%chk=000229446.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000229446

0 1
O 0.493588 -0.320962 2.928957
O 0.268012 3.604620 0.494574
O -3.448855 -0.319291 -2.948023
N 0.160722 1.355870 -0.201476
N 0.466549 1.819099 2.018420
N -1.992234 -0.425953 -0.617975
N -3.224071 -1.000977 -0.704542
N -5.226577 -1.367594 -1.930058
C 0.119105 0.027753 0.478147
C 1.201216 -0.918629 -0.071116
C 2.624910 -0.373017 0.089803
C 3.655030 -1.342111 -0.505155
C 0.389733 0.407826 1.977813
C -1.237214 -0.659433 0.413783
C 5.083496 -0.801375 -0.348699
C 0.272376 2.420299 0.716101
C 6.115611 -1.757907 -0.941023
C -3.922205 -0.823801 -1.957559
H 1.114888 -1.899980 0.440402
H 0.992052 -1.112197 -1.145094
H 2.709483 0.616042 -0.405267
H 2.850282 -0.199018 1.160509
H 3.574643 -2.331642 -0.015084
H 3.437731 -1.517064 -1.576761
H -0.276306 1.469634 -1.115702
H -1.437576 -1.328177 1.262699
H 5.167480 0.188848 -0.838675
H 5.306159 -0.628252 0.722658
H 0.659306 2.366354 2.852490
H 6.087096 -2.738020 -0.451524
H 7.131748 -1.363783 -0.825217
H 5.948430 -1.920988 -2.011872
H -3.553883 -1.688152 -0.016475
H -5.805714 -1.158371 -2.738212
H -5.744613 -1.455652 -1.070445


%chk=000229446-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000229446

0 1
O 0.421218 -0.340317 2.935570
O 0.300109 3.623991 0.380643
O -3.723761 0.133339 -2.817675
N 0.099816 1.321536 -0.220770
N 0.502020 1.817535 1.936717
N -2.044490 -0.347187 -0.630847
N -3.249646 -0.988892 -0.788177
N -5.299984 -1.307094 -1.872377
C 0.088507 0.022865 0.471534
C 1.218572 -0.946432 -0.014924
C 2.648050 -0.381020 0.118184
C 3.705838 -1.340899 -0.471944
C 0.350700 0.435631 1.952203
C -1.258863 -0.679660 0.357095
C 5.149689 -0.806997 -0.330430
C 0.295958 2.398534 0.632797
C 6.204144 -1.764930 -0.925080
C -4.070060 -0.651945 -1.902675
H 1.129820 -1.882361 0.570843
H 1.003710 -1.196087 -1.072587
H 2.706995 0.597222 -0.397763
H 2.881268 -0.200056 1.186845
H 3.631354 -2.328336 0.029883
H 3.486086 -1.518374 -1.545614
H -0.354854 1.438572 -1.128198
H -1.462358 -1.469396 1.105329
H 5.222667 0.181529 -0.827668
H 5.369408 -0.632512 0.742539
H 0.692389 2.394289 2.756828
H 6.170857 -2.751474 -0.425009
H 7.227059 -1.362105 -0.809414
H 6.026210 -1.929977 -2.004635
H -3.542142 -1.726522 -0.131057
H -5.926403 -1.131733 -2.654288
H -5.639483 -1.856738 -1.085477


