%chk=000298608.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000298608

0 1
S 2.959254 0.451647 -0.000692
O -1.437579 1.710304 -0.004437
C -2.010584 -0.610842 0.001252
C 0.398921 0.236064 -0.000943
C -3.472657 -0.147018 0.001272
C -1.048338 0.557340 -0.001673
C 1.374044 1.201457 -0.002666
C 0.930445 -1.114084 0.001830
C 2.286825 -1.175934 0.002320
C -4.440818 -1.325157 0.003954
C 1.249312 2.660074 -0.005907
C 3.197122 -2.329036 0.004838
H -1.815606 -1.249815 0.886806
H -1.816718 -1.253177 -0.882128
H -3.655612 0.501059 -0.880354
H -3.654602 0.504252 0.880739
H 0.281745 -1.979176 0.003322
H -4.311490 -1.960384 -0.879452
H -5.480827 -0.977229 0.005196
H -4.308816 -1.958613 0.888236
H 2.203252 3.201577 -0.002971
H 0.664349 3.003545 -0.882756
H 0.657008 3.006801 0.864774
H 3.852109 -2.339527 -0.881820
H 3.851505 -2.336123 0.891975
H 2.650457 -3.285505 0.006486


%chk=000298608-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000298608

0 1
S 3.036710 0.491132 -0.000558
O -1.469424 1.781882 -0.005935
C -2.037836 -0.595018 0.001282
C 0.402283 0.257784 -0.001177
C -3.515933 -0.163304 0.000284
C -1.050133 0.581874 -0.002227
C 1.399475 1.246056 -0.002431
C 0.940227 -1.095207 0.001383
C 2.317513 -1.179835 0.002027
C -4.473410 -1.374007 0.004831
C 1.275068 2.742342 -0.005142
C 3.209282 -2.389639 0.004437
H -1.824087 -1.229253 0.887478
H -1.824403 -1.234266 -0.881392
H -3.706829 0.473956 -0.882924
H -3.706230 0.480029 0.879213
H 0.311971 -1.989000 0.002675
H -4.318486 -2.011780 -0.886573
H -5.529311 -1.047277 0.004287
H -4.317525 -2.005716 0.900373
H 2.262486 3.235552 -0.002219
H 0.703981 3.081747 -0.887801
H 0.697204 3.084262 0.872055
H 3.863538 -2.423378 -0.886882
H 3.862777 -2.420384 0.896424
H 2.593793 -3.306048 0.005712


