%chk=000205850.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000205850

0 1
S 2.173016 0.440378 -1.901512
P 2.006609 0.354806 -0.022783
O 0.603032 1.100925 0.603253
O 3.041717 1.214804 0.917604
O 2.113405 -1.054713 0.791038
O -2.013758 -0.855105 -0.672101
N -0.656848 -0.635253 -0.441750
C -0.558682 0.553775 0.196637
C -1.860432 1.145156 0.406997
C -2.729785 0.238886 -0.147149
C -4.181870 0.149651 -0.316585
C 3.223766 2.601419 0.524905
C 2.071661 -2.265914 -0.017036
H -2.052416 2.080818 0.891355
H -4.484070 -0.778843 -0.832379
H -4.704846 0.168117 0.655193
H -4.571402 0.993430 -0.912571
H 3.966001 2.943664 1.263039
H 2.290472 3.166858 0.640421
H 3.636617 2.685433 -0.489319
H 1.125351 -2.350294 -0.573350
H 2.120204 -3.041440 0.762637
H 2.943758 -2.331059 -0.678141


%chk=000205850-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000205850

0 1
S 2.431523 0.467580 -2.112530
P 2.133748 0.364554 -0.083399
O 0.573616 1.062672 0.503512
O 3.116643 1.292147 0.966304
O 2.312266 -1.121381 0.739092
O -2.149554 -0.957768 -0.558545
N -0.713129 -0.764156 -0.346254
C -0.631128 0.496292 0.147765
C -1.905688 1.142463 0.284220
C -2.827412 0.210135 -0.159876
C -4.315955 0.182405 -0.302290
C 3.301614 2.730232 0.654536
C 2.103262 -2.389476 -0.015874
H -2.087897 2.145192 0.657805
H -4.637062 -0.792097 -0.704891
H -4.811680 0.337026 0.672233
H -4.665167 0.973978 -0.988455
H 4.095082 3.055998 1.342112
H 2.367814 3.284817 0.849154
H 3.621387 2.866003 -0.394981
H 1.047033 -2.465026 -0.321781
H 2.369812 -3.167462 0.713748
H 2.772371 -2.428629 -0.893201


