%chk=000221835.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000221835

0 1
O -0.918970 -2.125481 -1.361108
O 5.382485 -0.033756 1.036506
O 5.043719 1.734289 -0.163600
N -1.697485 -0.288709 -0.241929
N 4.687657 0.676977 0.329912
C -3.137832 -0.628918 -0.428477
C -3.805210 -0.874063 0.940187
C -3.845154 0.493678 -1.214839
C -4.004918 0.412656 1.749387
C -4.044988 1.770428 -0.389959
C -4.755952 1.475661 0.937224
C -0.689106 -1.099990 -0.743354
C 0.709347 -0.612259 -0.453768
C 1.547257 -1.404107 0.341977
C 1.166614 0.590951 -1.006079
C 2.853489 -0.985933 0.601596
C 2.472430 1.015618 -0.755185
C 3.302181 0.224622 0.053087
H -3.184928 -1.580761 -1.031524
H -3.209721 -1.601308 1.524998
H -4.786393 -1.359725 0.767179
H -4.829551 0.113396 -1.554047
H -3.278277 0.722536 -2.137641
H -3.027253 0.810304 2.080509
H -4.564594 0.184182 2.677044
H -4.633418 2.502422 -0.976404
H -3.070263 2.256140 -0.196741
H -5.790166 1.132817 0.739012
H -4.852346 2.405170 1.528984
H -1.494975 0.550573 0.291052
H 1.183142 -2.352573 0.745397
H 0.511896 1.189938 -1.641640
H 3.527227 -1.589475 1.220611
H 2.853755 1.951102 -1.179864


%chk=000221835-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000221835

0 1
O -0.974388 -2.387720 -0.267998
O 5.615587 -0.189471 0.697009
O 5.077399 1.826250 -0.225396
N -1.734946 -0.196324 -0.427631
N 4.771014 0.639296 0.181591
C -3.160264 -0.584348 -0.569667
C -3.806225 -0.890509 0.811091
C -3.936453 0.532913 -1.308800
C -3.975037 0.382434 1.672480
C -4.116904 1.807766 -0.445479
C -4.770900 1.475393 0.917962
C -0.733926 -1.137574 -0.298971
C 0.682951 -0.615176 -0.191186
C 1.653383 -1.492093 0.359066
C 1.081971 0.672349 -0.639702
C 2.994852 -1.090869 0.489129
C 2.421457 1.089905 -0.521853
C 3.357630 0.201699 0.049858
H -3.162336 -1.512672 -1.169843
H -3.196376 -1.649493 1.333252
H -4.800459 -1.345628 0.626102
H -4.937711 0.133402 -1.563098
H -3.433225 0.771230 -2.265746
H -2.976173 0.777977 1.950554
H -4.484166 0.127007 2.621110
H -4.729345 2.545064 -0.998468
H -3.136086 2.301342 -0.268521
H -5.805966 1.115857 0.742975
H -4.850214 2.389968 1.536444
H -1.516348 0.796613 -0.335961
H 1.326179 -2.489575 0.667608
H 0.364222 1.347134 -1.119288
H 3.756583 -1.748266 0.915897
H 2.753918 2.072522 -0.866016


