%chk=000287566.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000287566

0 1
S 0.022911 0.014870 -1.782253
O 2.018770 -0.132639 0.862318
O -2.030243 0.125232 0.819703
O 3.652128 0.091380 -0.669783
O -3.630181 -0.077476 -0.750165
C 1.799936 1.748411 -0.602484
C -1.779162 -1.734998 -0.666440
C 0.307315 1.409239 -0.655862
C -0.285801 -1.395254 -0.682153
C 2.057263 2.802658 0.487395
C 2.315797 2.243027 -1.956930
C -2.060128 -2.804793 0.402268
C -2.265075 -2.210023 -2.038856
C 2.613496 0.500434 -0.210798
C -2.601447 -0.492750 -0.274727
C 2.713730 -1.304482 1.410452
C -2.737298 1.289255 1.369118
C 2.035060 -1.549649 2.741417
C -2.087328 1.515919 2.717576
H -0.091175 1.172448 0.355791
H -0.278985 2.268646 -1.033831
H 0.090269 -1.172771 0.341258
H 0.308877 -2.249275 -1.059217
H 1.498279 3.723503 0.286884
H 1.760076 2.438864 1.479193
H 3.118342 3.076623 0.541422
H 1.802586 3.155899 -2.274782
H 3.392998 2.455613 -1.923446
H 2.178016 1.491489 -2.748313
H -1.496918 -3.722827 0.200674
H -1.784580 -2.455465 1.405441
H -3.122131 -3.079191 0.429241
H -1.744617 -3.118118 -2.358605
H -3.342656 -2.423231 -2.031988
H -2.110399 -1.447093 -2.816088
H 3.787890 -1.063059 1.500419
H 2.577799 -2.125301 0.686297
H -3.813025 1.046445 1.432679
H -2.586233 2.120090 0.659533
H 2.185150 -0.706591 3.429269
H 0.949259 -1.668804 2.623654
H 2.425238 -2.453077 3.225073
H -2.255441 0.665344 3.391844
H -0.998761 1.632346 2.625077
H -2.484802 2.415032 3.203326


%chk=000287566-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000287566

0 1
S 0.030329 0.011532 -2.071682
O 2.041511 0.042945 1.015826
O -2.053730 -0.053151 0.967396
O 3.782379 0.094926 -0.523352
O -3.762294 -0.079406 -0.608101
C 1.924616 1.753429 -0.705639
C -1.904678 -1.739369 -0.775862
C 0.414223 1.424849 -0.858017
C -0.389541 -1.415953 -0.886866
C 2.057152 2.934901 0.308465
C 2.555487 2.142582 -2.061204
C -2.066262 -2.935968 0.216088
C -2.504545 -2.103451 -2.152253
C 2.691983 0.553778 -0.117434
C -2.681322 -0.546311 -0.186421
C 2.724496 -1.088093 1.714776
C -2.750517 1.067785 1.669116
C 1.879733 -1.422344 2.940661
C -1.925554 1.390111 2.911589
H -0.040010 1.147431 0.105482
H -0.107329 2.309390 -1.264480
H 0.042011 -1.154597 0.091448
H 0.137507 -2.297341 -1.293127
H 1.535111 3.825435 -0.087285
H 1.619188 2.671933 1.287204
H 3.118819 3.201633 0.458907
H 2.057650 3.045397 -2.460746
H 3.632577 2.350992 -1.947677
H 2.444714 1.324093 -2.792897
H -1.542169 -3.823703 -0.183172
H -1.646378 -2.691502 1.207554
H -3.132473 -3.197622 0.340878
H -2.001301 -3.002082 -2.554420
H -3.584998 -2.308317 -2.068011
H -2.372006 -1.273635 -2.867375
H 3.748777 -0.767818 1.977949
H 2.802878 -1.934878 1.008715
H -3.777608 0.741309 1.913053
H -2.821030 1.922632 0.972034
H 1.815522 -0.556928 3.622521
H 0.854525 -1.710051 2.648445
H 2.335354 -2.265633 3.490989
H -1.867404 0.516506 3.583495
H -0.897439 1.686059 2.638448
H -2.393154 2.224406 3.465583


