%chk=000212849.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000212849

0 1
O 1.721757 -0.888895 0.458200
O -1.893913 -1.126356 -0.782996
O 0.493438 -3.316464 0.636898
N 6.394535 2.156072 0.666793
N -6.374522 2.170009 -0.320519
C 0.042758 -2.338897 -0.298071
C 1.217836 -1.471768 -0.777878
C -1.073210 -1.502167 0.357524
C 2.879808 -0.129951 0.387857
C -2.995422 -0.322659 -0.544718
C 3.549833 0.224602 -0.785646
C -3.412989 0.140251 0.705903
C 3.330289 0.285273 1.657336
C -3.695087 -0.002813 -1.726965
C 5.167057 1.439269 0.565925
C -5.268721 1.270883 -0.386848
C 4.699270 1.013905 -0.691074
C -4.556818 0.940355 0.780098
C 4.471439 1.070314 1.742023
C -4.829439 0.791549 -1.643942
H -0.372396 -2.948560 -1.139543
H 0.887606 -0.662127 -1.451947
H 2.012577 -2.080061 -1.242496
H -0.693174 -0.594416 0.857105
H -1.671231 -2.115582 1.054012
H 1.081312 -2.896535 1.312639
H 3.199390 -0.095232 -1.762293
H -2.871730 -0.104868 1.614563
H 2.779527 -0.013095 2.546944
H -3.334864 -0.382831 -2.680889
H 5.235335 1.287464 -1.597619
H -4.884425 1.314601 1.747714
H 4.837520 1.390532 2.715755
H -5.373475 1.055381 -2.548823
H 6.487824 2.726412 1.496891
H 6.649979 2.681724 -0.158779
H -7.040824 2.076421 -1.076044
H -6.851148 2.188261 0.571708


%chk=000212849-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000212849

0 1
O 1.720615 -1.052998 0.599233
O -1.708345 -1.086305 -0.801207
O 0.525838 -3.498186 0.903366
N 6.111096 2.521320 0.403880
N -6.310773 2.178619 -0.287303
C 0.056182 -2.592482 -0.152392
C 1.195119 -1.680649 -0.626136
C -1.162411 -1.803554 0.358486
C 2.820371 -0.170922 0.469400
C -2.858340 -0.291414 -0.589900
C 3.434901 0.164563 -0.758750
C -3.514499 -0.139394 0.654008
C 3.304773 0.394430 1.671936
C -3.359464 0.382805 -1.728871
C 5.027514 1.633877 0.422028
C -5.173756 1.364290 -0.383525
C 4.528025 1.058782 -0.778301
C -4.660157 0.681431 0.752134
C 4.393088 1.284308 1.651018
C -4.499769 1.199157 -1.629808
H -0.261336 -3.236817 -0.990280
H 0.809761 -0.914683 -1.325994
H 1.993018 -2.278936 -1.109141
H -0.858556 -1.088200 1.149738
H -1.906782 -2.514956 0.766448
H 1.116132 -2.959367 1.495389
H 3.076421 -0.254047 -1.703866
H -3.149483 -0.648194 1.551321
H 2.817108 0.129780 2.615740
H -2.843010 0.255014 -2.685703
H 4.995627 1.312095 -1.737619
H -5.159209 0.790989 1.722920
H 4.756391 1.714783 2.592200
H -4.874492 1.714238 -2.522964
H 6.464144 2.928803 1.263893
H 6.565638 2.770568 -0.468813
H -6.673442 2.663327 -1.101966
H -6.792239 2.297926 0.598198


