257759 0.486444
C -0.131294 -0.502068 0.214021
C -1.548773 -0.027316 0.146407
C 0.302133 0.344418 -2.098961
C -1.965194 0.785178 -0.923463
C -0.977484 1.220555 -1.959913
C 2.608196 1.399220 0.812074
C 4.041324 -2.432055 1.945483
C -2.462786 -0.400362 1.136367
C -3.293968 1.214016 -0.999275
C -3.794829 0.022955 1.051763
C -4.209928 0.825413 -0.013882
H 2.576236 -0.807702 -1.869707
H 1.732609 -2.245694 -1.192826
H 4.328543 0.124834 1.159867
H 4.001462 0.463208 -0.569806
H 3.112049 -3.170365 0.130880
H 4.547684 -2.149488 -0.161359
H 1.892345 1.654674 0.011616
H 2.004316 1.174118 1.703878
H 3.189786 2.304715 1.025864
H 4.617552 -1.584094 2.338349
H 3.164459 -2.561962 2.599107
H 4.663892 -3.329409 2.076583
H -2.122349 -1.019702 1.970129
H -3.605005 1.855362 -1.827529
H -4.506698 -0.273710 1.821073
H -5.246250 1.154753 -0.078764
H 1.951571 -1.079708 1.109560


%chk=000231933-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000231933

0 1
O 0.401257 -1.007861 1.246204
O 0.978087 0.526868 -3.261694
O -1.700875 1.417456 -3.274738
N 2.725774 -0.984766 0.341988
C 2.147782 -0.793988 -1.065463
C 0.718721 -0.276867 -1.022486
C 3.545496 0.207914 0.791350
C 3.494367 -2.286820 0.442502
C -0.088744 -0.458931 0.120922
C -1.510854 -0.028264 0.118561
C 0.236737 0.357692 -2.228677
C -2.070612 0.598698 -1.033045
C -1.235023 0.840812 -2.252238
C 2.758585 1.528085 0.794352
C 3.931738 -2.635526 1.873973
C -2.316363 -0.241442 1.261376
C -3.428014 1.001006 -1.024303
C -3.670086 0.160878 1.260408
C -4.228466 0.783049 0.116922
H 2.786555 -0.113036 -1.656802
H 2.185402 -1.776299 -1.574915
H 3.899238 -0.010007 1.813406
H 4.430457 0.278943 0.127314
H 2.815108 -3.071839 0.065686
H 4.364199 -2.235426 -0.242019
H 2.424583 1.819335 -0.214788
H 1.872448 1.464613 1.448696
H 3.412953 2.330356 1.179320
H 4.730409 -1.975135 2.251908
H 3.077003 -2.594163 2.572676
H 4.325964 -3.666947 1.886615
H -1.862327 -0.723090 2.132204
H -3.829813 1.482109 -1.922262
H -4.290242 -0.009319 2.147367
H -5.278359 1.094973 0.119157
H 1.712920 -1.068558 0.975923


