%chk=000201071.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000201071

0 1
S 2.696216 1.526455 1.307355
P 3.120967 0.006533 0.221186
O 1.946622 -0.336558 -0.967721
O -4.012155 1.245069 0.220411
O -4.116707 -0.898455 0.488386
N -3.510380 0.132963 0.242937
C 4.590307 0.134964 -0.900759
C 3.272493 -1.611402 1.122193
C 0.625573 -0.179830 -0.589594
C 0.031764 1.092459 -0.593517
C -0.104387 -1.353317 -0.326921
C -2.069222 0.024038 -0.049350
C -1.328870 1.190205 -0.314599
C -1.464573 -1.246113 -0.057868
H 4.641768 1.129999 -1.374414
H 5.533039 -0.010890 -0.355471
H 4.542962 -0.604855 -1.713910
H 4.153021 -1.620415 1.781577
H 2.398781 -1.791489 1.768887
H 3.356740 -2.460587 0.431908
H 0.623916 1.986459 -0.803682
H 0.390662 -2.322262 -0.353910
H -1.829387 2.166324 -0.299441
H -2.070450 -2.136196 0.148819


%chk=000201071-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000201071

0 1
S 3.136651 1.851235 1.289175
P 3.306678 0.061900 0.256117
O 1.937958 -0.453352 -0.818409
O -4.095684 1.332463 0.315574
O -4.347473 -0.924956 0.096262
N -3.622891 0.146213 0.115573
C 4.597457 -0.003966 -1.078263
C 3.475637 -1.445482 1.342919
C 0.580015 -0.264247 -0.524899
C 0.031384 1.025976 -0.299859
C -0.248434 -1.416192 -0.536397
C -2.167502 0.004067 -0.103782
C -1.352334 1.158376 -0.084070
C -1.632629 -1.284824 -0.332863
H 4.428144 0.841817 -1.761226
H 5.596710 0.086378 -0.623799
H 4.505485 -0.952491 -1.630462
H 4.381478 -1.345197 1.962403
H 2.595144 -1.499450 2.002146
H 3.533444 -2.349263 0.715638
H 0.683606 1.902717 -0.298143
H 0.206663 -2.393911 -0.719812
H -1.810247 2.135135 0.091748
H -2.300561 -2.149847 -0.343067


