%chk=000281161.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000281161

0 1
O -1.654247 0.224898 -1.061725
O -3.775586 -2.215428 -0.827548
O -4.207290 0.557816 1.234801
O -1.402152 3.054709 -0.087758
N 0.672909 -1.067445 0.466054
N 2.657983 -1.991608 -0.237466
N 1.351125 1.354583 0.406348
N 3.683027 1.648990 -0.286404
N 5.098697 -0.153311 -0.864682
C -1.670881 -1.038619 -0.369878
C -3.149330 -1.274703 0.031126
C -3.824471 0.126523 -0.072836
C -2.717570 1.087045 -0.573482
C -0.737672 -0.981889 0.858305
C -2.187814 2.032872 0.517684
C 1.543319 0.002390 0.244001
C 1.402655 -2.258534 0.138589
C 2.784430 -0.595277 -0.182207
C 3.871940 0.291256 -0.451799
C 2.455556 2.097382 0.127341
H -1.309426 -1.759821 -1.135590
H -3.287221 -1.725251 1.038097
H -4.709254 0.104918 -0.739738
H -3.000447 1.658710 -1.485119
H -0.970490 -1.800991 1.575184
H -0.905009 -0.004769 1.398620
H -1.589987 1.485748 1.275491
H -3.015869 2.578423 1.012962
H -3.674917 -1.961400 -1.773273
H -5.090122 0.198149 1.468102
H 0.954401 -3.238730 0.216638
H -0.519815 2.677440 -0.342643
H 2.362014 3.192083 0.244268
H 5.847333 0.495839 -1.049655
H 5.264684 -1.138897 -0.998610


%chk=000281161-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000281161

0 1
O -1.688552 0.238388 -1.117774
O -3.854711 -1.724493 -1.472464
O -3.571050 0.250061 1.691118
O -1.093036 2.885680 -0.292979
N 0.620802 -1.085854 0.488371
N 2.715337 -1.962779 0.103485
N 1.153769 1.331586 0.058515
N 3.522694 1.672198 -0.493836
N 5.060931 -0.113704 -0.647027
C -1.702020 -1.079300 -0.450838
C -3.211897 -1.314410 -0.218917
C -3.720661 0.087853 0.231925
C -2.772620 1.088100 -0.494128
C -0.816923 -1.094787 0.817536
C -2.163539 2.202066 0.398253
C 1.442667 -0.001102 0.149607
C 1.440978 -2.227937 0.435467
C 2.730125 -0.568459 -0.072703
C 3.788827 0.325405 -0.408708
C 2.246738 2.091992 -0.259945
H -1.306269 -1.801695 -1.187326
H -3.457271 -2.109526 0.503574
H -4.775601 0.217415 -0.073531
H -3.268812 1.564669 -1.357445
H -1.013431 -2.015070 1.398318
H -1.053900 -0.233813 1.460972
H -1.830242 1.785819 1.368236
H -2.951439 2.947248 0.611920
H -3.505388 -1.141973 -2.198279
H -4.308832 -0.230295 2.143122
H 1.049658 -3.218533 0.660474
H -0.281426 2.272389 -0.243237
H 2.070873 3.168237 -0.345710
H 5.781563 0.565351 -0.883621
H 5.273162 -1.107624 -0.589225


