%chk=000239954.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000239954

0 1
S -0.254761 -2.665629 0.072559
S 2.278860 2.060067 -0.303867
N 0.890289 -0.250488 -0.107773
N -0.333701 1.852084 -0.171439
N -2.825710 -0.940629 0.070051
N -2.677187 1.905098 -0.019933
C -1.543539 -0.283535 -0.001648
C -0.294554 -0.915490 -0.020331
C -1.530197 1.155934 -0.071792
C 0.803003 1.112488 -0.180843
C 1.490584 -3.105969 0.006150
C 3.587944 0.822793 -0.299092
H -2.920864 -1.619362 -0.686327
H -2.914505 -1.449129 0.950729
H -2.639426 2.905823 -0.131557
H -3.577432 1.447011 -0.024722
H 1.567652 -4.198332 0.068901
H 2.052124 -2.656106 0.836883
H 1.957956 -2.763858 -0.927629
H 3.497431 0.128450 -1.144853
H 3.580005 0.222791 0.620560
H 4.546930 1.350688 -0.372024


%chk=000239954-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000239954

0 1
S -0.280440 -2.737539 0.077506
S 2.323645 2.105767 -0.294276
N 0.892256 -0.237513 -0.115010
N -0.338996 1.865411 -0.167597
N -2.819072 -0.935935 0.092612
N -2.694012 1.868705 -0.069900
C -1.548765 -0.266876 0.005179
C -0.292651 -0.909158 -0.020016
C -1.518678 1.167859 -0.078860
C 0.795016 1.120669 -0.180400
C 1.569968 -3.063823 -0.017207
C 3.620223 0.744753 -0.284901
H -3.021120 -1.585072 -0.675280
H -3.037374 -1.342571 1.008707
H -2.676026 2.882848 -0.136416
H -3.560251 1.331497 -0.028979
H 1.676881 -4.157980 0.042529
H 2.074655 -2.570333 0.824496
H 1.964875 -2.679395 -0.967503
H 3.470970 0.080787 -1.147640
H 3.550622 0.168472 0.648077
H 4.589173 1.264130 -0.353119


