%chk=000275683.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000275683

0 1
S 0.861109 1.647474 -0.050260
O -2.842781 3.234215 0.332355
O -0.677947 3.201474 0.122617
O -3.929831 -2.980652 0.342797
O -5.127044 -1.181956 0.483000
N -1.781775 2.652742 0.220790
N -4.064889 -1.769033 0.372955
C -0.497879 0.560532 0.064276
C -1.755296 1.190594 0.195542
C 2.235789 0.554564 -0.200114
C -0.427909 -0.843777 0.035813
C 4.536193 -1.007244 -0.446877
C -2.938853 0.442561 0.298321
C -2.842179 -0.948650 0.267479
C -1.587201 -1.594967 0.136232
C 2.686573 0.190324 -1.470814
C 2.920745 0.152986 0.948772
C 3.836759 -0.591867 -1.593651
C 4.070874 -0.629245 0.824806
C 5.774392 -1.829506 -0.579826
H 0.541453 -1.342701 -0.065573
H -3.913834 0.946536 0.400255
H -1.555737 -2.692915 0.116241
H 2.152301 0.513708 -2.365975
H 2.569049 0.447218 1.939259
H 4.195065 -0.875802 -2.581640
H 4.611002 -0.942194 1.716686
H 5.940270 -2.485431 0.285897
H 5.758856 -2.473520 -1.469957
H 6.662025 -1.182868 -0.667107


%chk=000275683-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000275683

0 1
S 0.955594 1.860430 -0.045709
O -3.334711 3.136369 0.376572
O -1.099424 3.545626 0.183059
O -3.726426 -3.113076 0.303989
O -5.109576 -1.301998 0.467151
N -2.112546 2.741628 0.259374
N -3.942470 -1.839355 0.347621
C -0.509101 0.772822 0.073848
C -1.838269 1.289478 0.207552
C 2.319897 0.608912 -0.200689
C -0.370534 -0.644381 0.035564
C 4.558415 -1.128449 -0.450519
C -2.963592 0.443665 0.297482
C -2.769368 -0.942920 0.254212
C -1.474760 -1.499741 0.123357
C 2.747980 0.192956 -1.481706
C 3.005408 0.174240 0.956119
C 3.856929 -0.674242 -1.598835
C 4.113234 -0.692656 0.825542
C 5.772469 -2.028877 -0.585202
H 0.629336 -1.073509 -0.065364
H -3.962661 0.875470 0.398733
H -1.357688 -2.586112 0.093096
H 2.220839 0.543105 -2.375376
H 2.677287 0.509477 1.945584
H 4.183599 -0.997144 -2.594247
H 4.640266 -1.029901 1.725711
H 5.901812 -2.672861 0.301797
H 5.701158 -2.678639 -1.474677
H 6.696198 -1.427716 -0.691739


