%chk=000246387.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000246387

0 1
S -2.751856 1.473756 -0.006938
O -0.445431 2.123032 -0.009426
O -0.070898 -2.504390 0.009448
N -0.610940 -0.196760 0.000238
N -2.883516 -1.150197 0.005322
C 1.561374 0.665652 -0.002701
C 1.652553 -0.754742 0.002955
C 0.124097 1.060516 -0.004587
C 0.276836 -1.364076 0.005040
C 2.691624 1.456132 -0.005256
C 2.876203 -1.389442 0.005743
C -2.011673 -0.163018 0.000368
C 3.948433 0.805854 -0.002287
C 4.038342 -0.581173 0.003010
C -4.323545 0.716272 -0.002926
C -4.204193 -0.640803 0.003163
H 2.625462 2.545384 -0.009430
H 2.952594 -2.478451 0.009902
H 4.856392 1.412347 -0.004252
H 5.017254 -1.065235 0.005122
H -5.222990 1.305360 -0.005327
H -5.006321 -1.373819 0.006820


%chk=000246387-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000246387

0 1
S -2.979146 1.593516 -0.007423
O -0.258945 2.346370 -0.009519
O -0.166550 -2.403811 0.009365
N -0.625712 -0.016895 0.000144
N -2.783536 -1.091900 0.005231
C 1.603536 0.709980 -0.002607
C 1.621266 -0.701359 0.002975
C 0.190957 1.176443 -0.004534
C 0.219105 -1.221079 0.004750
C 2.789357 1.461703 -0.005455
C 2.827294 -1.418987 0.005962
C -2.029351 -0.005029 0.000153
C 4.016432 0.747368 -0.002456
C 4.035017 -0.671482 0.003169
C -4.458845 0.575119 -0.002882
C -4.147504 -0.773641 0.003580
H 2.762203 2.555789 -0.009754
H 2.828921 -2.513400 0.010231
H 4.962133 1.299671 -0.004484
H 4.995095 -1.198386 0.005368
H -5.442059 1.042249 -0.005176
H -4.869870 -1.590039 0.007363


