%chk=000284514.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000284514

0 1
S 0.009699 0.824563 0.479812
O 0.197276 1.753049 -0.640310
O -0.170691 1.305804 1.827326
O -2.665357 1.575746 0.443183
O 2.651817 1.501348 -0.289925
C -1.291834 -0.303315 -0.021720
C 1.360994 -0.349463 0.508000
C -0.778561 -1.661100 0.443955
C 0.739758 -1.707206 0.183168
C -2.638728 0.146100 0.551438
C 2.486960 0.086985 -0.448714
C -3.907093 -0.471298 -0.127304
C 3.903097 -0.506449 -0.125535
C -5.138954 0.167546 0.537183
C -3.916546 -0.163722 -1.633706
C -3.936345 -1.990266 0.098593
C 4.883701 0.062425 -1.167515
C 4.342058 -0.083283 1.282898
C 3.875401 -2.039639 -0.238296
H -1.366013 -0.300484 -1.139247
H 1.791784 -0.367253 1.544519
H -1.294926 -2.485220 -0.088462
H -0.996706 -1.822552 1.519293
H 1.209668 -2.506778 0.788492
H 0.933846 -1.985649 -0.872274
H -2.676926 -0.001553 1.658702
H 2.208830 -0.134989 -1.502475
H -5.237909 -0.131057 1.586377
H -6.065150 -0.112921 0.027317
H -5.070766 1.264606 0.528043
H -3.915060 0.915930 -1.825134
H -4.814001 -0.570209 -2.114324
H -3.051119 -0.597729 -2.146284
H -3.885882 -2.243509 1.162881
H -3.105596 -2.496302 -0.407501
H -4.864863 -2.425225 -0.290080
H 4.649940 -0.270473 -2.181870
H 5.914696 -0.231184 -0.950472
H 4.846744 1.162468 -1.162863
H 4.287285 1.012672 1.382170
H 5.371133 -0.385280 1.495213
H 3.700448 -0.508867 2.060687
H 3.489645 -2.373056 -1.205589
H 3.269129 -2.496780 0.549652
H 4.887673 -2.449837 -0.136995
H -2.770705 1.868815 -0.489494
H 2.007547 2.016190 -0.865515


%chk=000284514-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000284514

0 1
S -0.044520 0.905966 0.816864
O 0.182097 2.274379 -0.108356
O -0.503975 1.074372 2.373946
O -2.858494 1.588600 -0.488293
O 2.829542 1.612170 0.293758
C -1.349344 -0.266951 -0.098551
C 1.462830 -0.396892 0.666865
C -0.809198 -1.616098 0.379998
C 0.737449 -1.651524 0.135809
C -2.733313 0.314141 0.246278
C 2.559438 0.263499 -0.206939
C -3.969974 -0.559348 -0.156975
C 3.940583 -0.492226 -0.207386
C -5.238548 0.318369 0.035158
C -3.870640 -1.001884 -1.639291
C -4.095752 -1.791195 0.779115
C 4.900307 0.336958 -1.105296
C 4.512194 -0.563940 1.232010
C 3.820584 -1.917465 -0.806957
H -1.113851 -0.075344 -1.161176
H 1.762866 -0.459615 1.726087
H -1.273389 -2.438672 -0.191014
H -1.043448 -1.770598 1.449417
H 1.154803 -2.549982 0.622180
H 0.920925 -1.744531 -0.950872
H -2.777831 0.497477 1.344053
H 2.190844 0.299230 -1.258542
H -5.327366 0.664682 1.082133
H -6.141082 -0.272719 -0.208990
H -5.202868 1.208184 -0.612076
H -3.724760 -0.123320 -2.291851
H -4.800819 -1.512855 -1.948026
H -3.034283 -1.707788 -1.807611
H -4.127122 -1.484754 1.841805
H -3.275751 -2.518803 0.654881
H -5.039018 -2.323779 0.557736
H 4.521515 0.398519 -2.143820
H 5.896623 -0.142065 -1.134915
H 5.004370 1.362000 -0.716655
H 4.522871 0.439432 1.690023
H 5.546856 -0.951998 1.208523
H 3.921668 -1.239695 1.880331
H 3.352033 -1.901155 -1.810157
H 3.245773 -2.605562 -0.162623
H 4.831621 -2.348988 -0.922157
H -2.052679 2.160625 -0.348599
H 2.049630 2.202743 0.057455


