%chk=000248614.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000248614

0 1
O -1.697404 -2.725817 -0.814476
O 1.699120 3.565924 -0.165389
O 3.436445 2.294034 -0.117547
O 3.210590 -2.620028 0.151390
N 3.211401 -0.305693 0.044640
N 2.213288 2.463240 -0.105575
C -1.632048 -1.800457 0.272128
C -0.450751 -0.832407 0.166244
C -0.939550 0.517921 0.077854
C -2.835904 -0.876371 0.165730
C -2.409217 0.484191 0.079198
C 0.887632 -1.113685 0.161797
C -0.053926 1.560871 -0.008621
C 1.830196 -0.043093 0.062529
C 1.348404 1.293421 -0.013967
C -4.177773 -1.203515 0.151851
C -3.338170 1.509342 0.000364
C -5.118728 -0.156846 0.066734
C -4.705952 1.171901 -0.003128
C 3.843377 -1.589831 0.089140
C 5.337335 -1.505196 0.049572
H -1.614589 -2.375604 1.225738
H 1.251647 -2.147452 0.236321
H -0.393741 2.601467 -0.076163
H -4.503396 -2.241885 0.193151
H -3.028077 2.549517 -0.062387
H -6.180951 -0.398003 0.052935
H -5.447767 1.967895 -0.066086
H -0.817644 -3.132636 -0.974265
H 3.839553 0.534035 -0.016222
H 5.712362 -1.033885 -0.872062
H 5.776174 -2.517910 0.090816
H 5.754965 -0.942743 0.898758


%chk=000248614-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000248614

0 1
O -1.716708 -2.775173 -0.886301
O 1.743840 3.618705 -0.136031
O 3.554698 2.248807 -0.108597
O 3.302162 -2.693712 0.176141
N 3.228795 -0.339186 0.036918
N 2.252020 2.436211 -0.088153
C -1.655762 -1.804039 0.219963
C -0.471875 -0.831969 0.147871
C -0.949384 0.515597 0.073351
C -2.854486 -0.865745 0.142892
C -2.425600 0.492680 0.080102
C 0.886629 -1.136009 0.137975
C -0.034590 1.568600 0.002247
C 1.850352 -0.081131 0.053603
C 1.356986 1.276393 -0.008900
C -4.217755 -1.193922 0.124692
C -3.369424 1.539160 0.019906
C -5.167780 -0.143094 0.056445
C -4.745581 1.209244 0.010002
C 3.892163 -1.577890 0.093223
C 5.409499 -1.444471 0.042570
H -1.636620 -2.350011 1.189683
H 1.264424 -2.158958 0.199224
H -0.340656 2.616231 -0.048511
H -4.539960 -2.239834 0.147259
H -3.052550 2.586971 -0.024279
H -6.237858 -0.376709 0.037305
H -5.493991 2.007787 -0.039365
H -0.994200 -3.445088 -0.771436
H 3.796346 0.528647 -0.026519
H 5.733718 -0.965162 -0.899370
H 5.857110 -2.446149 0.107784
H 5.782938 -0.826082 0.879311


