%chk=000183843.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000183843

0 1
O 2.880467 1.710446 0.272438
O -2.862455 -1.530652 0.197261
N -1.847914 0.560037 0.173362
N -4.244381 0.316964 0.338532
C 3.735643 -0.881135 0.030092
C 2.262753 -0.535041 0.073361
C 1.836604 0.811825 0.199524
C 4.095631 -1.547161 -1.305073
C 4.116150 -1.775378 1.218009
C 1.271849 -1.513257 -0.005589
C -0.479647 0.143933 0.155737
C 0.488579 1.171448 0.243003
C -0.090262 -1.194251 0.034205
C -2.965436 -0.315046 0.198384
C 2.568111 3.115993 0.415132
C -5.400567 -0.598853 0.137993
C -4.456083 1.669713 -0.234676
H 4.328661 0.069975 0.111343
H 3.593313 -2.511795 -1.430152
H 5.173061 -1.725055 -1.379516
H 3.801998 -0.913883 -2.149925
H 3.835952 -1.304860 2.167416
H 5.194466 -1.961378 1.242834
H 3.615116 -2.747869 1.175951
H 1.562545 -2.561761 -0.100648
H 0.189436 2.206136 0.341105
H -0.838314 -1.990788 -0.023041
H -2.005490 1.561515 0.302134
H 2.028015 3.292571 1.349547
H 2.009670 3.471569 -0.455180
H 3.569766 3.564244 0.449533
H -5.699525 -0.700833 -0.916136
H -6.253816 -0.225200 0.726508
H -5.147320 -1.610599 0.515599
H -5.501009 1.985713 -0.068403
H -4.253496 1.724987 -1.316875
H -3.819772 2.403327 0.289109


%chk=000183843-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000183843

0 1
O 2.832443 1.779370 0.182545
O -2.950309 -1.667002 -0.014707
N -1.879734 0.433525 0.079066
N -4.235882 0.290719 0.048631
C 3.791601 -0.895900 0.071068
C 2.297693 -0.562116 0.073691
C 1.832130 0.783810 0.129249
C 4.206199 -1.623087 -1.236493
C 4.185080 -1.734697 1.316767
C 1.310935 -1.571787 0.021521
C -0.510593 0.039622 0.075495
C 0.451624 1.085525 0.130222
C -0.075265 -1.306635 0.021077
C -3.011911 -0.398345 0.034496
C 2.406912 3.175148 0.242263
C -5.477521 -0.497373 0.010026
C -4.342743 1.754821 0.102541
H 4.344808 0.058644 0.116643
H 3.686496 -2.594501 -1.337285
H 5.294959 -1.819989 -1.242011
H 3.959616 -1.014077 -2.124876
H 3.923214 -1.205611 2.250770
H 5.273618 -1.932578 1.323325
H 3.663856 -2.710489 1.322986
H 1.636615 -2.618200 -0.021426
H 0.109770 2.126466 0.172877
H -0.812656 -2.108729 -0.019209
H -2.033291 1.441174 0.120934
H 1.807890 3.378530 1.152352
H 1.823356 3.460829 -0.655710
H 3.338476 3.759698 0.276863
H -6.079051 -0.248452 -0.885626
H -6.090854 -0.318060 0.914282
H -5.201362 -1.561964 -0.029478
H -5.408038 2.034770 0.095379
H -3.872987 2.245210 -0.775581
H -3.902797 2.177333 1.030232


