%chk=000230035.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000230035

0 1
S -0.966936 2.209376 -0.901268
S -2.960985 2.209163 1.320933
S -3.548227 1.228538 -1.469136
S -2.926477 0.602219 2.661712
S 0.854424 3.253286 1.949280
P 0.711477 2.224925 0.365804
O 0.864621 0.582410 0.485803
O 1.839775 2.720292 -0.726056
C -1.662871 -2.483561 -0.791358
C -1.337649 -0.961748 -0.787444
C -1.989658 -0.111932 0.261458
C -3.180286 -2.716965 -0.757830
C -1.090340 -3.072892 -2.100129
C -0.985857 -3.192610 0.396646
C -2.345311 1.293625 -0.112842
C -2.221211 -0.502680 1.524233
C 1.518911 0.020859 1.666202
C 2.198891 1.873248 -1.852724
C -4.302673 2.861958 -1.503599
C 2.107138 -1.285889 1.135609
C 3.352813 0.959257 -1.443953
C 2.983262 -1.973282 2.186397
C 4.061639 0.381001 -2.674182
C 3.555544 -3.288273 1.663794
C 5.190961 -0.565741 -2.275336
H -1.558695 -0.565127 -1.802910
H -0.230503 -0.836012 -0.676801
H -3.678927 -2.227448 -1.602157
H -3.638965 -2.316613 0.152780
H -3.424038 -3.782756 -0.804839
H -1.547440 -2.615198 -2.983583
H -0.008725 -2.926130 -2.172318
H -1.278967 -4.149584 -2.164465
H -1.458946 -2.926370 1.351933
H 0.080206 -2.921318 0.474846
H -1.046523 -4.280844 0.300129
H -1.995152 -1.504363 1.905967
H 2.294065 0.695147 2.073017
H 0.723923 -0.140511 2.419409
H 1.335693 1.316069 -2.254737
H 2.515114 2.641366 -2.590113
H -4.926989 3.049352 -0.619000
H -3.564857 3.670668 -1.588848
H -4.951159 2.902001 -2.391217
H 1.284536 -1.965008 0.806069
H 2.694124 -1.067336 0.210839
H 2.985142 0.130961 -0.792500
H 4.069414 1.530813 -0.818425
H 2.394307 -2.161403 3.106542
H 3.810948 -1.300745 2.489834
H 4.468650 1.202796 -3.297184
H 3.333501 -0.155232 -3.314464
H 4.176752 -3.135049 0.773771
H 4.183843 -3.773446 2.420367
H 2.764327 -3.997218 1.393824
H 4.821646 -1.416454 -1.691659
H 5.699121 -0.969503 -3.158778
H 5.948698 -0.056385 -1.667740


%chk=000230035-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000230035

0 1
S -1.083823 2.278444 -0.819404
S -1.973818 1.785902 2.024641
S -3.770783 1.020145 -0.516310
S -2.136466 -0.287982 3.034636
S 1.481212 4.026835 1.502057
P 1.073014 2.543674 0.141712
O 1.403621 0.893229 0.599402
O 1.989800 2.736083 -1.318888
C -1.471112 -2.418948 -1.472494
C -1.043223 -0.979285 -1.022269
C -1.528817 -0.401431 0.303049
C -3.010685 -2.586609 -1.416514
C -0.995885 -2.564464 -2.947723
C -0.785399 -3.539196 -0.640926
C -2.010528 1.041298 0.297975
C -1.588656 -1.068913 1.489219
C 1.831436 0.580734 1.996250
C 2.010201 1.667060 -2.364126
C -4.400713 2.748019 -0.110897
C 2.243665 -0.892318 2.001539
C 3.240120 0.765052 -2.214857
C 2.657168 -1.359817 3.418348
C 3.323074 -0.268967 -3.364302
C 3.080800 -2.844249 3.442727
C 4.557449 -1.187609 -3.237127
H -1.370136 -0.278378 -1.815457
H 0.066360 -0.930320 -1.018204
H -3.515033 -1.827756 -2.043252
H -3.392109 -2.476161 -0.385697
H -3.303186 -3.587405 -1.786162
H -1.475110 -1.808106 -3.597256
H 0.102033 -2.440333 -3.029748
H -1.254056 -3.564482 -3.342609
H -1.217993 -3.640374 0.370039
H 0.301854 -3.357792 -0.539551
H -0.919816 -4.516518 -1.141677
H -1.345607 -2.125529 1.608318
H 2.670396 1.245887 2.276168
H 0.981934 0.765950 2.679391
H 1.069361 1.083412 -2.323532
H 2.038460 2.233671 -3.311631
H -4.289826 2.924826 0.970555
H -3.858253 3.507252 -0.690932
H -5.467597 2.741560 -0.385658
H 1.394488 -1.503259 1.640225
H 3.082807 -1.042534 1.294590
H 3.194175 0.243089 -1.240955
H 4.151001 1.393796 -2.211568
H 1.811627 -1.202481 4.117526
H 3.492221 -0.731039 3.787611
H 3.354729 0.259325 -4.338853
H 2.401137 -0.887512 -3.373838
H 3.946378 -3.021524 2.777179
H 3.367001 -3.162753 4.461494
H 2.255888 -3.498733 3.103198
H 4.535366 -1.751821 -2.285913
H 4.601959 -1.918941 -4.064592
H 5.492991 -0.598000 -3.255322


