%chk=000250227.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000250227

0 1
O -0.592315 2.636815 -0.775858
O -1.099672 -2.430786 0.907720
O 2.386881 -1.353239 -1.376981
N 1.590672 1.489543 0.152858
N 1.426757 -1.513282 0.714070
C -2.079607 0.858192 -0.269099
C 0.478031 0.703988 0.097460
C -2.201936 -0.474834 0.159187
C 0.327862 -0.626914 0.422147
C -0.751849 1.506863 -0.361787
C -0.988015 -1.276907 0.523817
C -3.222025 1.589533 -0.619062
C -3.464537 -1.067217 0.238986
C 2.952863 1.022299 0.506451
C -4.485460 0.991220 -0.536754
C -4.606256 -0.332271 -0.108796
C 2.233499 -1.991171 -0.351733
C 3.821219 2.204602 0.839093
C 2.978281 -3.261081 -0.045943
C 5.068308 2.329493 0.392589
H 1.540038 2.423917 -0.275551
H -3.116548 2.624983 -0.956251
H -3.546916 -2.107001 0.572911
H 1.186732 -2.184290 1.458310
H 2.903385 0.339391 1.391486
H 3.368642 0.417483 -0.342294
H -5.373338 1.562268 -0.809495
H -5.589911 -0.799586 -0.045243
H 3.366157 2.945462 1.500505
H 3.520881 -3.222618 0.906618
H 2.300914 -4.126854 -0.010488
H 3.717377 -3.466851 -0.836836
H 5.549898 1.618061 -0.265583
H 5.708990 3.161090 0.654744


%chk=000250227-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000250227

0 1
O -0.418947 2.483050 -1.195538
O -1.146406 -2.394346 1.186775
O 2.592478 -1.502655 -1.463278
N 1.732551 1.219248 -0.338026
N 1.349574 -1.766080 0.505981
C -1.997974 0.847148 -0.380878
C 0.564310 0.525464 -0.205939
C -2.178235 -0.397453 0.283361
C 0.346958 -0.782407 0.259701
C -0.628857 1.354272 -0.643474
C -0.997127 -1.251079 0.612857
C -3.121213 1.625922 -0.748153
C -3.481800 -0.849495 0.583065
C 3.059176 0.933006 0.240325
C -4.422706 1.167479 -0.450774
C -4.601848 -0.068538 0.217136
C 2.336069 -2.158474 -0.413601
C 3.554465 2.131151 1.030669
C 3.063784 -3.442993 -0.024311
C 4.718815 2.778010 0.775582
H 1.618049 2.119916 -0.825795
H -2.952918 2.581423 -1.254390
H -3.593232 -1.812883 1.089678
H 1.016817 -2.484215 1.167207
H 2.966861 0.057264 0.903665
H 3.772284 0.676642 -0.562650
H -5.293035 1.768858 -0.733292
H -5.612314 -0.422988 0.447331
H 2.906198 2.465243 1.854065
H 3.410758 -3.415194 1.024284
H 2.392362 -4.314873 -0.136997
H 3.927554 -3.579646 -0.690825
H 5.378882 2.471216 -0.045531
H 5.047670 3.628312 1.382970


