%chk=000250446.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000250446

0 1
O -0.150392 0.376316 -0.301702
N 3.865393 0.677580 0.130601
N 0.404146 -1.839019 -0.706343
N -1.739321 -1.271645 0.143262
C 2.826904 -0.075840 0.905791
C 2.694609 -1.493045 0.315437
C 5.230890 0.473992 0.720848
C 3.528259 2.136197 0.017649
C 1.832934 -1.501306 -0.956672
C 6.302957 0.795599 -0.322449
C 2.382189 2.333685 -0.973291
C -0.462852 -0.803015 -0.273927
C -2.842568 -0.428161 0.499989
C -4.133798 -1.011351 0.617317
C -2.660624 0.937897 0.771651
C -5.201860 -0.199748 1.016903
C -4.381140 -2.458095 0.326786
C -3.745763 1.722724 1.164295
C -5.016384 1.158423 1.290683
H 1.842006 0.447562 0.822775
H 3.052767 -0.136349 1.990119
H 2.285483 -2.176565 1.080387
H 3.701795 -1.886129 0.066010
H 5.398172 1.078362 1.638563
H 5.328335 -0.592429 1.022339
H 3.269755 2.592388 0.997601
H 4.429389 2.672968 -0.355313
H 1.889020 -0.503374 -1.461575
H 2.214568 -2.248441 -1.686530
H 7.297029 0.505945 0.030269
H 6.327698 1.863921 -0.566628
H 6.104275 0.261965 -1.261886
H 2.141566 3.393062 -1.095600
H 1.461746 1.818196 -0.648509
H 2.635223 1.923938 -1.958389
H 0.256217 -2.781383 -0.350303
H -1.967969 -2.254963 -0.008742
H -1.670034 1.394735 0.667469
H -6.196939 -0.632796 1.114066
H -5.445624 -2.719368 0.416109
H -4.085596 -2.723283 -0.698022
H -3.843302 -3.110003 1.028802
H -3.593960 2.781435 1.371110
H -5.860402 1.771017 1.598151


%chk=000250446-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000250446

0 1
O -0.232817 0.508307 -0.771979
N 3.896928 0.612401 0.249463
N 0.412716 -1.719980 -0.477752
N -1.782233 -1.092390 0.031872
C 3.031848 -0.367924 0.960596
C 2.850907 -1.675606 0.152912
C 5.343618 0.294132 0.397823
C 3.580728 2.026186 0.611678
C 1.791839 -1.545355 -0.969386
C 6.203348 0.864535 -0.746545
C 2.396485 2.599747 -0.188389
C -0.516826 -0.679800 -0.430726
C -2.944494 -0.298954 0.246756
C -4.106298 -0.965418 0.756114
C -2.980929 1.095134 -0.022719
C -5.275405 -0.203653 0.981345
C -4.092401 -2.457413 1.050783
C -4.164799 1.824062 0.215367
C -5.319072 1.184160 0.717878
H 2.038969 0.092928 1.115097
H 3.437534 -0.603283 1.977396
H 2.566057 -2.504932 0.833594
H 3.818292 -1.960869 -0.303297
H 5.739789 0.649088 1.384153
H 5.453131 -0.806882 0.401865
H 3.382991 2.119436 1.709140
H 4.479133 2.638146 0.408558
H 1.858381 -0.541787 -1.422814
H 1.981409 -2.292292 -1.765248
H 7.266132 0.588952 -0.609318
H 6.146007 1.967029 -0.793395
H 5.854569 0.468360 -1.716264
H 2.162469 3.626217 0.154336
H 1.485815 1.984716 -0.089442
H 2.648588 2.637229 -1.263159
H 0.152721 -2.650914 -0.146848
H -1.895324 -2.085548 0.239603
H -2.085823 1.580710 -0.414844
H -6.166091 -0.711411 1.371369
H -5.072334 -2.785333 1.434875
H -3.884518 -3.063578 0.144622
H -3.339216 -2.727320 1.819754
H -4.179476 2.899042 0.002971
H -6.237549 1.751722 0.901306


