%chk=000299451.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000299451

0 1
S -3.909652 0.822419 -0.175960
S 3.901885 0.854851 -0.181296
O -2.383947 1.202264 0.439707
O 2.373897 1.221579 0.436656
O -4.014115 -0.612184 -0.155937
O -4.051094 1.538761 -1.414791
O 4.034967 1.571855 -1.420691
O 4.019003 -0.578752 -0.160774
C -0.004043 0.979533 0.477942
C 0.001836 -0.317256 1.323180
C -1.254285 1.033684 -0.441139
C 1.244499 1.043991 -0.442762
C -0.008464 2.199655 1.410351
C 0.006844 -1.596653 0.529418
C 1.220657 -2.201797 0.167529
C -1.202184 -2.212047 0.168751
C 1.222612 -3.398558 -0.553545
C -1.194749 -3.408776 -0.552312
C 0.016299 -4.005487 -0.916450
C -4.851225 1.539798 1.092542
C 4.839219 1.581073 1.085317
H -0.883671 -0.297790 1.993846
H 0.887817 -0.290330 1.992966
H -1.238229 1.909009 -1.117316
H -1.365517 0.103255 -1.029222
H 1.362558 0.114602 -1.031168
H 1.220472 1.919231 -1.118814
H 0.882761 2.206080 2.049314
H -0.012674 3.138617 0.847059
H -0.898899 2.198754 2.050443
H 2.175722 -1.743104 0.441185
H -2.160814 -1.761423 0.443378
H 2.170906 -3.855684 -0.832919
H -2.139410 -3.873935 -0.830730
H 0.019935 -4.936225 -1.477947
H -5.506137 0.819580 1.609198
H -4.228304 1.989518 1.885669
H -5.507631 2.352181 0.741127
H 5.500154 0.866564 1.602229
H 5.489024 2.397999 0.732169
H 4.213678 2.027046 1.878495


%chk=000299451-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000299451

0 1
S -4.043126 0.839741 -0.375820
S 4.035304 0.875518 -0.380623
O -2.431930 1.065819 0.548855
O 2.423276 1.088364 0.545762
O -4.405809 -0.735203 -0.456443
O -4.019251 1.738709 -1.722780
O 4.002182 1.773311 -1.728162
O 4.411135 -0.696363 -0.460594
C -0.003758 0.977349 0.619930
C 0.003343 -0.350662 1.459890
C -1.236243 1.034415 -0.326074
C 1.226858 1.046605 -0.327693
C -0.009002 2.194971 1.579434
C 0.007766 -1.646980 0.658280
C 1.230455 -2.261844 0.275097
C -1.210789 -2.274140 0.281961
C 1.235315 -3.464889 -0.466840
C -1.207775 -3.477255 -0.459881
C 0.015774 -4.077973 -0.836806
C -5.084704 1.668664 0.975086
C 5.071188 1.714226 0.968637
H -0.887728 -0.317078 2.112541
H 0.896028 -0.309250 2.109867
H -1.217486 1.948057 -0.950608
H -1.262750 0.137579 -0.974353
H 1.260705 0.150519 -0.976671
H 1.198816 1.960474 -0.951541
H 0.889082 2.181964 2.219831
H -0.014807 3.146472 1.014834
H -0.905189 2.172526 2.222222
H 2.185378 -1.802472 0.557659
H -2.168615 -1.824231 0.569858
H 2.190663 -3.918540 -0.753535
H -2.160102 -3.940549 -0.741141
H 0.018876 -5.011621 -1.410777
H -6.129433 1.581785 0.646353
H -4.883420 1.107025 1.896411
H -4.738832 2.708325 1.029934
H 6.116747 1.631294 0.641541
H 4.720138 2.752366 1.019380
H 4.871423 1.154868 1.891678


