%chk=000258711.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000258711

0 1
O 2.979572 -0.643742 -0.117684
O 1.198833 -2.024388 -0.087185
O -3.469346 -0.113573 0.034681
N -1.249855 -0.870833 -0.013763
N -3.093947 -2.366040 -0.041216
C -0.568881 0.368162 -0.026747
C 0.854173 0.369438 -0.058836
C -1.260865 1.602426 -0.000366
C 1.538301 1.606327 -0.062372
C -0.559370 2.796850 -0.004742
C 0.848196 2.807009 -0.035574
C 1.623854 -0.877528 -0.087609
C -2.667023 -1.030602 0.007013
C 3.833851 -1.820926 -0.149514
H -2.359276 1.610339 0.022127
H 2.633285 1.597103 -0.086902
H -1.103545 3.743740 0.015538
H 1.383786 3.753385 -0.038652
H -0.653367 -1.728149 -0.069612
H 3.621263 -2.404121 -1.051129
H 3.664438 -2.421671 0.749649
H 4.836304 -1.380596 -0.169299
H -4.081423 -2.544597 0.082758
H -2.480558 -3.149715 0.099336


%chk=000258711-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000258711

0 1
O 2.983216 -0.668678 -0.119013
O 1.100392 -2.019131 -0.079875
O -3.550572 -0.165418 0.049143
N -1.265110 -0.824376 -0.013096
N -2.965525 -2.416574 0.022341
C -0.600109 0.411785 -0.021859
C 0.844726 0.417984 -0.058478
C -1.292718 1.657475 0.003666
C 1.539202 1.661243 -0.068017
C -0.574181 2.864944 -0.006539
C 0.844622 2.879575 -0.042430
C 1.604651 -0.847046 -0.085589
C -2.652504 -1.058732 0.021060
C 3.793015 -1.908855 -0.145727
H -2.383778 1.642986 0.030852
H 2.631695 1.639913 -0.095774
H -1.128330 3.810341 0.013732
H 1.390825 3.827942 -0.049999
H -0.612561 -1.632453 -0.035088
H 3.551696 -2.504328 -1.042017
H 3.595909 -2.513810 0.754997
H 4.834320 -1.558816 -0.169538
H -3.952474 -2.659639 0.045944
H -2.268007 -3.158033 0.001203


