%chk=000195868.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000195868

0 1
S 4.062274 0.190756 0.532317
P -1.151740 -0.113209 -1.407183
O 3.667524 0.493198 2.148627
O 4.037892 -1.247419 0.442590
O 5.276071 0.916565 0.275872
C 0.447238 0.802231 -1.050190
C -2.418440 0.808510 -0.378168
C -0.947409 -1.747323 -0.518888
C 1.531084 0.196802 -0.416049
C 2.720985 0.919194 -0.245330
C 0.541330 2.117782 -1.516753
C 2.820905 2.237438 -0.704962
C 1.730189 2.836396 -1.339584
C -2.062957 1.632222 0.691688
C -1.573072 -2.014248 0.699568
C -3.756250 0.651218 -0.746354
C -0.176168 -2.723215 -1.156638
C -3.061816 2.309395 1.401009
C -1.418026 -3.273888 1.291910
C -4.751664 1.327389 -0.029171
C -0.018964 -3.977430 -0.555359
C -4.404925 2.156354 1.041720
C -0.639687 -4.252897 0.667482
H 1.478295 -0.838224 -0.047941
H -0.296677 2.610451 -2.020568
H 3.754018 2.798543 -0.574163
H 1.806271 3.861750 -1.700111
H -1.022622 1.764415 0.994881
H -2.184779 -1.266770 1.209442
H -4.055128 0.013781 -1.581374
H 0.311986 -2.539850 -2.115996
H -2.792182 2.954707 2.235284
H -1.903560 -3.489065 2.242109
H -5.796984 1.208240 -0.308971
H 0.589107 -4.739418 -1.040764
H -5.180120 2.683325 1.596094
H -0.515790 -5.229838 1.132532
H 4.061491 -0.099567 2.802794


%chk=000195868-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000195868

0 1
S 3.996959 0.202934 0.799884
P -1.221681 -0.124896 -1.557186
O 3.325546 0.726089 2.455830
O 3.954448 -1.412876 0.730032
O 5.380463 0.996693 0.525892
C 0.395859 0.779721 -1.160509
C -2.421008 0.799551 -0.423018
C -0.970538 -1.755961 -0.634356
C 1.433742 0.210473 -0.382416
C 2.605276 0.963345 -0.209304
C 0.587572 2.069693 -1.727008
C 2.827010 2.239794 -0.745329
C 1.781624 2.794661 -1.520513
C -2.018119 1.553912 0.707906
C -1.397675 -1.980267 0.697686
C -3.800003 0.725667 -0.750021
C -0.344779 -2.811079 -1.349607
C -2.980533 2.222803 1.499346
C -1.196307 -3.240511 1.307240
C -4.762588 1.385271 0.047958
C -0.132248 -4.065664 -0.734905
C -4.354156 2.137646 1.173845
C -0.560177 -4.283420 0.595426
H 1.333825 -0.784999 0.062510
H -0.207585 2.508870 -2.340714
H 3.773346 2.763608 -0.579383
H 1.904820 3.787048 -1.965880
H -0.957150 1.625735 0.971960
H -1.891935 -1.178775 1.257063
H -4.119629 0.155428 -1.630381
H -0.026864 -2.652687 -2.387267
H -2.656229 2.804602 2.369449
H -1.532524 -3.403700 2.337274
H -5.824422 1.317920 -0.213794
H 0.360716 -4.868491 -1.293935
H -5.098546 2.655683 1.788843
H -0.400524 -5.257267 1.071452
H 3.921714 0.331743 3.157330


