%chk=000238037.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000238037

0 1
S 0.987836 -1.207439 -0.232786
O 1.711281 -1.080250 1.025228
O 0.891448 -2.513163 -0.861763
N 1.782507 -0.242438 -1.419336
N 3.932439 2.424637 0.206137
N -4.314955 1.317032 0.332146
C -0.551949 -0.486002 -0.065300
C 2.292920 1.088904 -1.026504
C 3.510575 1.023722 -0.074384
C -1.544668 -0.705697 -1.032189
C -0.834235 0.320098 1.048817
C -2.802246 -0.132270 -0.904141
C -2.081249 0.907563 1.204467
C -3.079208 0.688646 0.219301
H 1.474483 1.673450 -0.546064
H 2.558499 1.652037 -1.949894
H 2.407403 -0.730056 -2.071318
H 4.313034 0.395428 -0.511206
H 3.210608 0.520963 0.880458
H -1.329304 -1.345090 -1.896776
H -0.059562 0.480915 1.810821
H -3.562068 -0.306112 -1.659790
H -2.287489 1.532918 2.067758
H 4.575554 2.755487 -0.505366
H 4.417403 2.476549 1.096136
H -5.075999 1.044833 -0.265419
H -4.576659 1.764734 1.193267


%chk=000238037-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000238037

0 1
S 1.005124 -1.160586 -0.130776
O 1.706480 -0.958952 1.336950
O 0.946548 -2.624854 -0.843965
N 1.796908 -0.087823 -1.447781
N 4.327688 2.330431 0.112624
N -4.564408 1.170709 0.319568
C -0.699367 -0.422930 -0.009093
C 2.414012 1.169904 -0.948943
C 3.776397 1.010413 -0.223828
C -1.616463 -0.655494 -1.051123
C -1.030544 0.310691 1.144131
C -2.910346 -0.120894 -0.938236
C -2.326191 0.844863 1.252558
C -3.284005 0.641254 0.212669
H 1.699646 1.679235 -0.277787
H 2.530720 1.821503 -1.838689
H 2.472363 -0.729623 -1.908348
H 4.449157 0.389866 -0.866797
H 3.605093 0.441736 0.706517
H -1.325660 -1.249186 -1.923251
H -0.289296 0.438862 1.939848
H -3.640370 -0.291383 -1.737914
H -2.604663 1.418375 2.144149
H 4.750334 2.848210 -0.660756
H 4.872993 2.377459 0.974111
H -5.254784 1.020565 -0.410477
H -4.840966 1.707047 1.136938


