%chk=000233552.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000233552

0 1
S 2.650918 -0.881841 1.736033
S -2.653516 -0.884482 -1.740918
O 2.299162 -1.537790 -1.232270
O -2.302296 -1.533683 1.229311
C 1.179296 -0.991044 0.798980
C -1.182232 -0.992384 -0.803349
C 3.731895 0.171939 0.837367
C -3.736256 0.167698 -0.842561
C 5.591505 1.839724 -0.401906
C -5.602475 1.831398 0.392207
C 1.275538 -1.204959 -0.685128
C -1.278548 -1.202786 0.681224
C -0.000746 -0.995149 1.427906
C -0.002134 -0.998461 -1.432230
C 3.808667 1.515502 1.216377
C -3.813064 1.511773 -1.219714
C 4.566314 -0.349163 -0.154638
C -4.572188 -0.355334 0.147183
C 4.741557 2.348399 0.596686
C -4.748615 2.342865 -0.601607
C 5.497442 0.487860 -0.773285
C -5.506154 0.479822 0.764061
C 6.598614 2.728762 -1.053364
C -6.593199 2.725305 1.061871
H -0.114330 -0.861870 2.508109
H 0.111532 -0.867637 -2.512746
H 3.150766 1.915430 1.989810
H -3.153243 1.913450 -1.990612
H 4.478735 -1.397327 -0.459911
H -4.483707 -1.403528 0.451971
H 4.810293 3.394259 0.888217
H -4.815689 3.389720 -0.889936
H 6.148732 0.088137 -1.548392
H -6.157157 0.079207 1.538950
H 7.553261 2.699952 -0.505499
H 6.813092 2.430208 -2.088889
H 6.275903 3.778273 -1.083961
H -6.932100 3.541179 0.409149
H -7.491498 2.183892 1.389387
H -6.152775 3.189585 1.957919


%chk=000233552-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000233552

0 1
S 2.810302 -1.118440 1.688232
S -2.811996 -1.140055 -1.678266
O 2.326414 -1.306346 -1.413891
O -2.329003 -1.287025 1.427334
C 1.246364 -1.055057 0.757070
C -1.248985 -1.063716 -0.747186
C 3.897064 0.062815 0.762173
C -3.901114 0.048634 -0.765447
C 5.658039 1.892520 -0.509423
C -5.667488 1.888484 0.484167
C 1.255012 -1.154082 -0.748947
C -1.257707 -1.145039 0.760061
C 0.054122 -1.065981 1.439337
C -0.056581 -1.082034 -1.429244
C 3.557776 1.431499 0.699263
C -3.552890 1.414707 -0.694511
C 5.105383 -0.403776 0.204524
C -5.123913 -0.409056 -0.232501
C 4.432751 2.333549 0.053788
C -4.431974 2.322084 -0.062505
C 5.978285 0.512173 -0.420929
C -6.000657 0.512424 0.379394
C 6.612124 2.872931 -1.168324
C -6.595869 2.864005 1.185533
H 0.014812 -1.025540 2.533292
H -0.017241 -1.054153 -2.523586
H 2.624768 1.789720 1.147392
H -2.613480 1.768211 -1.132906
H 5.345010 -1.470827 0.232250
H -5.376446 -1.472728 -0.275456
H 4.162009 3.394662 -0.004196
H -4.157148 3.382122 -0.003798
H 6.913329 0.145805 -0.861219
H -6.950159 0.153830 0.794331
H 7.351106 3.257901 -0.438720
H 7.178826 2.397335 -1.987937
H 6.076093 3.744268 -1.583304
H -6.467730 3.892300 0.804674
H -7.655315 2.580483 1.057410
H -6.392593 2.888295 2.273873


