%chk=000258956.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000258956

0 1
O 1.780830 1.578302 -0.392521
O -3.543488 2.007764 0.337905
O -4.497137 0.173667 -0.829792
O 0.650190 3.413351 0.287960
N 0.946255 -2.590048 0.063232
C 1.632332 -1.265035 -0.049063
C 0.877257 -0.287686 0.865806
C 3.037829 -1.550177 0.416211
C 1.719676 0.995440 0.959755
C 1.971897 -3.605657 -0.351173
C 3.330850 -2.993326 0.103451
C -0.543837 -0.187053 0.357857
C -0.347278 -2.549902 -0.670497
C 3.194971 0.746338 1.340033
C -1.109195 -1.276566 -0.334388
C 3.753837 -0.619778 1.048534
C -1.299386 0.981084 0.634315
C -2.457369 -1.244084 -0.781638
C -2.601697 0.995064 0.196065
C -3.174741 -0.105849 -0.504237
C 1.181779 2.797258 -0.607885
C -4.767057 1.512596 -0.296455
C 1.325716 3.165818 -2.042278
H 1.660323 -0.849785 -1.092362
H 0.822172 -0.725619 1.903962
H 1.254387 1.743166 1.643360
H 1.977450 -3.825272 -1.435099
H 1.749636 -4.548154 0.186278
H 4.098741 -3.090777 -0.682836
H 3.717845 -3.518498 0.995705
H -0.936301 -3.437040 -0.337076
H -0.238240 -2.626030 -1.776457
H 3.321337 0.955897 2.423751
H 3.815603 1.503668 0.808116
H 4.768794 -0.787607 1.396963
H -0.867179 1.835622 1.159229
H -2.900731 -2.081049 -1.313211
H -4.998236 2.171248 -1.143385
H -5.535775 1.416425 0.481346
H 0.341231 3.170727 -2.538562
H 1.972343 2.465111 -2.593891
H 1.746666 4.177743 -2.146926


%chk=000258956-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000258956

0 1
O 1.826897 1.571711 -0.512464
O -3.627190 2.032577 0.306667
O -4.593254 0.145013 -0.816506
O 0.957511 3.625293 0.196958
N 0.958620 -2.598919 0.014174
C 1.637144 -1.287991 -0.039581
C 0.891523 -0.270417 0.822592
C 3.024155 -1.590361 0.471682
C 1.733327 1.019511 0.885643
C 1.972998 -3.584606 -0.439059
C 3.297697 -3.074322 0.217308
C -0.556208 -0.172082 0.336386
C -0.330946 -2.557396 -0.688155
C 3.173526 0.750393 1.402728
C -1.132331 -1.294480 -0.335243
C 3.734026 -0.643139 1.128890
C -1.341594 0.990827 0.599879
C -2.496443 -1.265039 -0.748913
C -2.672595 0.985445 0.189296
C -3.241459 -0.121972 -0.471103
C 1.390223 2.886746 -0.717847
C -4.910935 1.427168 -0.131507
C 1.496581 3.252155 -2.181770
H 1.688142 -0.896335 -1.090292
H 0.888235 -0.681497 1.855123
H 1.260246 1.801907 1.505100
H 2.076315 -3.585027 -1.554773
H 1.702895 -4.607301 -0.121931
H 4.167739 -3.247801 -0.442134
H 3.492327 -3.600561 1.169299
H -0.922961 -3.455928 -0.427725
H -0.189140 -2.577450 -1.803961
H 3.184257 0.921590 2.499648
H 3.835900 1.529405 0.976000
H 4.729130 -0.859371 1.541611
H -0.916823 1.868107 1.095414
H -2.946242 -2.117229 -1.267640
H -5.401310 2.103692 -0.847980
H -5.532697 1.214008 0.759276
H 0.635206 2.823962 -2.726268
H 2.414683 2.834836 -2.624996
H 1.475125 4.346177 -2.293725


