%chk=000211875.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000211875

0 1
O -1.422924 -0.467842 -1.178598
O -3.850143 -0.566174 1.005141
O -2.137292 -2.340587 1.411470
O -2.775339 2.786559 -0.123682
O 1.569450 -2.345998 -1.390241
N 0.689286 -0.648435 -0.092129
N 0.832851 0.501475 0.586141
N 3.033153 -0.641022 -0.780210
N 4.413159 1.080799 -0.049446
C -2.541674 0.011682 0.905467
C -1.489741 -1.110192 1.144129
C -2.394747 0.425360 -0.572292
C -0.694529 -1.205808 -0.189037
C -1.886395 1.863047 -0.756769
C 1.804618 -1.305300 -0.832594
C 2.015173 1.094086 0.632723
C 3.168423 0.503177 -0.084129
C 2.144254 2.356607 1.413727
H -2.452299 0.864700 1.608481
H -0.848006 -0.950270 2.036523
H -3.331801 0.227680 -1.142533
H -0.616418 -2.245219 -0.607817
H -1.769750 2.108622 -1.827071
H -0.924597 2.041872 -0.236077
H -2.897993 -2.476917 0.780616
H -4.036716 -0.814730 1.941124
H -3.653119 2.777754 -0.559294
H 1.185844 2.643974 1.883543
H 2.440136 3.200590 0.774757
H 2.872023 2.252853 2.231439
H 4.566906 1.976765 0.374806
H 5.172309 0.669892 -0.579067


%chk=000211875-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000211875

0 1
O -1.368449 -0.416582 -1.343368
O -3.593238 -0.210539 1.446866
O -2.327617 -2.447160 0.819927
O -3.052282 2.708449 -0.082689
O 1.765337 -2.452014 -1.411246
N 0.757583 -0.698363 -0.204410
N 0.812896 0.481116 0.494644
N 3.135765 -0.701240 -0.637432
N 4.408193 1.067184 0.172435
C -2.245249 0.022605 0.892047
C -1.425079 -1.307858 0.901296
C -2.378257 0.380804 -0.604508
C -0.601044 -1.251474 -0.403041
C -2.151922 1.874568 -0.897186
C 1.915902 -1.363158 -0.805816
C 1.996711 1.075842 0.642185
C 3.185380 0.453934 0.042587
C 2.051525 2.372022 1.411885
H -1.715525 0.815020 1.444701
H -0.774325 -1.397699 1.791970
H -3.379505 0.059097 -0.955832
H -0.469307 -2.245038 -0.854842
H -2.278023 2.076515 -1.979205
H -1.133675 2.163926 -0.593420
H -3.220272 -2.117206 1.125351
H -3.653942 0.167301 2.357721
H -3.990620 2.465461 -0.289524
H 1.038305 2.644154 1.747279
H 2.436376 3.201395 0.786801
H 2.699436 2.290231 2.306247
H 4.527496 1.946534 0.667359
H 5.211528 0.611173 -0.259682


