%chk=000268659.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000268659

0 1
S -0.455144 1.380029 0.168563
O -0.775505 2.180271 -1.001174
O -0.633657 1.982050 1.466844
O -3.364119 -1.243181 0.343577
N -3.377894 0.797011 -0.645082
C 1.148120 0.674068 0.058908
C 1.037984 -0.737221 -0.002490
C -0.385787 -1.196208 -0.009719
C -1.260456 -0.164797 0.027606
C 2.375192 1.297016 0.056212
C 2.177664 -1.525049 -0.066033
C -0.716292 -2.630916 -0.077670
C -2.722286 -0.280661 -0.055324
C 3.537967 0.496570 -0.011304
C 3.437367 -0.889675 -0.069557
H 2.464755 2.384619 0.105209
H 2.114176 -2.611051 -0.113155
H -0.198246 -3.217289 0.696179
H -0.463655 -3.070136 -1.054703
H -1.806313 -2.804552 0.080441
H 4.517355 0.976246 -0.015601
H 4.340390 -1.500919 -0.118778
H -4.381664 0.767992 -0.745569
H -2.900550 1.562485 -1.113381


%chk=000268659-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000268659

0 1
S -0.491980 1.487973 0.138266
O -0.945779 2.339272 -1.200712
O -0.646704 2.227520 1.582261
O -3.470361 -1.349484 0.279530
N -3.419021 0.824350 -0.586048
C 1.202206 0.660858 0.013898
C 1.023063 -0.740175 -0.013915
C -0.387242 -1.229642 -0.017814
C -1.340076 -0.250507 0.021120
C 2.435903 1.307540 0.030464
C 2.187059 -1.542859 -0.046294
C -0.685416 -2.705594 -0.105576
C -2.828338 -0.309530 -0.075104
C 3.591513 0.482413 -0.010100
C 3.460824 -0.926024 -0.047455
H 2.516152 2.397903 0.068287
H 2.103302 -2.633995 -0.067231
H -0.248480 -3.230828 0.765247
H -0.230879 -3.138254 -1.016712
H -1.769519 -2.886049 -0.108308
H 4.585098 0.941631 -0.011007
H 4.360079 -1.550000 -0.074008
H -4.436744 0.851288 -0.644775
H -2.855257 1.598897 -0.970016


