%chk=000229449.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000229449

0 1
O 0.020092 0.372570 -2.962247
O -0.324213 -3.633313 -0.677123
O -3.754451 0.317895 3.024189
N -0.305994 -1.411884 0.108867
N -0.083173 -1.798903 -2.135385
N -2.360236 0.449176 0.657472
N -3.560915 1.075901 0.802425
N -5.509340 1.484600 2.099769
C -0.303783 -0.056971 -0.517042
C 0.835902 0.815997 0.037206
C 2.227643 0.213188 -0.187057
C 3.318215 1.108685 0.416085
C -0.092055 -0.388364 -2.037592
C 4.713438 0.509365 0.194950
C -1.624238 0.688243 -0.386693
C -0.269910 -2.442504 -0.852401
C 5.808740 1.399024 0.799685
C 7.199377 0.806989 0.582247
C -4.231386 0.881565 2.067937
H 0.781254 1.820327 -0.432333
H 0.665491 0.974689 1.123680
H 2.279632 -0.798430 0.265080
H 2.415492 0.073712 -1.269994
H 3.137389 1.247407 1.499857
H 3.269151 2.120137 -0.031887
H -0.722786 -1.542265 1.030305
H 4.899149 0.370603 -0.887679
H 4.765554 -0.503218 0.640066
H -1.816877 1.398082 -1.203398
H 0.061540 -2.320370 -2.995324
H 5.760365 2.411896 0.354066
H 5.626878 1.536098 1.883724
H 7.974927 1.447362 1.017100
H 7.427956 0.692810 -0.483548
H 7.294074 -0.182286 1.044602
H -3.878070 1.803024 0.150420
H -6.074656 1.270475 2.916370
H -6.046677 1.629389 1.259902


%chk=000229449-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000229449

0 1
O -0.071578 0.408648 -2.978725
O -0.276621 -3.644362 -0.572859
O -4.038136 -0.132960 2.892917
N -0.367851 -1.361143 0.120932
N -0.047450 -1.787735 -2.064713
N -2.422376 0.373821 0.666343
N -3.595094 1.053227 0.892968
N -5.594509 1.396586 2.061652
C -0.344909 -0.036764 -0.520735
C 0.840585 0.864537 -0.034517
C 2.237304 0.235304 -0.217806
C 3.356922 1.129661 0.361407
C -0.144349 -0.401506 -2.023557
C 4.764214 0.513205 0.194934
C -1.657171 0.715073 -0.334509
C -0.238928 -2.410727 -0.778016
C 5.891619 1.402096 0.767683
C 7.292730 0.774125 0.604218
C -4.388167 0.699628 2.022274
H 0.782675 1.820270 -0.591498
H 0.662661 1.092523 1.034779
H 2.261742 -0.755009 0.277423
H 2.434014 0.064877 -1.295536
H 3.162980 1.311954 1.439284
H 3.330900 2.122780 -0.133801
H -0.800196 -1.495072 1.036893
H 4.958640 0.325888 -0.881861
H 4.791341 -0.478390 0.692912
H -1.851948 1.541631 -1.044120
H 0.096153 -2.339085 -2.911389
H 5.867182 2.390854 0.265423
H 5.694239 1.593923 1.842312
H 8.081411 1.428269 1.019459
H 7.526101 0.598546 -0.463064
H 7.352845 -0.200406 1.124592
H -3.882018 1.828359 0.277944
H -6.198760 1.212341 2.858807
H -5.942700 1.985732 1.307850


