%chk=000286908.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000286908

0 1
S -1.302575 -0.438660 2.221703
S 1.830625 0.266692 -1.531965
O -1.060138 1.183471 2.613056
O 1.489054 1.461999 -0.343357
O -1.843883 -1.012755 3.417588
O -0.050117 -0.915016 1.668139
O 2.392300 0.961881 -2.652446
O 0.605568 -0.472784 -1.679747
O -5.201114 -0.173404 -3.156607
O -6.683982 0.155802 -1.614630
O 5.667650 -3.457735 2.397998
O 7.187964 -2.578151 1.131214
N -5.544537 -0.052606 -1.994177
N 6.033836 -2.739008 1.486377
C -0.382187 2.475295 0.690181
C 0.037292 1.888092 2.005986
C 0.366840 2.249679 -0.480914
C -2.520320 -0.348958 0.994839
C 3.030432 -0.601177 -0.656352
C -1.511009 3.301372 0.597231
C 0.028236 2.832070 -1.709494
C -1.876379 3.874235 -0.623104
C -1.104468 3.645432 -1.769088
C -3.852213 -0.137349 1.374515
C -2.173301 -0.482701 -0.349784
C 4.376409 -0.466443 -1.027174
C 2.659502 -1.423176 0.410016
C -4.484879 -0.164833 -0.948983
C -4.847308 -0.041977 0.400496
C -3.161580 -0.388652 -1.338658
C 4.978526 -1.989819 0.737158
C 5.362508 -1.164789 -0.330618
C 3.642106 -2.128546 1.118525
H 0.251969 2.681369 2.754666
H 0.922227 1.223715 1.913350
H -2.106668 3.486018 1.494214
H 0.643687 2.671590 -2.598062
H -2.759474 4.508748 -0.682176
H -4.122597 -0.053192 2.434485
H -1.125113 -0.666082 -0.656265
H -1.385974 4.107648 -2.716822
H 4.659790 0.185128 -1.865024
H 1.598665 -1.524966 0.714433
H -5.894916 0.124854 0.675411
H -2.899552 -0.487455 -2.399619
H 6.420622 -1.075703 -0.603824
H 3.366075 -2.776349 1.960512


%chk=000286908-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000286908

0 1
S -1.465773 -0.336856 2.325593
S 1.905692 0.419310 -1.591953
O -1.207456 1.538750 2.425331
O 1.912754 2.088092 -0.388246
O -2.091235 -0.756311 3.748012
O -0.083379 -0.982004 1.768095
O 2.553722 0.789285 -3.032223
O 0.415156 -0.228091 -1.513247
O -5.507115 -0.853225 -3.135890
O -7.075734 -0.903340 -1.479549
O 5.524498 -3.655891 2.496814
O 7.156415 -3.012369 1.037555
N -5.857667 -0.831543 -1.896241
N 5.942063 -2.998809 1.470354
C -0.196786 2.830143 0.573362
C 0.056694 2.012575 1.824415
C 0.759098 2.845083 -0.494901
C -2.805904 -0.487726 1.007704
C 3.136650 -0.633254 -0.630166
C -1.334462 3.662236 0.469616
C 0.553100 3.664397 -1.644370
C -1.542690 4.465051 -0.674772
C -0.595659 4.468502 -1.732448
C -4.133261 -0.573978 1.462563
C -2.415525 -0.513705 -0.341092
C 4.462150 -0.646434 -1.098496
C 2.675905 -1.343342 0.491497
C -4.780117 -0.712317 -0.871093
C -5.148465 -0.690687 0.492005
C -3.439262 -0.631286 -1.305513
C 4.951780 -2.162749 0.730442
C 5.394153 -1.438456 -0.397991
C 3.616034 -2.133269 1.186921
H 0.529872 2.625461 2.616345
H 0.736241 1.162729 1.616831
H -2.063255 3.661093 1.286832
H 1.303006 3.645014 -2.442090
H -2.437709 5.092719 -0.742627
H -4.359502 -0.564471 2.533026
H -1.363838 -0.449678 -0.647285
H -0.758009 5.097718 -2.613563
H 4.747581 -0.072169 -1.984904
H 1.631122 -1.296071 0.821043
H -6.202593 -0.764010 0.770285
H -3.208790 -0.658228 -2.373300
H 6.440437 -1.501894 -0.706564
H 3.327663 -2.713192 2.067088


