%chk=000202616.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000202616

0 1
S -1.334444 0.430128 1.195373
S 2.702988 -0.706721 -0.787246
O -1.495516 2.504373 -0.470733
O 2.437850 1.338783 0.906386
N -0.039184 2.747600 1.300951
N 4.373154 1.295824 -0.316273
C -1.429448 -0.545971 -0.357535
C -0.036050 -0.577818 -1.022928
C -2.081364 -1.896925 -0.013899
C 1.065403 -1.071386 -0.084948
C -0.084254 -1.408821 -2.311288
C -3.580133 -1.707970 0.257296
C -1.423880 -2.646473 1.148087
C -0.946964 2.072420 0.513789
C 3.145962 0.810893 0.076300
H -2.115206 0.013459 -1.051195
H 0.199187 0.483356 -1.319880
H -1.981534 -2.541907 -0.930154
H 1.006731 -2.168017 0.080260
H 0.997223 -0.599986 0.924230
H 0.853698 -1.327015 -2.875071
H -0.255692 -2.472760 -2.113467
H -0.883060 -1.063673 -2.979082
H -3.763082 -1.098262 1.151785
H -4.077526 -2.670525 0.417855
H -4.087731 -1.212189 -0.577469
H -1.499574 -2.103685 2.098452
H -0.360643 -2.841957 0.960349
H -1.908437 -3.617744 1.306153
H 0.610448 2.240590 1.899393
H 0.304473 3.646553 0.984656
H 4.954763 0.841718 -1.002357
H 4.746043 2.135310 0.104711


%chk=000202616-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000202616

0 1
S -1.187299 0.422351 1.364881
S 2.878276 -0.723738 -0.857320
O -1.951412 2.517757 -0.308861
O 2.477798 1.278630 1.034776
N -0.024449 2.836848 0.988930
N 4.464522 1.348712 -0.174395
C -1.368649 -0.590259 -0.261609
C 0.010698 -0.633209 -1.004367
C -2.119056 -1.920468 0.026132
C 1.175752 -1.172913 -0.146619
C -0.096026 -1.371580 -2.359885
C -3.616780 -1.642106 0.309949
C -1.514882 -2.787518 1.158969
C -1.102939 2.123156 0.527974
C 3.243942 0.803194 0.155637
H -2.034168 0.047510 -0.875338
H 0.245346 0.429030 -1.222360
H -2.066433 -2.506493 -0.915729
H 1.193340 -2.272959 -0.087790
H 1.153804 -0.736763 0.867025
H 0.826699 -1.216895 -2.948688
H -0.229955 -2.460592 -2.222941
H -0.946620 -0.992236 -2.955312
H -3.734446 -1.036270 1.226426
H -4.169592 -2.589891 0.446802
H -4.086646 -1.086736 -0.522695
H -1.533461 -2.245098 2.122689
H -0.471777 -3.086009 0.957875
H -2.109762 -3.711216 1.283648
H 0.782745 2.343582 1.387718
H 0.081721 3.802903 0.674609
H 5.065110 0.930936 -0.883495
H 4.778798 2.179541 0.325864


