%chk=000285263.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000285263

0 1
S -2.827630 0.840976 1.250410
S 2.826285 0.829264 -1.252096
O -2.073223 0.464355 -1.618376
O 2.070947 0.468305 1.618299
O -2.960618 2.212835 0.854310
O -2.609957 0.509282 2.647110
O 2.963747 2.202161 -0.861149
O 2.607259 0.493266 -2.647600
N -1.341585 0.219986 0.506816
N 1.338882 0.215244 -0.505723
C -0.238640 -0.184409 1.404172
C 0.235215 -0.191295 -1.401222
C -1.139539 0.207796 -0.880477
C 1.136804 0.209902 0.881663
C -4.074679 -0.135505 0.614332
C 4.070927 -0.148591 -0.613305
C -4.576709 -1.202128 1.376279
C 4.571053 -1.217732 -1.372992
C -4.628399 0.138484 -0.643833
C 4.624617 0.126574 0.644602
C -5.614748 -1.988830 0.887161
C 5.605854 -2.006930 -0.881069
C -5.670891 -0.646189 -1.137887
C 5.663636 -0.660820 1.141634
C -6.172729 -1.714561 -0.377272
C 6.161069 -1.733980 0.384868
C -7.277445 -2.563281 -0.908419
C 7.280719 -2.568393 0.907226
H -0.258220 -1.289871 1.568931
H -0.382584 0.272748 2.425066
H 0.252881 -1.297514 -1.560957
H 0.379926 0.261054 -2.424153
H -4.154191 -1.411757 2.366844
H 4.149476 -1.427476 -2.363947
H -4.234398 0.967525 -1.251007
H 4.233218 0.958642 1.249348
H -5.999166 -2.814105 1.483431
H 5.990576 -2.832543 -1.476679
H -6.090897 -0.426899 -2.118645
H 6.085034 -0.439261 2.121282
H -6.873804 -3.407440 -1.490375
H -7.902248 -2.992354 -0.112425
H -7.950494 -2.008410 -1.578043
H 7.285338 -2.628602 2.005127
H 7.252396 -3.600290 0.530282
H 8.252937 -2.144333 0.607360


%chk=000285263-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000285263

0 1
S -3.036646 1.069328 1.047226
S 3.038247 1.042089 -1.071770
O -2.034935 0.582266 -1.827300
O 2.035211 0.607756 1.811345
O -3.298481 2.532025 0.418120
O -2.835801 0.878839 2.650772
O 3.306546 2.513830 -0.466912
O 2.835448 0.826338 -2.671924
N -1.321085 0.384708 0.387914
N 1.320751 0.374137 -0.400217
C -0.318609 0.057027 1.403907
C 0.317295 0.032026 -1.410447
C -1.126697 0.374018 -0.974455
C 1.126365 0.387535 0.962172
C -4.340206 -0.157381 0.462450
C 4.337820 -0.179952 -0.468960
C -4.762008 -1.127369 1.385101
C 4.752776 -1.167610 -1.375898
C -4.874218 -0.008404 -0.827670
C 4.872709 -0.014277 0.818698
C -5.786426 -2.009214 0.973380
C 5.771394 -2.049479 -0.950420
C -5.898079 -0.902232 -1.204996
C 5.890875 -0.908736 1.210052
C -6.364690 -1.912523 -0.319480
C 6.353674 -1.933253 0.339075
C -7.456239 -2.870944 -0.756898
C 7.465024 -2.868023 0.777553
H -0.358846 -1.016534 1.678322
H -0.526769 0.635947 2.320768
H 0.354601 -1.046149 -1.666580
H 0.527020 0.594723 -2.337005
H -4.327054 -1.173008 2.388469
H 4.313640 -1.229343 -2.376577
H -4.495188 0.759964 -1.506401
H 4.495215 0.763838 1.487122
H -6.144042 -2.774276 1.671245
H 6.120675 -2.830618 -1.634565
H -6.338407 -0.813373 -2.204499
H 6.328503 -0.809727 2.209809
H -7.075672 -3.583952 -1.512902
H -7.846692 -3.459074 0.090390
H -8.302922 -2.331418 -1.218191
H 7.294090 -3.244348 1.801999
H 7.558151 -3.736576 0.104176
H 8.439683 -2.343703 0.782903


