%chk=000257306.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000257306

0 1
O -2.791686 -2.379888 0.000000
O -3.836674 2.079402 0.000338
N -1.610776 1.520689 0.000453
N -3.317937 -0.176170 0.000506
C 3.254822 0.329076 -0.000719
C 1.763724 -0.034151 -0.000240
C 3.895638 -0.268043 -1.268047
C 3.897862 -0.272099 1.263564
C 3.491974 1.849229 0.001625
C 0.762310 0.933711 -0.000004
C 1.400399 -1.405148 -0.000305
C -0.594874 0.541682 0.000300
C -0.955555 -0.822116 0.000317
C 0.071870 -1.790625 -0.000035
C -2.357951 -1.248053 0.000788
C -2.999315 1.199777 0.000528
H 3.410868 0.106755 -2.176731
H 4.958436 -0.009153 -1.333373
H 3.829864 -1.361081 -1.289919
H 3.832817 -1.365249 1.281714
H 4.960604 -0.012804 1.328238
H 3.414204 0.099229 2.174263
H 4.564870 2.077114 0.001447
H 3.065659 2.330720 -0.885150
H 3.066532 2.327785 0.890410
H 1.008868 1.993427 -0.000108
H 2.181103 -2.165327 -0.000536
H -0.209568 -2.849210 -0.000007
H -1.365368 2.514955 0.000368
H -4.318519 -0.423834 0.000313


%chk=000257306-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000257306

0 1
O -2.833299 -2.430653 -0.003836
O -3.898314 2.122832 0.001067
N -1.641894 1.503903 0.002681
N -3.315056 -0.151316 0.000579
C 3.265228 0.330438 -0.000762
C 1.767707 -0.051667 -0.000075
C 3.941885 -0.263987 -1.274019
C 3.943636 -0.265389 1.270902
C 3.490648 1.863932 -0.000047
C 0.742153 0.917650 0.001530
C 1.393082 -1.432235 -0.001617
C -0.623333 0.534147 0.001789
C -0.982020 -0.841838 0.000570
C 0.045844 -1.816286 -0.001377
C -2.405208 -1.241874 0.001648
C -3.014448 1.223998 0.001960
H 3.490288 0.152578 -2.192784
H 5.020333 -0.019747 -1.276039
H 3.843701 -1.363044 -1.316583
H 3.845844 -1.364520 1.312282
H 5.022023 -0.020877 1.271841
H 3.493114 0.149925 2.190757
H 4.574772 2.076859 -0.000180
H 3.059007 2.344056 -0.897939
H 3.059348 2.343133 0.898501
H 0.990107 1.983792 0.002462
H 2.168322 -2.204862 -0.002992
H -0.251222 -2.870177 -0.002349
H -1.405576 2.498021 0.003179
H -4.312468 -0.386195 -0.001150


