%chk=000185151.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000185151

0 1
S 1.802138 1.083554 0.901658
S 4.968950 -1.530411 -0.396677
O -5.371697 0.097237 0.265603
O -4.111205 -1.090176 -1.193307
C -3.430335 1.406161 0.945575
C 0.254385 0.583510 0.242469
C 2.700713 0.009084 -0.154061
C -2.182416 0.798080 0.385962
C -4.617475 1.316956 -0.010307
C -0.952171 1.180895 0.764226
C 4.123853 -0.027921 -0.067164
C 0.450904 -0.359497 -0.728555
C 1.835311 -0.685328 -0.953744
C 5.026647 0.947637 0.254075
C 6.395731 0.489728 0.231399
C 6.529538 -0.822336 -0.104664
C -5.013810 -1.061289 -0.389867
C -5.908212 -2.162618 0.058928
H -3.690261 0.886479 1.898176
H -3.265527 2.466863 1.230688
H -2.342142 0.000940 -0.351240
H -5.381170 2.090598 0.189883
H -4.321243 1.331346 -1.074786
H -0.812742 1.977563 1.501805
H -0.341044 -0.832880 -1.295973
H 2.131037 -1.410940 -1.701364
H 4.773591 1.971327 0.496342
H 7.215871 1.156552 0.463539
H 7.430779 -1.402740 -0.195557
H -6.671891 -1.821371 0.776251
H -5.326597 -2.963186 0.543908
H -6.429208 -2.616717 -0.799123


%chk=000185151-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000185151

0 1
S 1.826902 1.412908 0.621474
S 5.020919 -1.511074 -0.750856
O -5.296934 0.027405 0.271453
O -4.216996 -0.878676 -1.596276
C -3.503628 1.577522 1.037224
C 0.219028 0.613677 0.328214
C 2.702277 -0.036530 -0.036380
C -2.256253 0.796027 0.693972
C -4.663113 1.361930 0.043250
C -0.997628 1.331863 0.679667
C 4.144366 -0.054809 -0.092816
C 0.410289 -0.652521 -0.232947
C 1.778961 -1.011631 -0.431556
C 5.065791 0.920575 0.297693
C 6.440234 0.551781 0.092784
C 6.600438 -0.710363 -0.457683
C -5.006028 -1.004333 -0.633370
C -5.792809 -2.245402 -0.271024
H -3.877209 1.293437 2.043403
H -3.275529 2.660837 1.076150
H -2.397250 -0.264014 0.444219
H -5.478769 2.079838 0.230447
H -4.321967 1.423399 -1.004815
H -0.879902 2.390941 0.952245
H -0.423431 -1.298918 -0.517089
H 2.089168 -1.965974 -0.866232
H 4.759285 1.880490 0.722576
H 7.281854 1.201175 0.345039
H 7.514845 -1.240301 -0.717760
H -5.674487 -2.478423 0.800312
H -5.453835 -3.092370 -0.884587
H -6.868287 -2.071362 -0.452635


