%chk=000284327.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000284327

0 1
S 0.844599 -0.767751 0.688405
O 1.692833 -1.877325 0.328558
O 0.221836 -0.688482 1.982629
O -1.095057 -2.311398 -2.091511
O -1.423396 -2.640414 0.025758
N 1.662434 0.705247 0.449963
N -1.030702 -1.996062 -0.922654
C 3.061616 0.762444 -0.103114
C -0.396989 -0.653933 -0.629627
C 3.439281 2.251360 -0.214963
C 4.037928 0.037993 0.837530
C 3.071801 0.105930 -1.491817
C -1.454682 0.354858 -0.282265
C -1.640693 1.470319 -1.113966
C -2.261822 0.183832 0.853380
C -2.625470 2.411690 -0.803567
C -3.245810 1.128234 1.154251
C -3.429324 2.241996 0.328444
H 1.474086 1.451437 1.135283
H 0.131571 -0.324719 -1.574655
H 3.496160 2.741031 0.762870
H 4.420995 2.369906 -0.687973
H 2.716917 2.807121 -0.824542
H 3.831651 -1.044047 0.884467
H 3.999600 0.424042 1.860388
H 5.072507 0.139359 0.492496
H 2.338148 0.555707 -2.166920
H 4.054623 0.215161 -1.966058
H 2.880361 -0.977735 -1.438528
H -1.022914 1.607246 -2.000259
H -2.112533 -0.681722 1.511934
H -2.769013 3.277597 -1.448722
H -3.869977 0.992946 2.037936
H -4.198364 2.976034 0.566045


%chk=000284327-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000284327

0 1
S 0.828608 -0.398868 0.913551
O 1.568536 -1.850887 0.971577
O 0.085283 0.199220 2.232298
O 0.039722 -2.177281 -2.064663
O -1.476696 -2.556083 -0.395153
N 1.917125 1.014087 0.287547
N -0.706768 -1.788905 -1.083808
C 3.299535 0.679775 -0.235176
C -0.591700 -0.343313 -0.720232
C 3.850186 2.071930 -0.655532
C 4.212880 0.040696 0.843683
C 3.168406 -0.235940 -1.472879
C -1.763908 0.427755 -0.280914
C -1.832722 1.786499 -0.710627
C -2.774714 -0.085877 0.581986
C -2.906763 2.605215 -0.314582
C -3.846967 0.741035 0.969707
C -3.919622 2.082142 0.524552
H 1.968835 1.624129 1.131535
H 0.066512 0.138939 -1.450875
H 3.938982 2.753515 0.211220
H 4.857608 1.943874 -1.090731
H 3.195374 2.541973 -1.408667
H 3.818061 -0.939925 1.159545
H 4.293620 0.695462 1.732274
H 5.230581 -0.108211 0.439783
H 2.511197 0.222503 -2.233422
H 4.164049 -0.383893 -1.926749
H 2.770289 -1.229962 -1.205604
H -1.043635 2.189525 -1.356255
H -2.713247 -1.116742 0.936458
H -2.956575 3.644363 -0.655927
H -4.623886 0.342947 1.630565
H -4.755986 2.718205 0.834711


