%chk=000279594.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000279594

0 1
O 4.371369 2.971828 -0.608502
O -0.869304 -2.693355 -0.975647
N 3.204007 -0.770851 0.685579
N -1.077834 1.943739 0.054169
N -3.786255 1.752122 0.612705
C 3.142521 -1.262361 -0.731263
C 4.052930 -1.675752 1.528450
C 2.506715 -2.661756 -0.760905
C 3.432668 -3.084109 1.538863
C 3.295678 -3.641783 0.116141
C 3.708081 0.641546 0.745456
C 2.649548 1.584322 0.231487
C 1.292624 1.335196 0.424055
C 3.014722 2.763317 -0.459478
C 0.321178 2.204214 -0.112003
C 2.063666 3.659688 -0.957717
C 0.706665 3.372516 -0.792203
C -1.683854 0.698487 -0.075053
C -3.113987 0.602168 0.235195
C -3.764678 -0.661405 0.138362
C -1.014728 -0.443119 -0.495748
C -1.705982 -1.679561 -0.568057
C -3.048379 -1.818535 -0.261648
C -5.162904 -0.705114 0.460762
C -5.815394 0.439650 0.837535
C -5.081485 1.669126 0.900549
C -1.425870 -4.025422 -1.097462
H 4.139702 -1.285019 -1.220285
H 2.513327 -0.554363 -1.313765
H 4.066845 -1.270042 2.562936
H 5.106913 -1.726644 1.181402
H 1.454046 -2.597304 -0.405997
H 2.455918 -3.024832 -1.802632
H 4.047579 -3.756745 2.162439
H 2.431858 -3.036803 2.014482
H 2.788658 -4.623427 0.140864
H 4.296328 -3.821390 -0.319776
H 4.661138 0.797509 0.187339
H 3.921912 0.900523 1.809268
H 0.992097 0.441093 0.987094
H 2.369070 4.563394 -1.477104
H -0.041995 4.051278 -1.197702
H -1.674823 2.749624 0.269934
H 4.558907 3.795749 -1.118737
H 0.037390 -0.432816 -0.780315
H -3.562879 -2.767314 -0.317272
H -5.682984 -1.659876 0.397743
H -6.873498 0.439572 1.088673
H -5.588012 2.594036 1.196038
H -2.214900 -4.037817 -1.854882
H -1.788057 -4.374219 -0.125967
H -0.553657 -4.605160 -1.425101


%chk=000279594-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000279594

0 1
O 4.369105 3.303999 -0.186131
O -1.180026 -3.077976 -0.591864
N 3.406307 -0.769226 0.548832
N -1.079008 1.751585 -0.013683
N -3.714671 1.832375 0.300459
C 3.397489 -1.232036 -0.863785
C 4.215367 -1.663876 1.412567
C 2.835561 -2.663540 -0.980272
C 3.674774 -3.108272 1.368946
C 3.636521 -3.635690 -0.083899
C 3.804212 0.653245 0.668789
C 2.695282 1.614681 0.250649
C 1.342243 1.219965 0.308673
C 3.002081 2.936587 -0.159246
C 0.291077 2.098634 -0.064154
C 1.968723 3.837290 -0.506800
C 0.624421 3.420486 -0.469324
C -1.714400 0.518822 -0.065882
C -3.163871 0.581694 0.110449
C -3.948697 -0.627726 0.067398
C -1.125139 -0.733304 -0.303963
C -1.927126 -1.914677 -0.344544
C -3.316630 -1.891423 -0.154944
C -5.362541 -0.477163 0.253973
C -5.912817 0.793265 0.454122
C -5.049819 1.930876 0.466333
C -1.907322 -4.346553 -0.662223
H 4.435116 -1.207679 -1.292777
H 2.784336 -0.528439 -1.455809
H 4.177505 -1.275607 2.448142
H 5.293589 -1.669614 1.097727
H 1.771595 -2.666412 -0.673638
H 2.875730 -2.985608 -2.039013
H 4.308203 -3.756911 2.004882
H 2.651293 -3.116619 1.791369
H 3.193947 -4.649515 -0.116409
H 4.674229 -3.721691 -0.469353
H 4.726648 0.889593 0.086634
H 4.058099 0.846137 1.730914
H 1.152659 0.211269 0.682144
H 2.210021 4.862238 -0.818545
H -0.170333 4.116245 -0.762352
H -1.767493 2.515294 0.076810
H 4.471084 4.227595 -0.524644
H -0.058414 -0.852078 -0.492898
H -3.924456 -2.800215 -0.176168
H -6.002833 -1.366982 0.234521
H -6.989388 0.928644 0.597668
H -5.453763 2.938789 0.613363
H -2.653274 -4.336183 -1.480584
H -2.412127 -4.572591 0.297165
H -1.140467 -5.107903 -0.867328


