%chk=000186790.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000186790

0 1
S -0.416738 -1.140631 -1.464901
P -1.329065 -1.416803 0.215476
O -2.084275 -0.124093 0.878629
O -0.360622 -1.977912 1.447651
O 1.496465 0.233729 0.270260
O 2.668125 -1.160268 -1.076042
C -1.364096 1.159620 0.980440
C -2.401143 2.171776 0.477633
C -1.028645 1.313695 2.457977
C -2.260237 2.442554 -1.015442
C -2.711366 -2.644922 0.216580
C 1.067320 -2.014315 1.229307
C 1.699344 -0.635578 1.408956
C 1.749696 0.948026 -1.960469
C 2.018422 -0.149691 -0.967373
C 3.011935 1.775934 -2.172477
H -0.440366 1.158835 0.351838
H -2.320539 3.117713 1.046301
H -3.417068 1.775024 0.696323
H -0.721738 2.336195 2.701003
H -0.207104 0.639416 2.752259
H -1.891665 1.058331 3.087796
H -2.329762 1.515389 -1.601899
H -1.298944 2.908871 -1.258381
H -3.050725 3.112003 -1.373199
H -2.586296 -3.396419 -0.577375
H -3.680091 -2.146040 0.056514
H -2.766849 -3.175513 1.179694
H 1.383888 -2.704028 2.041156
H 1.331003 -2.473280 0.250321
H 1.206136 -0.052070 2.219767
H 2.786563 -0.720030 1.589778
H 1.417263 0.488404 -2.919006
H 0.907442 1.588572 -1.620596
H 3.852061 1.152248 -2.508787
H 2.849600 2.545366 -2.937124
H 3.324070 2.285391 -1.252386


%chk=000186790-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000186790

0 1
S -0.734090 -1.097112 -1.879240
P -1.455958 -1.416287 0.048999
O -2.046145 -0.039899 0.921501
O -0.333486 -2.237113 1.127734
O 1.823113 -0.040184 0.709258
O 3.531242 -0.661032 -0.756534
C -1.486964 1.344420 0.749100
C -2.674858 2.261912 0.402799
C -0.783507 1.730178 2.055386
C -3.361468 1.924212 -0.935573
C -2.925764 -2.511573 0.282511
C 1.088980 -2.413112 0.775594
C 1.977398 -1.343886 1.407429
C 2.284466 1.451124 -1.119604
C 2.649677 0.157906 -0.417963
C 3.394176 1.955982 -2.060145
H -0.767868 1.318092 -0.095122
H -2.291801 3.302402 0.379391
H -3.407021 2.211051 1.232302
H -0.427493 2.776038 1.997876
H 0.087071 1.080541 2.236663
H -1.482719 1.647418 2.906122
H -3.783218 0.904072 -0.913136
H -2.647555 1.970505 -1.778025
H -4.185873 2.630253 -1.143459
H -2.701517 -3.503356 -0.136291
H -3.790914 -2.067980 -0.231723
H -3.126728 -2.591666 1.361862
H 1.352777 -3.402474 1.189799
H 1.215715 -2.429948 -0.324635
H 1.678407 -1.145316 2.448439
H 3.035312 -1.660806 1.356458
H 1.357350 1.236731 -1.690642
H 2.014285 2.203997 -0.357118
H 3.671630 1.176146 -2.788995
H 3.050361 2.847702 -2.613150
H 4.304984 2.226561 -1.497665


