%chk=000290161.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000290161

0 1
S -1.056244 0.134465 0.004522
O 0.975495 -3.122426 0.068181
N 1.386951 -0.841112 0.034752
N 1.321764 1.558864 0.071042
C 2.836602 -0.964179 0.056367
C 0.736458 0.424214 0.035436
C 0.533576 -1.999142 0.032684
C -0.899700 -1.608300 -0.012325
C -1.917014 -2.474157 -0.039662
C 3.427856 -1.886134 0.936201
C 3.620074 -0.180611 -0.805548
C -3.338054 -2.098399 -0.083944
C 4.818268 -2.015706 0.947663
C 5.009532 -0.320943 -0.772041
C 0.682591 2.833130 0.064245
C 5.610359 -1.234860 0.099585
C -4.216831 -2.643160 0.868369
C -3.827289 -1.228477 -1.070978
C 0.847663 3.658514 1.192585
C 0.004485 3.299689 -1.076927
C -5.571088 -2.304387 0.839097
C -5.186158 -0.902378 -1.098654
C -6.057540 -1.435253 -0.143899
C 0.324763 4.951929 1.169715
C -0.507057 4.599078 -1.078897
C -0.352446 5.424265 0.039561
H -1.715017 -3.558338 -0.019551
H 2.811731 -2.507214 1.586768
H 3.158407 0.539903 -1.480678
H 5.285163 -2.731298 1.623749
H 5.626080 0.288112 -1.432462
H 6.693385 -1.338960 0.117419
H -3.841193 -3.320382 1.634529
H -3.153446 -0.814629 -1.821899
H 1.384394 3.288425 2.065059
H -0.110005 2.661627 -1.950458
H -6.250237 -2.719402 1.582980
H -5.565012 -0.228422 -1.866309
H -7.114910 -1.174946 -0.165251
H 0.446908 5.597733 2.038965
H -1.030636 4.969808 -1.959609
H -0.756327 6.434359 0.030819


%chk=000290161-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000290161

0 1
S -1.167113 0.436006 -0.063134
O 0.778120 -3.006197 0.232772
N 1.286350 -0.693705 0.117249
N 1.394995 1.684880 0.097571
C 2.724225 -0.883835 0.179297
C 0.715283 0.595862 0.043304
C 0.393787 -1.809363 0.146924
C -1.028070 -1.374220 0.059882
C -2.033597 -2.307261 0.060278
C 3.270823 -1.711170 1.186770
C 3.561055 -0.259377 -0.773325
C -3.486249 -2.171222 -0.019134
C 4.667244 -1.912126 1.236829
C 4.956086 -0.461227 -0.710228
C 0.928201 3.011502 -0.038409
C 5.513844 -1.287895 0.292597
C -4.257162 -3.374497 -0.050719
C -4.185754 -0.926628 -0.065206
C 1.514334 4.001696 0.797024
C -0.034412 3.402057 -1.013572
C -5.662002 -3.340784 -0.131775
C -5.592148 -0.895524 -0.145044
C -6.337899 -2.098082 -0.180335
C 1.114869 5.348723 0.688079
C -0.416191 4.756181 -1.123384
C 0.146789 5.734216 -0.270674
H -1.652737 -3.337948 0.128499
H 2.614074 -2.200921 1.910118
H 3.127699 0.382258 -1.545018
H 5.090832 -2.555879 2.015087
H 5.604880 0.024866 -1.446671
H 6.597161 -1.444486 0.336552
H -3.736039 -4.338948 -0.013061
H -3.638469 0.020188 -0.030512
H 2.272804 3.689955 1.521761
H -0.455670 2.656083 -1.696888
H -6.230317 -4.276810 -0.156304
H -6.110688 0.068962 -0.177568
H -7.431181 -2.066483 -0.242324
H 1.564873 6.100730 1.345654
H -1.151181 5.048045 -1.881957
H -0.155148 6.783278 -0.359805


