%chk=000239196.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000239196

0 1
O 5.284082 0.853735 -0.805183
O 5.821724 -0.843607 0.640131
O 5.302035 3.433914 0.912225
N 4.191827 -1.106853 -1.032002
C -2.578476 -0.628094 0.371715
C -3.773080 -0.196479 -0.489594
C -1.331677 -0.882402 -0.486282
C -5.019703 0.058163 0.368529
C -0.137875 -1.314264 0.375852
C -6.214722 0.489686 -0.492298
C 1.109510 -1.568653 -0.481736
C -7.460977 0.744358 0.365952
C 2.301326 -1.997039 0.382226
C -8.657393 1.176159 -0.493769
C 3.553916 -2.314368 -0.446048
C -9.900657 1.431112 0.355552
C 5.144785 -0.427261 -0.276114
C 6.409088 1.638430 -0.312892
C 6.078808 2.239750 1.052232
H -2.362062 0.148837 1.130324
H -2.836728 -1.541456 0.941718
H -1.075397 0.031866 -1.055696
H -1.550088 -1.658783 -1.244839
H -3.991094 -0.973038 -1.247933
H -3.516196 0.717317 -1.059424
H -4.802782 0.835168 1.126800
H -5.277593 -0.855065 0.938773
H -0.397233 -2.227597 0.945790
H 0.077740 -0.537664 1.135313
H -5.957538 1.403269 -1.062272
H -6.432465 -0.287070 -1.250466
H 0.891292 -2.347911 -1.238082
H 1.360356 -0.654207 -1.052495
H -7.245250 1.521118 1.124528
H -7.719859 -0.168036 0.936724
H 2.030764 -2.895007 0.974923
H 2.530410 -1.214170 1.132861
H -8.400648 2.090497 -1.063747
H -8.876029 0.398887 -1.251926
H 4.306185 -2.842998 0.189498
H 3.311160 -2.997498 -1.292016
H -10.205350 0.533200 0.905038
H -9.730206 2.223726 1.092970
H -10.748792 1.738674 -0.266240
H 3.617870 -0.562171 -1.677374
H 6.494886 2.408848 -1.103897
H 7.311060 1.001570 -0.283215
H 5.543538 1.517990 1.698520
H 6.988923 2.595758 1.574555
H 4.451387 3.230659 0.467895


%chk=000239196-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000239196

0 1
O 5.635705 0.783472 -0.792481
O 5.977478 -1.020537 0.702777
O 5.578123 3.471032 0.401183
N 4.187486 -0.971932 -0.825783
C -2.669731 -0.596098 0.410071
C -3.858246 -0.061876 -0.420928
C -1.362032 -0.716161 -0.404702
C -5.167064 0.067447 0.390504
C -0.190919 -1.321754 0.401106
C -6.367459 0.542038 -0.459707
C 1.117989 -1.433175 -0.413388
C -7.677933 0.676789 0.348213
C 2.269521 -2.089383 0.380479
C -8.883050 1.122100 -0.511824
C 3.578310 -2.252268 -0.426952
C -10.188633 1.256157 0.301604
C 5.310973 -0.474312 -0.213500
C 6.854071 1.441384 -0.240160
C 6.452531 2.396571 0.885789
H -2.500411 0.069717 1.281945
H -2.934425 -1.591072 0.825851
H -1.071254 0.287246 -0.780685
H -1.548605 -1.342063 -1.302777
H -4.030094 -0.737505 -1.285184
H -3.592996 0.927682 -0.848919
H -5.010088 0.774219 1.232010
H -5.411042 -0.913371 0.850356
H -0.481043 -2.329816 0.764667
H -0.007542 -0.706410 1.306358
H -6.123197 1.519230 -0.927009
H -6.525441 -0.170741 -1.296299
H 0.924609 -2.022606 -1.335055
H 1.420560 -0.417416 -0.744425
H -7.528967 1.404475 1.173376
H -7.913662 -0.295150 0.830733
H 1.951099 -3.097390 0.716652
H 2.482742 -1.501369 1.294690
H -8.646135 2.091700 -0.995936
H -9.030896 0.392633 -1.334336
H 4.332285 -2.785608 0.176968
H 3.385232 -2.852094 -1.338399
H -10.464469 0.292226 0.769838
H -10.075296 2.000983 1.111995
H -11.033638 1.576217 -0.335623
H 3.767930 -0.411648 -1.568060
H 7.272086 1.993759 -1.097025
H 7.555547 0.668111 0.119620
H 5.974740 1.825630 1.708298
H 7.348453 2.905347 1.281041
H 4.829599 3.046590 -0.091862


