%chk=000291741.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000291741

0 1
S 5.718820 -1.024283 0.602965
O 0.587222 1.059462 -1.303936
O -0.454542 -1.338214 -0.678355
O -4.578967 0.931545 1.779342
O 6.659935 -0.972372 -0.499861
O 6.050804 -0.451748 1.894385
N 5.450560 -2.697362 0.901013
C -1.466569 0.727967 -0.072277
C -2.541247 1.307754 0.630704
C -0.407216 1.560213 -0.446167
C -2.790630 -1.427928 -0.308058
C -3.873534 -0.844643 0.373376
C -1.465200 -0.737006 -0.390583
C -3.744214 0.499669 1.012033
C -0.359773 2.937765 -0.118598
C -2.513873 2.662185 0.973097
C -1.431405 3.470197 0.603566
C -2.935537 -2.686274 -0.900414
C -5.091773 -1.526061 0.460777
C 0.800787 3.772661 -0.527745
C 1.751773 0.560846 -0.748756
C -4.161556 -3.360383 -0.820904
C -5.235449 -2.783082 -0.141389
C 4.197211 -0.423034 0.086578
C 2.042729 0.560697 0.622765
C 2.657342 0.085045 -1.718393
C 3.278289 0.056263 1.027795
C 3.879686 -0.409587 -1.282219
H -3.352616 3.088025 1.536248
H -1.428691 4.526194 0.880643
H -2.084275 -3.138856 -1.418333
H -5.925090 -1.070118 1.004329
H 1.608786 3.722915 0.220721
H 1.233954 3.431514 -1.483524
H 0.538584 4.832125 -0.653122
H -4.271296 -4.339713 -1.288440
H -6.188450 -3.309251 -0.074275
H 1.324414 0.922647 1.352803
H 2.381537 0.097755 -2.770967
H 3.532809 0.049027 2.095059
H 4.606936 -0.781186 -2.015160
H 5.889064 -3.373139 0.280321
H 5.517863 -3.031631 1.859157


%chk=000291741-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000291741

0 1
S 5.355022 -1.690836 0.734494
O 0.768301 1.662162 -1.311592
O -0.349867 -0.842073 -1.422624
O -4.689636 0.969949 1.462680
O 6.499531 -1.654590 -0.425854
O 5.636962 -1.278427 2.285618
N 4.703544 -3.414695 0.811692
C -1.405227 1.018958 -0.272034
C -2.565376 1.474385 0.436081
C -0.390133 1.978661 -0.565084
C -2.448757 -1.324369 -0.362490
C -3.575803 -0.874487 0.381788
C -1.323055 -0.405935 -0.730074
C -3.683570 0.548616 0.807022
C -0.519226 3.353669 -0.221607
C -2.692189 2.833289 0.801628
C -1.687881 3.759388 0.466781
C -2.374368 -2.681406 -0.764579
C -4.612071 -1.781537 0.715420
C 0.573109 4.334972 -0.584141
C 1.774573 0.832423 -0.779760
C -3.407998 -3.578625 -0.430404
C -4.529913 -3.128552 0.312225
C 3.898370 -0.687689 0.120843
C 1.898880 0.574621 0.606249
C 2.717986 0.345182 -1.712093
C 2.980185 -0.204237 1.065695
C 3.801124 -0.429142 -1.258007
H -3.593973 3.136207 1.342046
H -1.798753 4.812834 0.745733
H -1.497929 -3.004253 -1.334757
H -5.465508 -1.403803 1.287109
H 1.542698 4.039805 -0.143108
H 0.728312 4.367764 -1.677510
H 0.324767 5.349798 -0.232668
H -3.344970 -4.626074 -0.743766
H -5.331276 -3.828636 0.570838
H 1.168683 0.973676 1.316585
H 2.580042 0.566745 -2.773137
H 3.121795 -0.406903 2.131821
H 4.561266 -0.808973 -1.947553
H 5.158766 -3.966972 0.065739
H 4.900764 -3.774293 1.760956


