%chk=000287711.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000287711

0 1
O 2.684385 0.784580 -1.100095
O 3.884985 -2.084696 -0.425700
O 5.175735 -0.334178 0.843927
O 1.892927 3.096616 -0.008727
N 0.708028 -0.370193 -0.541609
N 0.199976 -2.731352 0.014449
N -2.021733 2.962862 -0.356103
N -3.662546 1.396063 0.135505
N -2.128627 -3.134284 0.608285
N -3.765681 -1.468798 0.698812
C 2.136336 -0.521957 -0.915434
C 2.952190 -1.215681 0.215131
C 3.786679 -0.081464 0.878381
C 3.452416 1.196942 0.064465
C 2.625350 2.218888 0.855290
C -0.151901 -1.409877 -0.151045
C -0.039609 0.824726 -0.579175
C -1.353523 0.561322 -0.202867
C -1.457009 -0.854202 0.064238
C -2.383824 1.583666 -0.106025
C -2.466239 -1.794369 0.451315
C -3.253046 3.778343 -0.091553
C -4.355575 2.710717 0.171425
C -0.840997 -3.524154 0.390196
H 2.231584 -1.024553 -1.910325
H 2.328653 -1.777537 0.941719
H 3.568104 0.027895 1.963901
H 4.366249 1.647950 -0.384574
H 3.272667 2.841673 1.502710
H 1.828312 1.751045 1.466658
H 0.430199 1.763166 -0.864640
H 3.595146 -3.022642 -0.324581
H 5.418990 -0.892356 0.053054
H -1.162630 3.310401 0.065094
H -3.469133 4.377164 -0.999816
H -3.129367 4.475878 0.755526
H 2.378995 3.242617 -0.850772
H -4.854162 2.839779 1.151452
H -5.142188 2.730184 -0.609715
H -0.626819 -4.596422 0.533470
H -4.113118 -0.515445 0.552152
H -4.431079 -2.189018 0.937696


%chk=000287711-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000287711

0 1
O 2.521674 1.247465 -0.542377
O 2.895190 -2.276228 0.410019
O 4.926981 -0.942061 -0.628497
O 3.772004 3.635641 0.617408
N 0.571035 -0.074531 -0.269556
N 0.274065 -2.480744 0.166339
N -2.671957 2.877247 -0.364996
N -4.021542 1.062663 -0.012274
N -2.050481 -3.155425 0.490478
N -3.845916 -1.624651 0.400957
C 2.021575 -0.120918 -0.519662
C 2.813865 -0.849265 0.603241
C 4.221834 -0.224048 0.428404
C 3.939282 1.224233 -0.039098
C 4.099897 2.279601 1.062776
C -0.205004 -1.204110 -0.009525
C -0.267634 1.036869 -0.369934
C -1.598362 0.632318 -0.166485
C -1.566162 -0.803890 0.058776
C -2.772984 1.501034 -0.171647
C -2.513492 -1.857619 0.319482
C -3.999246 3.512451 -0.199048
C -4.931905 2.247961 -0.119810
C -0.717747 -3.391841 0.410575
H 2.209776 -0.628128 -1.489566
H 2.381876 -0.571199 1.587385
H 4.803062 -0.256499 1.371422
H 4.595883 1.453499 -0.901109
H 5.143245 2.226032 1.445480
H 3.403328 2.086535 1.895709
H 0.170033 2.010577 -0.575654
H 1.906707 -2.603706 0.303587
H 4.580926 -1.881115 -0.577503
H -1.797954 3.396900 -0.334576
H -4.247745 4.163920 -1.055276
H -4.041502 4.118478 0.727530
H 4.306917 3.851391 -0.188531
H -5.612029 2.285070 0.748832
H -5.552859 2.146942 -1.029813
H -0.397802 -4.427080 0.560940
H -4.180433 -0.624506 0.261697
H -4.457299 -2.419964 0.585996


