%chk=000250731.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000250731

0 1
I 1.030988 -3.638726 0.398227
O -0.075716 2.326823 -0.593948
O 2.957278 -1.072233 0.015949
N 1.479746 0.627122 -0.291048
N -0.902849 0.198611 -0.355496
N -1.776992 -2.023935 -0.142619
C 0.191202 1.152771 -0.416105
C 2.616496 1.610894 -0.303041
C -0.676435 -1.178414 -0.138657
C -2.278075 0.751761 -0.544339
C 1.784547 -0.787986 -0.067293
C 0.622690 -1.636808 0.014872
C 2.803088 2.252187 1.065792
C -3.069794 0.719302 0.732984
C -4.368778 0.434037 0.770437
H 3.536131 1.054609 -0.608330
H 2.405901 2.382971 -1.077720
H -2.180809 1.824912 -0.879763
H -2.778023 0.217821 -1.383963
H 1.918506 2.826746 1.370258
H 2.997794 1.501201 1.842843
H 3.655846 2.942006 1.058873
H -2.504014 0.980797 1.631843
H -2.710421 -1.672287 0.013549
H -1.628716 -3.005743 0.096270
H -4.948091 0.448681 1.685369
H -4.965800 0.186581 -0.096442


%chk=000250731-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000250731

0 1
I 1.019656 -3.670721 0.364387
O -0.068246 2.420077 -0.536235
O 2.996265 -1.086900 0.008669
N 1.457863 0.663757 -0.265593
N -0.901949 0.244519 -0.272830
N -1.792432 -1.935264 0.016055
C 0.170017 1.187627 -0.363851
C 2.595315 1.625633 -0.338405
C -0.680296 -1.127409 -0.062735
C -2.269709 0.778837 -0.516477
C 1.783509 -0.734983 -0.071355
C 0.630760 -1.604432 0.028756
C 2.950341 2.201585 1.045131
C -3.185035 0.699480 0.690990
C -4.476887 0.285223 0.639148
H 3.448073 1.064848 -0.752655
H 2.299386 2.429641 -1.031365
H -2.106642 1.840416 -0.781701
H -2.715505 0.266537 -1.389849
H 2.098295 2.759142 1.470883
H 3.242883 1.395708 1.739736
H 3.802690 2.898462 0.949900
H -2.751973 1.051071 1.638057
H -2.714119 -1.545359 0.214255
H -1.638588 -2.935563 0.147757
H -5.118294 0.303003 1.526122
H -4.939680 -0.051231 -0.298292


