%chk=000290232.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000290232

0 1
S -1.300634 1.910721 0.000412
N 1.434732 1.846433 -0.000281
N 2.590163 -0.289426 -0.000638
N 1.489041 -2.346259 -0.002532
C -1.241258 -0.692775 -0.000403
C 0.148514 -0.260035 -0.000196
C -2.120620 0.349056 -0.000060
C 0.271832 1.154548 -0.000090
C 1.384813 -0.973179 -0.000528
C -1.642560 -2.124276 -0.001244
C -3.592645 0.349116 0.000046
C 2.560477 1.073047 -0.001203
H -1.273215 -2.642843 -0.898037
H -1.269837 -2.645256 0.892655
H -2.736253 -2.246812 0.000679
H -4.027995 1.360279 -0.001576
H -3.994791 -0.165903 -0.887947
H -3.994616 -0.163084 0.889763
H 3.533383 1.590928 -0.000377
H 2.399283 -2.782092 0.000778
H 0.678985 -2.936188 0.004680


%chk=000290232-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000290232

0 1
S -1.295609 1.991919 0.000229
N 1.481654 1.862430 -0.000135
N 2.612110 -0.297489 -0.000560
N 1.505341 -2.341914 -0.001747
C -1.227622 -0.690739 -0.000325
C 0.163676 -0.249348 -0.000287
C -2.122447 0.370705 -0.000276
C 0.309455 1.173999 -0.000084
C 1.410781 -0.967216 -0.000539
C -1.674720 -2.138741 -0.000463
C -3.629979 0.328950 -0.000187
C 2.586130 1.065135 -0.000835
H -1.315829 -2.677662 -0.900057
H -1.314901 -2.678195 0.898485
H -2.774709 -2.217783 0.000307
H -4.064185 1.343059 -0.002012
H -4.021854 -0.197632 -0.891607
H -4.021886 -0.194449 0.893112
H 3.556433 1.569626 0.000363
H 2.443332 -2.739767 -0.001015
H 0.691627 -2.948888 0.001535


