%chk=000239831.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000239831

0 1
O 1.323048 -0.179839 -0.934214
O 2.496282 1.557168 -0.008298
N -1.791820 1.773199 -0.377038
N 3.360768 -0.605229 -0.002040
C -2.975367 1.408026 0.469962
C -3.483618 0.016059 0.056207
C -4.746424 -0.364638 0.837326
C -0.558368 1.034745 0.039104
C -5.257581 -1.754068 0.430284
C 0.229498 0.738772 -1.243885
C -1.559236 3.248267 -0.345019
C -6.516718 -2.141631 1.202451
C 4.648296 -0.196766 0.625763
C 3.204500 -2.004380 -0.475226
C 2.421765 0.373296 -0.287671
C 4.667608 -0.550635 2.111161
C 3.765951 -2.199308 -1.882480
H -3.777129 2.158161 0.291304
H -2.756236 1.434554 1.558065
H -3.685170 0.009071 -1.033931
H -2.692315 -0.742447 0.213338
H -5.539532 0.388876 0.667026
H -4.541677 -0.345539 1.924952
H -0.815374 0.076759 0.540869
H 0.084223 1.595714 0.754352
H -4.466857 -2.510792 0.600238
H -5.465197 -1.773804 -0.657746
H 0.641153 1.648282 -1.711821
H -0.347240 0.144937 -1.975767
H -2.419361 3.753074 -0.813087
H -1.407228 3.671166 0.658954
H -0.671319 3.491591 -0.951734
H -6.335945 -2.168418 2.282941
H -7.333473 -1.432834 1.024612
H -6.873607 -3.133962 0.904861
H 4.780973 0.905664 0.495467
H 5.486136 -0.695125 0.090832
H 2.117719 -2.263341 -0.458652
H 3.714671 -2.678198 0.248104
H 3.852342 -0.048853 2.650298
H 4.552941 -1.626470 2.282589
H 5.609305 -0.236061 2.575368
H 3.246256 -1.558658 -2.608447
H 4.832362 -1.956068 -1.940654
H 3.642096 -3.236019 -2.214919


%chk=000239831-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000239831

0 1
O 1.419535 -0.427255 -0.813756
O 2.568739 1.579779 -0.345898
N -1.706521 1.551319 -0.012778
N 3.626202 -0.509540 -0.154761
C -2.979684 1.210320 0.666959
C -3.696753 -0.002265 0.037104
C -5.022130 -0.347526 0.753118
C -0.595623 0.603817 0.237449
C -5.764250 -1.542532 0.111686
C 0.198283 0.384227 -1.064805
C -1.297902 2.958652 0.187929
C -7.086486 -1.887384 0.830436
C 4.914921 0.114245 0.223695
C 3.547277 -1.985011 -0.253326
C 2.556700 0.317554 -0.421734
C 5.099656 0.225186 1.752027
C 3.833248 -2.509162 -1.676936
H -3.644646 2.092209 0.582277
H -2.834269 1.029409 1.764161
H -3.886256 0.223225 -1.030587
H -3.032717 -0.890706 0.057817
H -5.688764 0.540606 0.745802
H -4.820047 -0.574817 1.821202
H -0.999493 -0.363273 0.585537
H 0.099250 0.975538 1.025870
H -5.097684 -2.429284 0.114979
H -5.969359 -1.312922 -0.953764
H 0.493884 1.351153 -1.505993
H -0.384775 -0.202736 -1.790927
H -2.073558 3.635508 -0.213092
H -1.127781 3.217667 1.262984
H -0.355894 3.158107 -0.351579
H -6.904913 -2.153346 1.889089
H -7.781066 -1.026123 0.816348
H -7.598299 -2.741897 0.350500
H 4.948467 1.119705 -0.228595
H 5.728480 -0.489258 -0.222228
H 2.543326 -2.307288 0.067532
H 4.280065 -2.403375 0.462583
H 4.316476 0.871281 2.184272
H 5.045089 -0.765568 2.239848
H 6.084572 0.668669 1.988428
H 3.074845 -2.127310 -2.381256
H 4.831416 -2.190914 -2.029479
H 3.799541 -3.614387 -1.694339


