%chk=000250493.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000250493

0 1
O -1.277506 -0.250945 0.715802
O -0.323528 -0.968123 -1.206862
N 2.251717 -2.684028 1.153687
C 1.978456 0.659706 0.096522
C 3.104538 1.068192 1.065273
C 2.564962 0.149042 -1.231027
C 3.997274 2.141346 0.425703
C 3.451777 1.222762 -1.873581
C 4.568155 1.666902 -0.917979
C 1.051705 -0.397501 0.770737
C -2.641076 -0.349139 0.139215
C -3.516186 -0.522277 1.381847
C -2.912030 0.950025 -0.621285
C -4.997237 -0.416937 0.997647
C -4.398361 1.044203 -0.987467
C -5.291289 0.892520 0.252134
C -0.211512 -0.596035 -0.065697
C 1.715325 -1.677373 0.972857
H 1.347938 1.560396 -0.114626
H 3.718053 0.184370 1.330230
H 2.683596 1.447031 2.014337
H 1.749428 -0.143392 -1.924501
H 3.156302 -0.772352 -1.063243
H 3.419919 3.074419 0.279587
H 4.823126 2.398018 1.115880
H 3.891219 0.829935 -2.810235
H 2.837693 2.094945 -2.168643
H 5.163413 2.475202 -1.381617
H 5.270358 0.827183 -0.749800
H 0.741025 0.002399 1.784375
H -2.661394 -1.236715 -0.528179
H -3.253976 0.249994 2.132878
H -3.304439 -1.493723 1.866816
H -2.284450 0.993091 -1.532843
H -2.612135 1.817154 -0.001065
H -5.622414 -0.482033 1.908475
H -5.285612 -1.281531 0.368276
H -4.651750 0.264618 -1.732573
H -4.599284 2.013386 -1.482149
H -6.356292 0.925047 -0.045074
H -5.136809 1.752718 0.931968


%chk=000250493-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000250493

0 1
O -1.074010 -0.310488 0.841273
O -0.435411 -1.874686 -0.777145
N 2.828614 -3.014510 0.442481
C 1.893660 0.419840 0.293432
C 3.177389 0.731504 1.102217
C 2.186843 0.386542 -1.226576
C 3.833747 2.050768 0.628002
C 2.846168 1.706473 -1.697008
C 4.128356 2.016902 -0.890270
C 1.228702 -0.914418 0.814129
C -2.497192 -0.336672 0.339174
C -3.377131 0.081705 1.523515
C -2.644530 0.607651 -0.865950
C -4.862431 0.147027 1.084143
C -4.129398 0.666529 -1.307991
C -5.049415 1.083031 -0.134753
C -0.157484 -1.124676 0.181707
C 2.097452 -2.085613 0.596506
H 1.150073 1.218512 0.496912
H 3.899412 -0.100591 0.975869
H 2.938695 0.792225 2.183068
H 1.256728 0.199889 -1.796866
H 2.867616 -0.461189 -1.444799
H 3.154772 2.900614 0.849151
H 4.765926 2.229508 1.197488
H 3.078083 1.640194 -2.777207
H 2.126196 2.542760 -1.575515
H 4.561137 2.982035 -1.216900
H 4.888292 1.235865 -1.097896
H 1.075124 -0.794524 1.904570
H -2.713520 -1.377178 0.026855
H -3.047658 1.077019 1.881278
H -3.245606 -0.629936 2.359317
H -2.005242 0.260468 -1.697644
H -2.303013 1.619433 -0.569512
H -5.483810 0.488764 1.933140
H -5.214325 -0.871569 0.820648
H -4.440266 -0.329683 -1.684161
H -4.236035 1.372154 -2.153196
H -6.107229 1.076436 -0.460059
H -4.810580 2.124385 0.164372


