%chk=000258908.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000258908

0 1
O -6.006413 -0.250769 -0.049519
N -0.056625 1.187955 -0.035070
C 0.970375 0.233825 -0.018435
C 0.397853 -1.068953 -0.006112
C -1.035125 -0.908846 -0.015589
C -1.297644 0.504173 -0.033645
C 2.388992 0.438588 -0.013368
C -2.609996 1.025271 -0.046730
C 3.196980 -0.731368 0.004612
C 1.238723 -2.211988 0.011751
C -2.110233 -1.812215 -0.010811
C -3.653669 0.094295 -0.041445
C 2.597336 -2.041781 0.016839
C -3.396467 -1.303339 -0.023747
C 3.000968 1.722684 -0.025195
C -2.815012 2.502788 -0.065179
C 4.616045 -0.578335 0.010299
C 4.373283 1.837463 -0.019301
C 5.187375 0.673848 -0.001368
C -5.075724 0.527691 -0.053905
H 0.055754 2.181590 -0.046548
H 0.783684 -3.201439 0.021024
H -1.923302 -2.883244 0.002771
H 3.262508 -2.903470 0.030404
H -4.261531 -1.975543 -0.020698
H 2.375127 2.611781 -0.038911
H -3.878346 2.789931 -0.074104
H -2.361100 2.958650 -0.957680
H -2.369832 2.979650 0.820734
H 5.238903 -1.472059 0.024079
H 4.850587 2.815611 -0.028257
H 6.270804 0.789708 0.002997
H -5.245878 1.620445 -0.067692


%chk=000258908-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000258908

0 1
O -6.095562 -0.268092 -0.049831
N -0.079870 1.147260 -0.035234
C 0.961287 0.210291 -0.018691
C 0.392656 -1.098524 -0.006302
C -1.049777 -0.939070 -0.015919
C -1.315172 0.473631 -0.033886
C 2.375425 0.438781 -0.013698
C -2.614348 1.032733 -0.046952
C 3.217846 -0.741684 0.005047
C 1.248632 -2.243952 0.012067
C -2.143292 -1.844641 -0.010984
C -3.692047 0.093413 -0.041596
C 2.629116 -2.060553 0.017542
C -3.441081 -1.321334 -0.023821
C 2.981370 1.735055 -0.025979
C -2.756825 2.546831 -0.064953
C 4.638212 -0.563847 0.010775
C 4.373732 1.872408 -0.019952
C 5.209101 0.713445 -0.001381
C -5.110433 0.524822 -0.054094
H 0.034895 2.157814 -0.046314
H 0.819492 -3.251451 0.021817
H -1.976442 -2.926732 0.002557
H 3.300798 -2.926387 0.031629
H -4.318846 -1.976286 -0.020728
H 2.354021 2.635223 -0.040394
H -3.802347 2.886650 -0.073046
H -2.268006 2.977248 -0.961358
H -2.275351 2.997707 0.825360
H 5.278750 -1.453743 0.024939
H 4.828404 2.868863 -0.029523
H 6.298110 0.831038 0.003218
H -5.294046 1.625679 -0.068114


