%chk=000284615.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000284615

0 1
S 0.833339 -0.295843 0.970024
O -2.384703 0.446993 -2.459432
O 0.666731 -1.635695 1.517487
O 0.651737 0.850783 1.847105
C -2.390463 -0.127745 1.083279
C -1.582256 0.488961 -0.114479
C -3.830222 -0.417148 -0.670101
C -3.850182 0.284580 0.714376
C -2.482913 -1.670247 0.934635
C -3.414943 -1.867345 -0.291346
C -2.577058 0.216559 -1.296293
C -0.246003 -0.184120 -0.426128
C -1.410797 1.997821 0.053606
C 2.412002 -0.188453 0.251240
C 3.023480 1.058359 0.094031
C 3.081054 -1.352468 -0.136373
C 4.294593 1.145621 -0.481670
C 4.352432 -1.268806 -0.712532
C 4.956361 -0.018813 -0.887425
H -2.033341 0.209334 2.066144
H -4.736705 -0.339552 -1.279283
H -4.017412 1.367912 0.667370
H -4.602050 -0.127541 1.399893
H -2.915164 -2.116975 1.845236
H -1.500061 -2.155874 0.816157
H -2.913716 -2.386257 -1.121464
H -4.300541 -2.468827 -0.034285
H 0.221433 0.351980 -1.280551
H -0.431939 -1.201413 -0.837773
H -0.970620 2.460063 -0.836773
H -2.363401 2.505308 0.245410
H -0.755417 2.227063 0.914106
H 2.515538 1.967565 0.433147
H 2.617742 -2.332588 0.022702
H 4.771118 2.116758 -0.606704
H 4.873660 -2.175161 -1.016969
H 5.948386 0.047911 -1.336070


%chk=000284615-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000284615

0 1
S 0.885132 -0.490847 0.994441
O -2.478202 0.373273 -2.531895
O 0.810599 -2.061970 1.464421
O 0.651370 0.722277 2.074285
C -2.472455 -0.080001 1.084610
C -1.654799 0.441121 -0.153460
C -3.955831 -0.367783 -0.650078
C -3.923150 0.369920 0.719964
C -2.637390 -1.630449 1.021079
C -3.593343 -1.838827 -0.210229
C -2.693416 0.176028 -1.313806
C -0.379511 -0.323433 -0.511960
C -1.358380 1.966772 -0.078244
C 2.595756 -0.226223 0.210039
C 3.114855 1.078081 0.178144
C 3.286394 -1.358281 -0.250650
C 4.401602 1.256677 -0.381998
C 4.571678 -1.159130 -0.807810
C 5.121285 0.143095 -0.877652
H -2.066875 0.292437 2.037264
H -4.854496 -0.285068 -1.277672
H -4.062670 1.460683 0.641846
H -4.670794 -0.032085 1.425596
H -3.115064 -1.981457 1.952827
H -1.679958 -2.170908 0.938543
H -3.128891 -2.413424 -1.031135
H -4.520779 -2.365377 0.075924
H 0.200598 0.186122 -1.297956
H -0.525196 -1.386169 -0.759983
H -0.953921 2.321644 -1.043704
H -2.269985 2.548951 0.136140
H -0.628039 2.158838 0.726554
H 2.547807 1.913558 0.602573
H 2.844559 -2.355181 -0.148005
H 4.841264 2.258661 -0.423041
H 5.141801 -2.017896 -1.177083
H 6.118144 0.289071 -1.307593


