%chk=000270310.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000270310

0 1
S 0.590434 1.216219 0.645586
O -0.470000 0.054225 0.004441
O -4.462736 -0.728324 -1.418255
O 0.361367 1.196733 2.070960
O 0.376844 2.428585 -0.104308
C -2.514588 -1.298017 0.086345
C -2.813976 0.881969 -0.374287
C -1.802966 0.043564 0.496204
C -3.516930 -0.450438 -0.748006
C -1.681872 -2.229912 -0.771443
C -3.179322 -2.006630 1.252574
C -3.693386 1.802248 0.451560
C -2.211368 1.572523 -1.579706
C 2.078671 0.484007 0.226974
C 2.694018 0.791193 -0.993744
C 2.685525 -0.424371 1.104364
C 3.904469 0.192863 -1.338935
C 3.896154 -1.025265 0.764536
C 4.514124 -0.723325 -0.462719
C 5.815107 -1.355360 -0.823600
H -1.811872 0.263930 1.577803
H -2.309689 -2.968378 -1.283950
H -0.942433 -2.768865 -0.167037
H -1.116235 -1.673357 -1.532765
H -3.809820 -1.336030 1.848073
H -2.433726 -2.443693 1.928451
H -3.821648 -2.824817 0.898469
H -4.522715 2.197947 -0.150850
H -3.122025 2.664970 0.821303
H -4.133177 1.300610 1.320519
H -2.987163 1.954896 -2.252754
H -1.564646 0.897886 -2.154895
H -1.579261 2.425042 -1.274978
H 2.227013 1.509712 -1.678072
H 2.212180 -0.659204 2.065080
H 4.378617 0.437101 -2.288275
H 4.364237 -1.728361 1.451640
H 5.937301 -2.354521 -0.381619
H 5.943277 -1.469477 -1.909546
H 6.658012 -0.742179 -0.465238


%chk=000270310-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000270310

0 1
S 0.610914 1.288805 0.615558
O -0.504497 -0.053928 -0.133818
O -4.914254 -0.637504 -0.954862
O 0.346630 1.277587 2.217785
O 0.453433 2.667886 -0.223112
C -2.665065 -1.345599 0.058633
C -2.923955 0.882346 -0.365450
C -1.860728 -0.014946 0.395707
C -3.761181 -0.413081 -0.538391
C -2.011018 -2.260238 -1.002968
C -3.122210 -2.156082 1.287717
C -3.594204 1.970839 0.497323
C -2.437069 1.458427 -1.715513
C 2.245253 0.480350 0.209545
C 2.887173 0.849784 -0.982696
C 2.767790 -0.448737 1.123115
C 4.129793 0.243257 -1.267588
C 4.011872 -1.038027 0.812295
C 4.707895 -0.704129 -0.380993
C 6.058784 -1.322999 -0.686054
H -1.831420 0.188094 1.484430
H -2.746609 -3.010648 -1.343717
H -1.141983 -2.783787 -0.566918
H -1.654705 -1.694350 -1.879900
H -3.599195 -1.515539 2.051510
H -2.258012 -2.664692 1.753715
H -3.856873 -2.923138 0.982829
H -4.480341 2.380046 -0.019659
H -2.882476 2.796566 0.681684
H -3.924897 1.576296 1.475942
H -3.297268 1.868537 -2.273692
H -1.945239 0.693714 -2.341064
H -1.704412 2.265340 -1.533320
H 2.438851 1.590222 -1.652433
H 2.231000 -0.689449 2.045983
H 4.655354 0.510012 -2.191246
H 4.446660 -1.766867 1.505427
H 6.146573 -2.337847 -0.261547
H 6.240682 -1.387349 -1.772569
H 6.874748 -0.713474 -0.251788


