%chk=000254964.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000254964

0 1
S -2.504725 -1.837607 -0.372060
P -1.233693 -0.494524 0.037189
O -0.372989 -0.034897 -1.298356
O -0.122362 -1.014776 1.148470
N -1.794092 1.023758 0.731535
C 1.771008 0.114471 -0.030453
C 0.790317 0.785274 -1.025861
C 1.040430 -0.165512 1.307719
C 2.917842 1.097284 0.247648
C 2.316475 -1.188795 -0.620010
C -2.748243 1.736356 -0.162792
H 0.461704 1.786205 -0.687338
H 1.234223 0.874407 -2.037862
H 1.663035 -0.778016 1.991147
H 0.743514 0.763819 1.829141
H 2.564146 2.044487 0.669540
H 3.644312 0.674764 0.952640
H 3.472978 1.333118 -0.668593
H 1.508633 -1.906356 -0.828412
H 2.842247 -1.020199 -1.565889
H 3.013683 -1.685603 0.063064
H -2.196689 0.941553 1.686766
H -3.729215 1.242160 -0.288570
H -2.311996 1.889051 -1.168001
H -2.935444 2.742680 0.254138


%chk=000254964-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000254964

0 1
S -2.582963 -2.065783 -0.558185
P -1.307150 -0.560011 -0.023586
O -0.342631 -0.014930 -1.375664
O -0.137431 -0.991102 1.203930
N -1.894613 0.946504 0.643167
C 1.802091 0.117228 -0.027342
C 0.843019 0.820750 -1.025441
C 1.061012 -0.102703 1.318654
C 2.987511 1.078377 0.244141
C 2.307816 -1.226173 -0.603415
C -2.855506 1.764562 -0.131303
H 0.492508 1.786688 -0.608706
H 1.333677 0.988482 -1.999150
H 1.699995 -0.637097 2.042144
H 0.747259 0.871676 1.744608
H 2.645450 2.049930 0.649716
H 3.692766 0.634764 0.970983
H 3.549090 1.275955 -0.687190
H 1.471952 -1.918440 -0.798497
H 2.846729 -1.062458 -1.554956
H 3.001565 -1.715590 0.105093
H -2.056634 0.914032 1.656216
H -3.886177 1.356306 -0.123995
H -2.514877 1.824376 -1.178868
H -2.869357 2.787760 0.282445


