%chk=000193566.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000193566

0 1
S 0.051488 1.952860 0.079337
O -0.385400 2.986286 0.996501
O 0.677893 2.310739 -1.163097
O -4.279969 -1.890475 -0.638145
N 1.245160 1.153202 1.097739
N 2.969233 -0.411354 1.586657
N 1.567069 -0.643779 -0.418092
C -1.194717 0.813762 -0.152568
C -2.236757 0.720656 0.789025
C -1.191140 -0.014171 -1.284505
C -3.266925 -0.191822 0.614431
C -2.215359 -0.938947 -1.488256
C -3.238732 -1.015833 -0.529747
C 1.947542 0.011970 0.744024
C 3.634319 -1.529822 1.219752
C 2.270588 -1.757583 -0.743813
C 3.320214 -2.241845 0.048204
H -2.239940 1.382225 1.665504
H -0.377324 0.066460 -2.019653
H 1.549612 1.612940 1.975788
H -4.085306 -0.284369 1.326068
H -2.213902 -1.578396 -2.364543
H 4.441146 -1.854069 1.891020
H 1.967102 -2.262440 -1.669908
H 3.873262 -3.131179 -0.231515
H -4.228958 -2.448618 -1.457508


%chk=000193566-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000193566

0 1
S 0.093903 1.846339 0.141379
O -0.362440 3.017603 1.172820
O 0.795255 2.193898 -1.274280
O -4.702867 -1.698966 -0.747069
N 1.253190 0.887871 1.233741
N 3.166705 -0.395113 1.605827
N 1.753865 -0.784821 -0.363643
C -1.353302 0.696726 -0.138450
C -2.429088 0.777184 0.764769
C -1.334602 -0.148536 -1.258399
C -3.547389 -0.044945 0.535200
C -2.460693 -0.965335 -1.483473
C -3.557861 -0.913495 -0.584562
C 2.088609 -0.127686 0.794597
C 3.961889 -1.428519 1.213808
C 2.591401 -1.794671 -0.730691
C 3.721430 -2.168116 0.031781
H -2.396436 1.476824 1.605610
H -0.463726 -0.168703 -1.918409
H 1.549685 1.439849 2.048505
H -4.414485 -0.025639 1.200435
H -2.481519 -1.637260 -2.350138
H 4.814017 -1.649813 1.865777
H 2.336919 -2.313768 -1.661383
H 4.377829 -2.983721 -0.278811
H -4.640091 -2.270788 -1.552242


