%chk=000231387.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000231387

0 1
O 0.773219 2.300254 0.751401
N 0.022269 0.332354 -0.170944
N -1.004283 2.475860 -0.682213
C 0.917795 -0.446372 0.731291
C -1.009327 -0.444264 -0.896576
C 2.154748 -0.866485 -0.041810
C -2.141556 -0.902200 0.007724
C -0.021624 1.726045 0.014194
C 3.220505 0.173144 -0.153801
C -3.129656 0.146169 0.396529
C 2.266845 -2.091245 -0.561067
C -2.228119 -2.172116 0.409006
H 0.373380 -1.324015 1.145568
H 1.209259 0.185120 1.609117
H -0.497824 -1.322100 -1.365372
H -1.411327 0.151667 -1.745759
H 3.779063 0.101429 -1.094746
H 2.807131 1.195151 -0.092966
H 3.946324 0.079878 0.666619
H -2.635041 1.007431 0.875068
H -3.674330 0.533338 -0.474485
H -3.879549 -0.223702 1.108352
H 1.509795 -2.853078 -0.476863
H 3.135167 -2.424407 -1.108153
H -1.522409 -2.941351 0.136641
H -3.018945 -2.541526 1.044928
H -1.422291 2.107320 -1.522149
H -0.834118 3.475602 -0.713937


%chk=000231387-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000231387

0 1
O 0.934904 2.522352 0.838257
N 0.005563 0.518457 0.052358
N -0.895993 2.635227 -0.583187
C 0.928134 -0.272968 0.903445
C -0.846067 -0.248071 -0.883085
C 2.056431 -0.933399 0.112696
C -2.047840 -0.920015 -0.211975
C 0.058899 1.914250 0.141631
C 2.955069 0.001074 -0.673214
C -3.030077 -0.008359 0.498413
C 2.233575 -2.281378 0.147820
C -2.197662 -2.269716 -0.261902
H 0.344255 -1.042040 1.443784
H 1.351493 0.435506 1.638518
H -0.217501 -1.026895 -1.355689
H -1.178390 0.420557 -1.700725
H 3.777826 -0.542657 -1.167729
H 2.379201 0.543543 -1.447944
H 3.381491 0.778539 -0.011580
H -2.513727 0.611900 1.255309
H -3.519629 0.688106 -0.213328
H -3.824536 -0.582301 1.003829
H 1.564358 -2.932774 0.724076
H 3.062156 -2.767725 -0.380236
H -1.465225 -2.908730 -0.770556
H -3.056183 -2.772535 0.198388
H -1.738885 2.230728 -0.981067
H -0.816538 3.647223 -0.520708