%chk=000222937.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000222937

0 1
O 4.922975 -0.270755 -0.200963
O -1.315889 1.569058 -0.023767
N -0.646394 -0.643472 -0.065874
N -4.037310 0.885955 0.035337
N -5.013062 -1.162366 0.041286
C 0.777787 -0.455550 -0.099434
C -3.003805 -0.073244 0.000802
C -1.601083 0.378815 -0.029847
C 3.549275 -0.226944 -0.166308
C 1.374758 0.813618 -0.100917
C 1.579878 -1.621454 -0.131872
C -5.247584 0.184516 0.059306
C 2.766946 0.932570 -0.134461
C 2.961522 -1.511662 -0.165266
C -3.636588 -1.326401 0.005329
C -6.566529 0.844068 0.098196
C 5.651874 0.999262 -0.206525
C 7.102617 0.561137 -0.246267
H -0.960518 -1.614725 -0.069147
H -3.874418 1.881494 0.040618
H 0.755388 1.718997 -0.075812
H 1.121297 -2.609237 -0.130917
H 3.213190 1.922237 -0.135125
H 3.603218 -2.390502 -0.190626
H -3.193788 -2.307968 -0.014542
H -6.694748 1.464323 0.998534
H -6.739763 1.479293 -0.783994
H -7.376082 0.089167 0.112288
H 5.351718 1.569442 -1.102241
H 5.396269 1.552028 0.713582
H 7.780518 1.421785 -0.253502
H 7.353365 -0.064872 0.621819
H 7.310864 -0.046214 -1.138490


%chk=000222937-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000222937

0 1
O 4.988716 -0.337187 -0.203430
O -1.405947 1.651362 -0.016507
N -0.665414 -0.592109 -0.061010
N -4.069092 0.845183 0.035736
N -5.076617 -1.169918 0.039628
C 0.750525 -0.439162 -0.094666
C -3.035785 -0.099071 0.002144
C -1.643513 0.394124 -0.026309
C 3.586221 -0.294608 -0.166181
C 1.400060 0.821315 -0.097513
C 1.537218 -1.624737 -0.127438
C -5.281378 0.176225 0.057988
C 2.809861 0.889842 -0.133033
C 2.938160 -1.555798 -0.162929
C -3.691274 -1.344245 0.004950
C -6.615870 0.853176 0.096125
C 5.713904 0.948491 -0.208832
C 7.202658 0.615442 -0.253547
H -0.999635 -1.558751 -0.064704
H -3.883336 1.850690 0.041302
H 0.797319 1.730914 -0.072288
H 1.048671 -2.607823 -0.125373
H 3.284448 1.875375 -0.134350
H 3.549669 -2.462427 -0.188515
H -3.265805 -2.346671 -0.014978
H -6.734749 1.480965 0.998675
H -6.776667 1.498681 -0.787238
H -7.399020 0.080278 0.106830
H 5.406760 1.541647 -1.095034
H 5.456426 1.521187 0.706178
H 7.800088 1.545232 -0.258951
H 7.494091 0.016860 0.626273
H 7.445206 0.037914 -1.161806


