%chk=000223022.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000223022

0 1
O -1.653279 -1.791708 -0.379379
O -4.158392 -0.545745 0.488788
O 2.324763 -1.219947 0.116614
O 3.852181 1.666303 -0.505976
O 4.458578 -1.017415 0.868250
N 1.990226 1.407531 0.838947
C 0.426295 2.617583 -0.698459
C -0.768677 1.762023 -0.382745
C 1.396202 2.721954 0.493328
C -0.701127 0.371302 -0.557827
C -1.953160 2.352370 0.086012
C -1.816150 -0.417252 -0.257070
C -2.998012 0.178649 0.237272
C -3.063770 1.566784 0.400833
C 3.129917 0.972068 0.173095
C 3.450669 -0.519702 0.450840
C -2.596916 -2.429820 -1.285597
C -4.042944 -1.456087 1.617775
C 2.355673 -2.689825 0.229803
C 1.272577 -3.151661 -0.716605
H 0.965192 2.219199 -1.586259
H 0.110660 3.638785 -0.998085
H 0.871955 3.108194 1.396160
H 2.215658 3.440834 0.249918
H 0.206042 -0.113173 -0.927239
H -2.011002 3.432531 0.210999
H -3.985924 2.015291 0.770207
H 1.332286 0.714346 1.209975
H -2.353385 -2.139356 -2.311344
H -2.404629 -3.493381 -1.112386
H -3.628769 -2.158538 -1.030995
H -3.202803 -2.143908 1.473169
H -5.004509 -1.979872 1.591461
H -3.931071 -0.878531 2.539172
H 2.142879 -2.912881 1.288905
H 3.366481 -3.042858 -0.040329
H 1.522949 -2.932604 -1.762471
H 0.312353 -2.640073 -0.510910
H 1.098182 -4.229913 -0.627147


%chk=000223022-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000223022

0 1
O -1.815673 -1.661068 -1.057515
O -4.041746 -0.745011 0.617822
O 2.357279 -1.213846 0.415842
O 4.159921 1.818539 -0.313270
O 4.632533 -1.055806 -0.099130
N 1.973651 1.352674 0.405826
C 0.306490 2.828588 -0.749148
C -0.861986 1.902104 -0.444010
C 1.448558 2.718839 0.308123
C -0.861961 0.563176 -0.913531
C -1.954976 2.335102 0.350861
C -1.902143 -0.329232 -0.580276
C -2.969520 0.104920 0.257478
C -2.995285 1.445737 0.697969
C 3.260033 1.010890 0.050016
C 3.533590 -0.514540 0.114253
C -2.903897 -2.055038 -1.985452
C -3.656329 -1.909740 1.449311
C 2.440448 -2.710031 0.440523
C 1.034684 -3.225402 0.730496
H 0.734414 2.601672 -1.742851
H -0.031465 3.881933 -0.767259
H 1.068480 3.039569 1.297368
H 2.291685 3.374169 0.029893
H -0.059369 0.193898 -1.561497
H -1.989940 3.371815 0.705937
H -3.837145 1.767332 1.319602
H 1.335747 0.588739 0.649216
H -2.853067 -1.444155 -2.906197
H -2.716894 -3.112641 -2.225737
H -3.892581 -1.932982 -1.508066
H -2.887277 -2.521129 0.943279
H -4.581700 -2.489147 1.587614
H -3.277574 -1.566146 2.430664
H 3.174583 -2.996863 1.214867
H 2.823195 -3.041627 -0.541563
H 0.312875 -2.867832 -0.024335
H 0.691168 -2.895019 1.726385
H 1.038393 -4.330944 0.717195


