%chk=000270317.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000270317

0 1
S 1.916034 0.081694 -0.740881
S -0.028444 1.662438 0.949225
O 1.723166 -0.452732 -2.080102
O 2.785690 -0.661550 0.147478
O 1.138451 1.833496 1.801012
O -0.272064 2.710838 -0.035145
C 0.251280 0.163438 0.026196
C 0.169423 -1.035637 0.981589
C -0.767601 0.105271 -1.123795
C 0.373003 -2.407714 0.313289
C -2.192648 -0.325219 -0.747571
C 2.462603 1.739737 -0.850526
C -1.452649 1.459502 1.959751
C -0.148984 -3.542518 1.206566
C -3.120907 -0.254873 -1.970082
C 3.687298 1.806578 -1.750111
C -1.846891 2.808613 2.540688
C 0.086321 -4.907894 0.564658
C -4.538491 -0.705464 -1.627754
H -0.813732 -1.046788 1.494348
H 0.942181 -0.926653 1.781454
H -0.804088 1.091331 -1.643483
H -0.405148 -0.608164 -1.909894
H 1.456116 -2.572749 0.111453
H -0.123495 -2.448109 -0.675054
H -2.610426 0.311472 0.061494
H -2.184741 -1.359575 -0.348933
H 2.724089 2.160432 0.155543
H 1.685154 2.444424 -1.233958
H -1.279935 0.739305 2.786646
H -2.313107 1.035918 1.382046
H -1.229100 -3.406860 1.406899
H 0.355292 -3.505608 2.192981
H -2.715855 -0.884730 -2.787771
H -3.142271 0.778759 -2.370085
H 4.536779 1.245432 -1.333468
H 3.482693 1.408811 -2.756460
H 4.022661 2.845348 -1.876050
H -1.069675 3.214903 3.206050
H -2.033504 3.558460 1.754627
H -2.766826 2.730499 3.135496
H 1.154124 -5.089472 0.387958
H -0.420271 -4.994412 -0.403359
H -0.281489 -5.717306 1.204529
H -4.993050 -0.072425 -0.857889
H -5.188497 -0.661128 -2.510137
H -4.558970 -1.738519 -1.261967


%chk=000270317-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000270317

0 1
S 1.997024 0.054122 -0.723673
S -0.127283 1.717455 1.025193
O 1.863633 -0.516560 -2.258689
O 2.922985 -0.778075 0.338190
O 1.238901 1.911304 1.916122
O -0.538616 2.872696 -0.070502
C 0.031851 -0.006349 0.009753
C 0.030597 -1.164326 0.989291
C -0.865587 0.046783 -1.204786
C 0.153875 -2.556556 0.311325
C -2.363901 -0.253026 -0.939227
C 2.665260 1.900053 -0.843792
C -1.589472 1.583701 2.329247
C 0.135555 -3.689485 1.361770
C -3.160047 -0.336708 -2.262721
C 3.774912 1.922930 -1.885691
C -1.801969 2.978102 2.909317
C 0.262783 -5.086877 0.719190
C -4.662687 -0.602677 -2.034065
H -0.909151 -1.140713 1.581665
H 0.880276 -1.040508 1.691142
H -0.778705 1.046858 -1.673720
H -0.455617 -0.674775 -1.941734
H 1.101276 -2.605568 -0.255559
H -0.670930 -2.707804 -0.412436
H -2.805935 0.550499 -0.315511
H -2.480164 -1.204225 -0.383187
H 2.962604 2.094524 0.196883
H 1.770625 2.489522 -1.107382
H -1.212104 0.844380 3.052645
H -2.443632 1.195324 1.753114
H -0.802321 -3.635644 1.953406
H 0.969305 -3.532967 2.074709
H -2.729302 -1.138744 -2.895053
H -3.028975 0.609035 -2.824804
H 4.641404 1.315359 -1.574801
H 3.417405 1.556943 -2.863119
H 4.112648 2.969647 -2.008182
H -0.894523 3.336618 3.424242
H -2.072522 3.700436 2.120561
H -2.625990 2.939933 3.646188
H 1.207344 -5.174495 0.151437
H -0.570353 -5.282547 0.017901
H 0.253744 -5.883124 1.485603
H -5.124372 0.205729 -1.436139
H -5.208349 -0.664584 -2.992842
H -4.822002 -1.555020 -1.493779


