%chk=000246862.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000246862

0 1
O 4.078026 -2.222220 1.290427
O 4.212668 2.809695 -0.407920
O -1.712891 2.178083 0.971893
O -4.155494 -1.017472 -0.322167
O -4.084768 1.064971 0.561036
N 2.178962 -0.304570 -0.174961
C 2.857746 -1.513053 -0.699002
C 3.067124 0.791790 0.274856
C 0.794862 -0.205444 -0.104686
C 3.028894 -2.590291 0.389047
C 3.283908 1.820069 -0.855300
C 0.185641 0.960613 0.403007
C -0.030156 -1.292277 -0.546877
C -1.210054 1.031572 0.470508
C -2.038811 -0.041573 0.036185
C -1.403044 -1.195932 -0.473315
C -3.476522 0.088577 0.129604
C -5.607394 -0.947045 -0.254765
H 3.861316 -1.232264 -1.095755
H 2.288005 -1.929985 -1.562129
H 4.043778 0.373393 0.608577
H 2.636098 1.305476 1.167913
H 3.396325 -3.539987 -0.047386
H 2.095190 -2.774558 0.949446
H 2.367066 2.407967 -1.063446
H 3.638433 1.352802 -1.788760
H 0.759562 1.816807 0.749581
H 0.420923 -2.193111 -0.948914
H -2.034645 -2.024594 -0.812428
H 3.756329 -1.548604 1.925616
H 5.119579 2.444914 -0.369944
H -2.748625 2.187735 1.001466
H -5.962879 -0.118662 -0.875935
H -5.920224 -0.811315 0.785523
H -5.907626 -1.921306 -0.653292


%chk=000246862-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000246862

0 1
O 3.873157 -2.258112 1.477382
O 4.096163 2.990208 -0.425502
O -1.730894 2.217836 0.934700
O -4.185563 -1.031955 -0.287112
O -4.055702 1.134175 0.557561
N 2.250329 -0.329912 -0.144256
C 2.920891 -1.523456 -0.704114
C 3.117615 0.800903 0.245837
C 0.853390 -0.231310 -0.086519
C 3.066344 -2.671429 0.320573
C 3.290170 1.851328 -0.881541
C 0.217183 0.951865 0.387906
C 0.019900 -1.333155 -0.500710
C -1.186241 1.041558 0.460858
C -2.016050 -0.061133 0.044993
C -1.370319 -1.234127 -0.434883
C -3.463195 0.077557 0.131281
C -5.660100 -0.906111 -0.208355
H 3.934864 -1.222393 -1.021453
H 2.394930 -1.884964 -1.608730
H 4.107123 0.392635 0.524774
H 2.718529 1.305537 1.143975
H 3.624461 -3.507156 -0.134901
H 2.072513 -3.039768 0.644632
H 2.316795 2.287317 -1.155721
H 3.728298 1.375459 -1.784807
H 0.778825 1.833532 0.703250
H 0.462300 -2.260179 -0.871451
H -1.994484 -2.074552 -0.752947
H 3.336796 -1.631131 2.026082
H 5.030446 2.697058 -0.276087
H -2.749968 2.119658 0.916732
H -6.007122 -0.072832 -0.841803
H -5.973512 -0.722958 0.832926
H -6.040569 -1.869792 -0.574865


