%chk=000212477.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000212477

0 1
S -0.486173 3.753312 -0.072495
O 1.053789 3.109254 -0.215817
O -1.165058 3.287858 -1.511719
O -1.114650 3.019618 1.023937
C 1.723161 0.886142 -0.797647
C -2.725769 1.441514 -1.138864
C 2.251335 -0.420357 -0.279078
C -2.492867 0.117385 -0.466025
C 1.409597 1.842107 0.357654
C -1.476626 1.937861 -1.873792
C 3.629714 -0.595952 -0.082592
C -2.684422 -1.079840 -1.172065
C 1.368497 -1.469639 0.017356
C -2.085519 0.074569 0.876404
C 4.117850 -1.812344 0.402173
C -2.481343 -2.307537 -0.535125
C 1.862426 -2.683277 0.501976
C -1.887465 -1.154661 1.508365
C 3.236676 -2.858098 0.694853
C -2.086309 -2.348334 0.805445
H 0.803667 0.729816 -1.413128
H 2.446554 1.367740 -1.488646
H -3.040566 2.202166 -0.387545
H -3.582931 1.377390 -1.838654
H 2.307041 2.065027 0.966463
H 0.603568 1.461086 1.015063
H -1.643627 2.024465 -2.965707
H -0.586173 1.294589 -1.692895
H 4.320090 0.214180 -0.308017
H -2.997384 -1.056175 -2.213229
H 0.294342 -1.339733 -0.126026
H -1.924390 1.010545 1.424409
H 5.187924 -1.945213 0.551960
H -2.635513 -3.234292 -1.084955
H 1.172618 -3.494296 0.729948
H -1.578123 -1.182821 2.552224
H 3.618869 -3.804127 1.071351
H -1.936811 -3.304328 1.301638


%chk=000212477-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000212477

0 1
S -0.017978 3.636325 -0.190250
O 1.775172 3.346506 -0.617505
O -0.935101 2.608821 -1.474191
O -0.258373 2.850266 1.207236
C 2.451291 0.965990 -0.963149
C -2.986100 1.346328 -0.898387
C 3.179686 -0.211329 -0.329669
C -3.531598 -0.018198 -0.500391
C 2.392973 2.160261 0.016180
C -1.443470 1.308634 -0.988841
C 4.575088 -0.386160 -0.516102
C -3.961113 -0.944371 -1.485287
C 2.485501 -1.130560 0.499440
C -3.573840 -0.408709 0.863805
C 5.260891 -1.453236 0.107333
C -4.424961 -2.228258 -1.118499
C 3.166679 -2.199392 1.123662
C -4.038300 -1.690426 1.234733
C 4.558309 -2.363602 0.930333
C -4.464493 -2.605651 0.243702
H 1.421196 0.680522 -1.243515
H 2.963524 1.295080 -1.884785
H -3.272404 2.116371 -0.158467
H -3.387377 1.658312 -1.879241
H 3.407059 2.499093 0.296376
H 1.844343 1.896704 0.944743
H -1.100280 0.554881 -1.721648
H -1.014263 1.073655 0.008438
H 5.124114 0.312867 -1.159616
H -3.938574 -0.654284 -2.543320
H 1.404532 -1.012956 0.649509
H -3.249543 0.299439 1.636922
H 6.338142 -1.577116 -0.051667
H -4.758235 -2.930044 -1.891489
H 2.614326 -2.903767 1.755882
H -4.071643 -1.973842 2.292883
H 5.087784 -3.193295 1.411898
H -4.826961 -3.599262 0.530140


