%chk=000217830.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000217830

0 1
O 4.706899 0.799995 1.292975
O 3.699443 2.096378 -0.223707
N -2.268232 -0.884834 0.048485
C -4.632493 -0.148571 0.116215
C -3.180006 0.278525 -0.141126
C 3.429907 -0.374974 -0.315164
C 1.928434 -0.465187 -0.189340
C -0.871521 -0.682570 0.012173
C -5.597011 1.019183 -0.132189
C 1.348660 -1.560870 0.468687
C 1.096143 0.520927 -0.741592
C -0.033222 -1.675196 0.577603
C -0.288714 0.424587 -0.644400
C 3.892780 -0.551708 -1.763054
C -7.045923 0.612755 0.123796
C 3.903529 0.979319 0.186650
H -4.751406 -0.517914 1.153139
H -4.897281 -1.001721 -0.541266
H -3.067330 0.634557 -1.191874
H -2.902263 1.128885 0.521796
H 3.911387 -1.169568 0.319525
H -5.490385 1.381807 -1.174112
H -5.329704 1.876628 0.516839
H -2.594085 -1.551107 0.748637
H 1.983382 -2.333427 0.903895
H 1.544106 1.384056 -1.243504
H -0.465031 -2.532141 1.086321
H -0.909680 1.198280 -1.085887
H 3.493827 -1.484373 -2.183433
H 3.540168 0.266584 -2.406271
H 4.985235 -0.590500 -1.839879
H -7.729478 1.449978 -0.059977
H -7.357062 -0.211377 -0.528860
H -7.199852 0.286877 1.158895
H 5.041681 1.654118 1.672201


%chk=000217830-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000217830

0 1
O 4.590210 0.555258 1.495833
O 4.090535 1.983603 -0.262696
N -2.238263 -0.679389 0.347276
C -4.639504 -0.087885 0.213377
C -3.193061 0.330910 -0.115346
C 3.506514 -0.427882 -0.436865
C 1.987456 -0.468427 -0.209267
C -0.858960 -0.596035 0.163991
C -5.678979 0.950769 -0.264327
C 1.386810 -1.563077 0.463257
C 1.141415 0.566982 -0.679514
C -0.005870 -1.634215 0.646934
C -0.254736 0.513567 -0.501218
C 3.882221 -0.458784 -1.940088
C -7.129435 0.531214 0.056130
C 4.074906 0.827718 0.218254
H -4.741751 -0.230704 1.309295
H -4.854168 -1.067302 -0.261993
H -3.094856 0.476594 -1.213529
H -2.978645 1.314661 0.357960
H 3.956085 -1.294568 0.078083
H -5.569386 1.100734 -1.357405
H -5.462293 1.929504 0.209349
H -2.609185 -1.489400 0.842669
H 2.018692 -2.372747 0.849150
H 1.580869 1.437947 -1.180660
H -0.444278 -2.495820 1.167046
H -0.874429 1.335217 -0.873431
H 3.443567 -1.353151 -2.414998
H 3.496868 0.437268 -2.455227
H 4.978632 -0.486110 -2.077869
H -7.854028 1.287587 -0.296156
H -7.381047 -0.430022 -0.430149
H -7.275473 0.405403 1.145493
H 4.898469 1.407980 1.908839


