%chk=000294463.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000294463

0 1
O -3.591003 0.153836 0.976581
O -4.183053 1.876657 -1.657415
O -4.014319 -1.626332 -1.791360
O -6.727728 -1.562918 0.988939
N -1.445428 0.136516 0.012161
N 0.109578 -1.556509 -0.116852
N 0.063765 1.964016 0.839606
N 3.041902 -1.058350 0.740338
N 2.378223 1.208558 1.124814
N 8.970256 0.175231 -1.112793
C -3.436346 0.698165 -1.364847
C -2.752031 0.818446 0.029252
C -4.496173 -0.420331 -1.190936
C -4.547977 -0.727990 0.322876
C -5.890532 -0.407248 0.996132
C -0.227790 0.682156 0.446413
C -1.172428 -1.244235 -0.303063
C 0.731789 -0.382685 0.351567
C 2.078782 -0.083364 0.729555
C 4.470437 -0.779274 1.015059
C 5.247570 -0.532269 -0.288929
C 1.375445 2.139467 1.162025
C 6.735080 -0.307989 -0.002358
C 7.518224 -0.065850 -1.307555
H -2.721113 0.487107 -2.187261
H -2.641614 1.862413 0.419402
H -5.471152 -0.126171 -1.631422
H -4.223150 -1.773925 0.537371
H -5.737659 -0.206581 2.079732
H -6.410722 0.452464 0.541100
H -3.581388 2.629935 -1.853777
H -4.168627 -1.622468 -2.760438
H -1.963615 -1.898651 -0.660782
H -6.999358 -1.790708 0.076204
H 2.801995 -1.977324 0.366464
H 4.886707 -1.650626 1.568666
H 4.559227 0.107940 1.689387
H 5.115900 -1.383397 -0.984523
H 4.822748 0.352018 -0.808541
H 1.673920 3.150486 1.489841
H 6.860050 0.557316 0.677972
H 7.155676 -1.179997 0.533826
H 7.404816 -0.936824 -1.991125
H 7.095467 0.808525 -1.851799
H 9.127842 0.996000 -0.536224
H 9.408907 -0.608936 -0.640381


%chk=000294463-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000294463

0 1
O -3.792224 -1.047312 0.821039
O -2.817300 2.221434 -0.570883
O -5.004038 0.612642 -2.222347
O -6.895578 -1.473662 -1.282218
N -1.477099 -0.389054 0.941932
N 0.318085 -1.668082 1.575449
N -0.257344 1.636309 0.134771
N 3.182221 -0.567195 1.259854
N 2.172918 1.391414 0.358290
N 8.827343 -0.250127 -1.749943
C -3.078375 0.806645 -0.590364
C -2.865084 0.091878 0.779491
C -4.560552 0.500871 -0.835450
C -4.673342 -0.972334 -0.394773
C -6.099930 -1.412772 -0.051714
C -0.338422 0.374159 0.671079
C -1.025830 -1.601844 1.490446
C 0.757057 -0.431461 1.068802
C 2.063398 0.124184 0.895859
C 4.558225 -0.071321 1.086689
C 5.257696 -0.640913 -0.170406
C 1.038470 2.062574 0.017930
C 6.709593 -0.129025 -0.304831
C 7.438740 -0.704360 -1.551824
H -2.472002 0.278890 -1.360369
H -3.104372 0.784415 1.610954
H -5.170361 1.155817 -0.176428
H -4.263635 -1.626166 -1.190071
H -6.108310 -2.430793 0.370224
H -6.541900 -0.714244 0.690375
H -1.811441 2.305627 -0.383588
H -4.840657 1.538984 -2.533918
H -1.722457 -2.381798 1.783248
H -6.656907 -0.696535 -1.858782
H 3.029200 -1.510928 1.624045
H 5.140744 -0.331626 1.991746
H 4.501708 1.027814 1.016026
H 5.256684 -1.749784 -0.128120
H 4.671254 -0.353139 -1.064587
H 1.180893 3.062174 -0.402592
H 6.710842 0.979165 -0.366974
H 7.289404 -0.395947 0.604214
H 7.444134 -1.810516 -1.491182
H 6.860248 -0.447502 -2.460610
H 8.920155 0.748380 -1.959435
H 9.479251 -0.548640 -1.018153


