%chk=000283811.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000283811

0 1
S 2.265809 1.350833 -0.015272
O 2.516044 3.030616 -0.015500
O 2.803479 0.862871 -1.259909
O 2.806645 0.862518 1.227738
C -0.232152 0.318676 -0.013674
C -1.714982 0.443992 -0.012911
C 0.273445 -1.077559 -0.015472
C 0.557478 1.395617 -0.013487
C -2.411098 0.484600 1.203289
C 0.508987 -1.733286 -1.232699
C -2.409149 0.514419 -1.228887
C 0.495705 -1.741555 1.199782
C -3.804322 0.595669 1.198922
C 0.962586 -3.055098 -1.230304
C -3.802397 0.625132 -1.224069
C 0.949458 -3.063275 1.193375
C -4.500234 0.665519 -0.012459
C 1.180578 -3.720706 -0.019497
C 3.884026 3.452882 -0.018999
H 0.117867 2.404359 -0.012033
H -1.868919 0.430790 2.146429
H 0.355797 -1.209788 -2.176279
H -1.865366 0.483687 -2.172165
H 0.332025 -1.224564 2.145107
H -4.348149 0.627485 2.142335
H 1.154089 -3.563185 -2.174657
H -4.344711 0.679806 -2.167305
H 1.130733 -3.577818 2.136235
H -5.585973 0.751209 -0.012275
H 1.537589 -4.749883 -0.021022
H 4.387192 3.098769 -0.927729
H 4.391143 3.100467 0.888184
H 3.822479 4.549300 -0.019891


%chk=000283811-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000283811

0 1
S 2.401126 1.281860 0.095011
O 2.436271 3.114105 -0.362043
O 3.032611 0.397889 -1.105046
O 3.066468 1.159206 1.575669
C -0.247679 0.188239 0.043471
C -1.716676 0.413320 -0.143334
C 0.252403 -1.209757 0.177718
C 0.541414 1.301083 0.104673
C -2.659010 -0.420075 0.520771
C -0.249234 -2.225307 -0.683040
C -2.196140 1.468628 -0.968647
C 1.220637 -1.554124 1.160904
C -4.043419 -0.189882 0.378062
C 0.228397 -3.547509 -0.583401
C -3.581034 1.693254 -1.112914
C 1.687291 -2.881459 1.263780
C -4.510147 0.868177 -0.436675
C 1.199276 -3.880307 0.390909
C 3.786626 3.687141 -0.227462
H 0.206205 2.339743 0.114548
H -2.302377 -1.235790 1.158177
H -0.994892 -1.968957 -1.443268
H -1.482246 2.087375 -1.523807
H 1.593802 -0.795955 1.858223
H -4.757346 -0.833360 0.903463
H -0.151480 -4.315789 -1.265427
H -3.935614 2.502506 -1.760341
H 2.432644 -3.132662 2.025686
H -5.585709 1.042441 -0.550384
H 1.568990 -4.908605 0.470131
H 4.461820 3.319054 -1.021149
H 4.211202 3.474404 0.771426
H 3.631522 4.773616 -0.340781


