%chk=000279802.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000279802

0 1
S 0.637479 0.951701 -0.848727
O 1.540317 -0.140685 0.181344
O 0.869390 2.289397 -0.369552
O 0.938127 0.629052 -2.219448
N 2.880458 0.133395 -0.035329
C -0.890703 0.339133 -0.387539
C -1.810593 1.109801 0.354898
C -1.244437 -0.977117 -0.768224
C -3.411656 -0.724735 0.303515
C -3.062269 0.575012 0.691515
C -2.496919 -1.498016 -0.426173
C -1.497452 2.495552 0.798416
C -0.293879 -1.835745 -1.528523
C -4.752934 -1.279219 0.650335
C 3.706366 -0.540104 0.715579
C 5.166508 -0.272148 0.505465
C 3.340697 -1.549403 1.757477
H -3.768691 1.176518 1.258578
H -2.763563 -2.507617 -0.728476
H -1.284484 3.170981 -0.050834
H -2.299377 2.959381 1.384951
H -0.577370 2.541901 1.412049
H 0.640623 -2.012746 -0.966547
H -0.703895 -2.819965 -1.784813
H 0.017255 -1.363904 -2.485042
H -5.473354 -1.079141 -0.158950
H -4.732409 -2.367900 0.798564
H -5.169197 -0.837247 1.566161
H 5.348767 0.443937 -0.314046
H 5.620500 0.154129 1.410944
H 5.705806 -1.195728 0.255935
H 2.250545 -1.588053 1.918542
H 3.663757 -2.557753 1.465890
H 3.805388 -1.318064 2.724964


%chk=000279802-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000279802

0 1
S 0.677364 1.032829 -0.969920
O 1.708024 -0.145575 0.219063
O 0.928204 2.555909 -0.491805
O 1.004178 0.668966 -2.512503
N 3.110257 0.113937 -0.058010
C -1.005349 0.325625 -0.423368
C -1.871265 1.127865 0.365684
C -1.300481 -0.998260 -0.851120
C -3.484217 -0.763038 0.302304
C -3.117720 0.540182 0.707105
C -2.561860 -1.513258 -0.465327
C -1.580268 2.534134 0.858555
C -0.366400 -1.871473 -1.668871
C -4.839069 -1.339876 0.666745
C 3.890939 -0.540718 0.776503
C 5.376960 -0.354230 0.566651
C 3.394572 -1.444178 1.886187
H -3.815181 1.131124 1.312390
H -2.820166 -2.532430 -0.776485
H -1.427751 3.241302 0.025324
H -2.423347 2.891716 1.472456
H -0.657776 2.580301 1.461506
H 0.629850 -1.944374 -1.198264
H -0.787054 -2.885667 -1.765312
H -0.205455 -1.453523 -2.677077
H -5.551618 -1.227292 -0.173115
H -4.771986 -2.418306 0.894484
H -5.276789 -0.829676 1.541577
H 5.568936 0.313806 -0.287694
H 5.843687 0.078117 1.472361
H 5.867516 -1.328488 0.378364
H 2.590921 -0.948589 2.460654
H 2.955416 -2.370085 1.467398
H 4.215728 -1.722179 2.566461


