%chk=000234563.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000234563

0 1
S 4.372710 0.000437 -1.110759
O -5.503454 -1.411525 -0.717064
O 1.775674 2.254725 -1.475656
O -4.385423 -2.154607 1.072858
O 3.638881 -0.915548 1.274974
N 1.473215 0.807486 0.304155
N 4.733316 -2.419453 -0.067520
C -2.734129 0.359028 0.352734
C 0.047994 0.679786 0.278788
C -4.229509 0.214915 0.410592
C -1.920429 -0.330724 1.267355
C -2.144957 1.200850 -0.599927
C -0.538177 -0.177521 1.236597
C -0.760385 1.367496 -0.641581
C 2.242154 1.569650 -0.587689
C 3.736106 1.493856 -0.332255
C -4.652177 -1.224822 0.349990
C 4.190861 -1.195066 0.231173
H -4.722646 0.790475 -0.407818
H -4.613429 0.661071 1.358798
H -2.377486 -1.004960 1.997590
H -2.764766 1.734738 -1.320764
H 0.081032 -0.721138 1.948662
H -0.310525 2.028630 -1.390998
H 1.962816 0.234715 1.016013
H 4.238760 2.367972 -0.809124
H 3.995073 1.543564 0.747731
H -5.814794 -2.351670 -0.804140
H 5.184357 -2.630556 -0.944054
H 4.669437 -3.177805 0.600138


%chk=000234563-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000234563

0 1
S 4.476480 -0.131994 -1.189256
O -5.293066 -1.244725 -1.027122
O 1.748470 2.372605 -1.614477
O -4.567095 -2.258773 0.932142
O 3.441263 -0.901749 1.261984
N 1.456336 0.834701 0.154775
N 4.785267 -2.456183 0.168484
C -2.773293 0.364869 0.492670
C 0.042546 0.711446 0.221248
C -4.285907 0.186154 0.639738
C -1.875777 -0.350732 1.326661
C -2.237759 1.244641 -0.477561
C -0.486230 -0.180785 1.195123
C -0.846197 1.428757 -0.622943
C 2.210633 1.603050 -0.717842
C 3.723478 1.470601 -0.493233
C -4.711608 -1.221213 0.248874
C 4.161414 -1.240032 0.278285
H -4.822748 0.913754 0.012035
H -4.585710 0.334824 1.692970
H -2.269825 -1.050506 2.072264
H -2.916841 1.799887 -1.135492
H 0.197723 -0.739029 1.846246
H -0.440131 2.111922 -1.370913
H 2.005570 0.235271 0.796472
H 4.233063 2.273234 -1.044802
H 3.993950 1.501057 0.575572
H -5.518575 -2.184871 -1.267726
H 5.396296 -2.682228 -0.614977
H 4.628375 -3.149954 0.899597


