%chk=000219270.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000219270

0 1
O 3.568684 -1.564254 -0.721667
O 2.120359 1.553027 -1.078045
O -0.763363 2.188447 -0.795425
O 2.567021 -1.261261 1.294014
N -0.903877 -0.093577 -0.320213
C 1.380559 -0.758121 -0.786398
C 0.028176 -1.260631 -0.234415
C 1.251066 0.764899 -0.872430
C -0.255324 1.104007 -0.663946
C -2.297826 -0.251279 -0.015497
C 2.534880 -1.194677 0.090252
C -3.197755 0.798464 -0.283471
C -2.763420 -1.457705 0.542796
C -4.552364 0.630336 0.002665
C -4.125239 -1.603674 0.818608
C 4.844248 -1.935029 -0.091891
C -5.023483 -0.567744 0.550236
C 5.556159 -0.690022 0.385585
H 1.551155 -1.141979 -1.831109
H -0.361361 -2.112278 -0.831827
H 0.127074 -1.593257 0.827843
H -2.844462 1.745266 -0.704939
H -2.089578 -2.276471 0.776544
H -5.247837 1.444843 -0.204073
H -4.485924 -2.537266 1.250946
H 4.634953 -2.652034 0.721103
H 5.347413 -2.431882 -0.942181
H -6.081960 -0.690045 0.768633
H 6.590717 -0.904773 0.679986
H 5.586733 0.083625 -0.395181
H 5.052477 -0.244152 1.256896


%chk=000219270-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000219270

0 1
O 3.644825 -1.527738 -0.788420
O 2.189657 1.368614 -1.199560
O -0.652882 2.166544 -0.880150
O 2.469937 -1.630448 1.232043
N -0.902751 -0.162899 -0.370831
C 1.334071 -0.961936 -0.854849
C -0.035600 -1.372881 -0.279480
C 1.255235 0.582877 -0.965352
C -0.209165 0.995334 -0.745770
C -2.288303 -0.246962 -0.034290
C 2.513298 -1.415994 -0.002220
C -3.158265 0.868997 -0.202269
C -2.811663 -1.469019 0.474793
C -4.522241 0.744960 0.130517
C -4.178612 -1.573767 0.802136
C 4.938915 -1.799610 -0.075673
C -5.044605 -0.470097 0.631145
C 5.531592 -0.496600 0.464398
H 1.485228 -1.340345 -1.882196
H -0.490079 -2.199830 -0.851000
H 0.078092 -1.681447 0.775583
H -2.759488 1.812326 -0.578847
H -2.163967 -2.336188 0.630564
H -5.180499 1.610324 -0.003287
H -4.564663 -2.520533 1.195508
H 4.744486 -2.527586 0.731682
H 5.566833 -2.252934 -0.858215
H -6.106022 -0.554515 0.887032
H 6.529392 -0.695818 0.897211
H 5.642571 0.247619 -0.342084
H 4.892572 -0.069644 1.255279


