%chk=000209268.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000209268

0 1
O -2.988265 2.192135 0.014141
O 3.096669 0.224021 0.298060
N -5.091065 -0.490648 -0.915928
N -2.345273 0.210934 -0.969317
C -4.713117 0.935148 -1.156251
C -6.309797 -0.872083 -1.703071
C -5.150163 -0.899797 0.519255
C -5.660547 2.001714 -0.609425
C -3.284285 1.189529 -0.609634
C -6.399670 -2.392578 -1.834904
C -6.384145 -0.486932 1.322258
C -0.953503 0.211084 -0.628118
C -0.336827 1.301299 0.027042
C -0.195693 -0.918288 -0.984202
C 1.765950 0.117152 -0.051433
C 1.018067 1.256977 0.316113
C 1.172354 -0.970724 -0.697750
C 3.969963 -0.902150 -0.018324
C 5.340715 -0.487194 0.442652
C 5.674462 0.866361 0.582553
C 6.297030 -1.478236 0.712056
C 6.961190 1.227458 0.991801
C 7.582993 -1.109651 1.114912
C 7.917019 0.241750 1.255821
H -4.644518 1.065376 -2.275517
H -7.246550 -0.471529 -1.257275
H -6.222238 -0.421688 -2.717547
H -4.236170 -0.517680 1.028185
H -5.062291 -2.011716 0.522910
H -5.220478 3.005884 -0.705358
H -6.619974 1.998685 -1.133700
H -5.860888 1.858692 0.464787
H -7.166771 -2.675496 -2.564035
H -6.653027 -2.873317 -0.883124
H -5.446282 -2.820692 -2.170678
H -6.324306 -0.865453 2.348996
H -7.310653 -0.873171 0.884542
H -6.476905 0.608372 1.383364
H -2.692767 -0.640813 -1.427435
H -0.931286 2.180249 0.308769
H -0.662120 -1.763801 -1.486988
H 1.516514 2.082403 0.822191
H 1.742245 -1.849037 -0.980842
H 3.595056 -1.792183 0.519306
H 3.947580 -1.069118 -1.112135
H 4.920531 1.629955 0.379361
H 6.043481 -2.531074 0.610532
H 7.217670 2.279767 1.104241
H 8.326364 -1.877542 1.322203
H 8.919019 0.524649 1.572040


%chk=000209268-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000209268

0 1
O -3.122920 2.788176 -0.295759
O 3.063270 0.410855 0.333331
N -5.011458 -0.331878 -0.861268
N -2.514096 0.530378 -0.636363
C -4.853273 1.148654 -0.984784
C -5.853495 -0.962183 -1.911978
C -5.215751 -0.856352 0.523399
C -5.892656 2.050287 -0.276369
C -3.406170 1.583350 -0.580540
C -5.607300 -2.477457 -2.044216
C -6.674230 -0.957725 1.041053
C -1.116548 0.518114 -0.394204
C -0.381748 1.690812 -0.056647
C -0.431919 -0.719249 -0.491555
C 1.680126 0.367489 0.075483
C 1.001706 1.606557 0.174379
C 0.957319 -0.804020 -0.259505
C 3.809658 -0.848969 0.223493
C 5.280430 -0.569787 0.470210
C 5.846711 0.696903 0.187876
C 6.114318 -1.609717 0.950948
C 7.229744 0.915703 0.378098
C 7.498465 -1.393122 1.133579
C 8.061255 -0.127967 0.846551
H -4.916692 1.368080 -2.071582
H -6.941260 -0.780402 -1.744855
H -5.596324 -0.475341 -2.871848
H -4.624447 -0.217387 1.205300
H -4.760910 -1.865317 0.577024
H -5.644213 3.106141 -0.474038
H -6.911198 1.842421 -0.649698
H -5.874194 1.911399 0.818220
H -6.195705 -2.884017 -2.886801
H -5.906128 -3.027112 -1.133885
H -4.538297 -2.681513 -2.235707
H -6.665826 -1.353163 2.073923
H -7.278318 -1.650384 0.427324
H -7.182352 0.020122 1.054737
H -3.010373 -0.349930 -0.876146
H -0.908556 2.644185 0.020724
H -0.988075 -1.628880 -0.750577
H 1.578259 2.498909 0.437190
H 1.451158 -1.776551 -0.339801
H 3.424398 -1.585416 0.959260
H 3.659922 -1.269547 -0.795462
H 5.195351 1.503185 -0.161772
H 5.683165 -2.591206 1.187099
H 7.657987 1.901110 0.162115
H 8.132897 -2.205029 1.506584
H 9.133594 0.043793 0.992557


