%chk=000258124.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000258124

0 1
O 0.901540 -2.586905 0.639703
O 3.712774 -0.700127 0.757912
O -0.263951 -2.529125 -1.301470
O 3.344033 -1.369828 -1.380048
N 1.989548 1.430432 -0.192496
C -0.639427 0.356616 -0.090345
C -0.440447 1.779287 -0.020837
C 0.463710 -0.469229 -0.239755
C 0.892501 2.279450 -0.080033
C -2.010607 -0.194897 0.012950
C 1.770949 0.124814 -0.263428
C -1.513461 2.718464 0.084248
C 1.138470 3.689362 -0.020130
C -2.611851 -0.810666 -1.094482
C -2.706451 -0.097598 1.229068
C -1.257311 4.065998 0.138040
C 0.298143 -1.937781 -0.412711
C 0.081262 4.556254 0.088480
C 3.005692 -0.735861 -0.412044
C -3.912067 -1.312677 -0.987538
C -4.002437 -0.607681 1.329272
C -4.607829 -1.210675 0.220784
C 0.877280 -4.040973 0.600421
C 4.949317 -1.468152 0.784793
H -2.538975 2.343173 0.112561
H 2.173471 4.035877 -0.064404
H -2.055358 -0.918713 -2.029320
H -2.232059 0.367390 2.093031
H -2.073369 4.784562 0.216386
H 0.246673 5.633558 0.135665
H -4.377818 -1.791893 -1.848301
H -4.541417 -0.537999 2.272999
H -5.619751 -1.605523 0.301623
H 1.301608 -4.309589 1.573408
H 1.499661 -4.386731 -0.231325
H -0.152879 -4.394544 0.489308
H 4.729003 -2.526228 0.614948
H 5.314914 -1.280561 1.800417
H 5.636114 -1.083179 0.024252


%chk=000258124-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000258124

0 1
O 0.137468 -2.617291 0.999125
O 4.241010 -0.136432 -0.195941
O 0.404920 -2.575802 -1.318960
O 2.995509 -2.061533 0.181462
N 2.067623 1.411990 0.186813
C -0.597275 0.328309 0.041748
C -0.393755 1.754959 0.168058
C 0.538724 -0.500508 -0.024990
C 0.967779 2.248057 0.245095
C -1.978618 -0.246380 -0.015375
C 1.853571 0.091434 0.048971
C -1.463687 2.708451 0.189280
C 1.213009 3.652583 0.376693
C -2.419189 -0.962950 -1.159428
C -2.868747 -0.083336 1.079908
C -1.197462 4.075271 0.308217
C 0.381536 -1.988878 -0.212550
C 0.147791 4.553264 0.411338
C 3.057395 -0.814718 0.024261
C -3.725821 -1.497547 -1.207170
C -4.170165 -0.627594 1.033886
C -4.605139 -1.333305 -0.112541
C 0.060870 -4.097179 0.935565
C 5.457023 -0.986362 -0.219157
H -2.495373 2.356753 0.096631
H 2.256051 3.976848 0.437546
H -1.741837 -1.097901 -2.008900
H -2.528826 0.447724 1.976160
H -2.026405 4.791470 0.316502
H 0.336066 5.627942 0.506870
H -4.053469 -2.043011 -2.098882
H -4.840903 -0.504607 1.891418
H -5.616916 -1.752137 -0.150242
H -0.122696 -4.412196 1.972075
H 1.017376 -4.495024 0.557947
H -0.761129 -4.409537 0.269794
H 5.589309 -1.489155 0.753718
H 6.278150 -0.285242 -0.420729
H 5.375428 -1.748330 -1.012610


