%chk=000262773.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000262773

0 1
S 0.406232 0.998058 1.321183
O 4.958972 -1.148474 1.674242
O 4.811509 0.299220 -0.057545
C -0.788216 0.390842 0.034556
C -2.043188 0.259353 0.883758
C -0.926925 1.451685 -1.037745
C -0.283773 -0.942045 -0.471986
C 2.092326 0.902526 0.652952
C -2.852684 -0.884623 0.804629
C 0.191810 1.880020 -1.773817
C -0.161607 -1.216517 -1.840883
C -2.417462 1.302706 1.749821
C -2.178365 2.014799 -1.335643
C 0.046403 -1.949613 0.455400
C 2.830727 -0.259433 1.292396
C -3.993783 -1.000537 1.603085
C 0.069708 2.867566 -2.752357
C 0.318877 -2.457230 -2.275292
C -3.554715 1.177618 2.552174
C -2.300701 3.002309 -2.318194
C 0.523099 -3.185693 0.019227
C -4.343385 0.025222 2.485526
C -1.178039 3.437041 -3.026000
C 0.667929 -3.441783 -1.349416
C 4.267282 -0.286535 0.847578
C 6.369896 -1.339773 1.389558
H 2.088763 0.818257 -0.457971
H 2.584462 1.871234 0.884977
H -2.601803 -1.692651 0.115895
H 1.176084 1.435793 -1.591821
H -0.447873 -0.472243 -2.585825
H -1.839984 2.229572 1.796371
H -3.075087 1.687876 -0.806730
H -0.081676 -1.768451 1.525649
H 2.357849 -1.236060 1.027538
H 2.778765 -0.217183 2.405010
H -4.611145 -1.894915 1.535191
H 0.950233 3.193917 -3.304189
H 0.416493 -2.652413 -3.342422
H -3.827421 1.985214 3.230095
H -3.278739 3.432078 -2.530173
H 0.778282 -3.955778 0.745840
H -5.226969 -0.070047 3.113378
H -1.272765 4.209656 -3.786054
H 1.044455 -4.405014 -1.688114
H 6.470575 -1.926889 0.471939
H 6.868799 -0.370384 1.286065
H 6.720476 -1.889679 2.269044


%chk=000262773-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000262773

0 1
S 0.517129 1.017485 1.698039
O 5.136500 -1.386922 1.105230
O 4.614489 0.144298 -0.570753
C -0.741738 0.417565 0.308280
C -2.118205 0.374699 1.019330
C -0.863473 1.443805 -0.847330
C -0.223812 -0.958371 -0.143847
C 2.182210 0.892384 0.797394
C -3.055638 -0.657097 0.755847
C -0.226164 2.706554 -0.846722
C 0.428411 -1.142899 -1.389172
C -2.519200 1.451214 1.853867
C -1.717669 1.121914 -1.939379
C -0.294711 -2.067143 0.746451
C 2.972219 -0.355695 1.220667
C -4.347045 -0.625389 1.328360
C -0.423074 3.620282 -1.908736
C 0.983162 -2.396260 -1.741643
C -3.805227 1.479466 2.433285
C -1.915247 2.030484 -2.998682
C 0.247576 -3.318649 0.393779
C -4.727925 0.439837 2.174193
C -1.265332 3.287639 -2.991038
C 0.892163 -3.491452 -0.856463
C 4.291940 -0.467581 0.473852
C 6.440227 -1.623108 0.437776
H 1.990958 0.895768 -0.286453
H 2.727616 1.818405 1.044522
H -2.779261 -1.491706 0.103523
H 0.410955 2.981841 0.000054
H 0.506724 -0.307890 -2.092111
H -1.821047 2.272967 2.047259
H -2.239778 0.158651 -1.953897
H -0.756327 -1.932214 1.730160
H 2.382695 -1.267744 1.010689
H 3.171275 -0.362751 2.306885
H -5.054366 -1.433724 1.110499
H 0.082390 4.592336 -1.884404
H 1.489497 -2.508616 -2.706788
H -4.088945 2.316578 3.081066
H -2.580303 1.760501 -3.826870
H 0.179129 -4.156744 1.096451
H -5.728398 0.462482 2.620429
H -1.419497 3.995788 -3.812810
H 1.320673 -4.462441 -1.128586
H 6.282607 -2.012992 -0.582048
H 7.016185 -0.684206 0.379461
H 6.949351 -2.362749 1.071281


