%chk=000245305.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000245305

0 1
O 3.517938 -0.467871 -0.203734
O -5.163804 -1.071655 0.048606
O -4.689747 1.031513 0.236665
N -4.373136 -0.143994 0.110433
C 2.198794 -0.135916 -0.124471
C -0.569883 0.239161 0.011412
C 1.689886 1.165713 0.019837
C 1.340186 -1.258042 -0.202366
C 0.309177 1.338172 0.086248
C -0.028364 -1.060406 -0.134082
C 4.521581 0.603765 -0.136704
C -2.003437 0.477251 0.086339
C 5.828803 -0.150607 -0.258429
C -2.951555 -0.478394 0.026139
H 2.345441 2.028238 0.079688
H 1.772801 -2.251158 -0.314110
H -0.094254 2.347571 0.198524
H -0.699400 -1.920797 -0.193509
H 4.343514 1.296427 -0.976834
H 4.410325 1.120240 0.831879
H -2.312553 1.531908 0.201469
H 6.688282 0.528978 -0.215133
H 5.941156 -0.891514 0.546537
H 5.884378 -0.708511 -1.204442
H -2.757731 -1.547971 -0.086461


%chk=000245305-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000245305

0 1
O 3.572967 -0.531946 -0.210371
O -5.325942 -0.979807 0.055345
O -4.710781 1.219828 0.248876
N -4.430193 -0.040259 0.117237
C 2.219666 -0.218333 -0.130082
C -0.599573 0.178522 0.009321
C 1.699099 1.094606 0.016082
C 1.334233 -1.330964 -0.205558
C 0.305644 1.275737 0.083406
C -0.048161 -1.134124 -0.136678
C 4.559321 0.573198 -0.138234
C -2.029757 0.448014 0.084004
C 5.940581 -0.061923 -0.259360
C -3.043032 -0.467844 0.029969
H 2.359967 1.963322 0.076775
H 1.765128 -2.330199 -0.317676
H -0.096630 2.289659 0.195570
H -0.710298 -2.004250 -0.196776
H 4.365160 1.285420 -0.965387
H 4.438557 1.102876 0.828141
H -2.341901 1.496027 0.195092
H 6.719950 0.720093 -0.212951
H 6.115125 -0.777842 0.561187
H 6.041186 -0.598628 -1.217535
H -2.951916 -1.549080 -0.076899


