%chk=000288411.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000288411

0 1
O -2.720059 -1.031021 0.062458
O -1.808503 -3.796747 -0.005020
O 3.711875 2.408283 0.271733
O -4.018128 3.444140 -0.020901
N 3.137924 0.275089 -0.225505
C 1.826875 0.476688 0.459118
C -0.536977 1.152354 0.018742
C 0.953427 1.638730 -0.091012
C 0.932796 -0.724925 0.302240
C -0.417159 -0.362900 0.148310
C 1.377133 -2.040964 0.226159
C 3.466481 -1.090892 -0.723837
C 2.863489 -2.216229 0.151089
C -1.169874 1.720121 1.269715
C -1.281719 1.509984 -1.247473
C -1.376140 -1.370544 0.082303
C 0.420712 -3.063813 0.159508
C -0.938876 -2.726577 0.122225
C 4.041095 1.349519 -0.242711
C -2.275824 2.468709 1.253539
C -2.385603 2.261218 -1.259179
C -2.994706 2.791638 -0.007579
C 5.364522 1.154345 -0.925105
C -3.382969 -1.330486 -1.199195
C -2.868122 -3.852226 0.991175
H 2.041950 0.662202 1.548029
H 1.135841 2.572710 0.469508
H 1.221375 1.875085 -1.135012
H 4.569228 -1.220922 -0.765779
H 3.076224 -1.186146 -1.764233
H 3.299178 -2.189410 1.172548
H 3.139786 -3.201335 -0.272520
H -0.652130 1.471146 2.198323
H -0.845689 1.107227 -2.163950
H 0.707982 -4.113115 0.131309
H -2.727631 2.878469 2.158111
H -2.913924 2.528384 -2.174790
H 5.254936 0.885202 -1.983322
H 5.983153 0.392366 -0.434505
H 5.935369 2.098948 -0.891975
H -2.975127 -0.688079 -1.984032
H -4.423651 -1.068026 -0.975972
H -3.275044 -2.391363 -1.447124
H -3.408834 -2.899894 1.049586
H -2.429635 -4.119370 1.956468
H -3.504127 -4.655571 0.604034


%chk=000288411-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000288411

0 1
O -2.770224 -1.056924 -0.122874
O -1.869477 -3.829223 -0.004586
O 3.730691 2.398449 0.504205
O -3.948319 3.770210 0.330484
N 3.152813 0.294343 -0.265042
C 1.784442 0.529306 0.271408
C -0.603012 1.165811 -0.119816
C 0.902992 1.601682 -0.437398
C 0.921180 -0.704440 0.173529
C -0.436370 -0.368673 0.009553
C 1.388342 -2.028880 0.160292
C 3.480220 -1.054809 -0.796650
C 2.897121 -2.192257 0.093630
C -1.043487 1.747723 1.212145
C -1.505131 1.580952 -1.258793
C -1.404484 -1.392769 -0.040011
C 0.425098 -3.061917 0.099044
C -0.954316 -2.750814 0.047296
C 4.080361 1.316416 -0.068064
C -2.112264 2.582313 1.354345
C -2.559170 2.434473 -1.121363
C -2.949055 2.988205 0.198946
C 5.508986 1.105137 -0.564638
C -3.475833 -1.532822 -1.337749
C -2.804638 -3.898918 1.145152
H 1.911155 0.841732 1.329588
H 1.122785 2.623726 -0.096774
H 1.070056 1.545038 -1.529752
H 4.575177 -1.152184 -0.856129
H 3.072988 -1.168671 -1.821722
H 3.356447 -2.133961 1.100650
H 3.175196 -3.170635 -0.339328
H -0.442955 1.463589 2.087068
H -1.241082 1.175659 -2.246442
H 0.712504 -4.118748 0.090888
H -2.398983 2.990804 2.330203
H -3.172365 2.739942 -1.977200
H 5.544273 0.805481 -1.627293
H 6.038748 0.334944 0.026870
H 6.043282 2.058987 -0.444452
H -3.057461 -1.037188 -2.233560
H -4.523969 -1.228656 -1.199416
H -3.393990 -2.629583 -1.437976
H -3.384897 -2.963735 1.240690
H -2.241452 -4.089691 2.078077
H -3.471019 -4.747421 0.928464


