%chk=000272769.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000272769

0 1
S -1.717277 1.890124 1.356813
O -3.422296 -2.394697 -0.134171
N -2.910339 -0.223125 0.313620
N -0.472544 -0.266168 2.427021
N 1.134419 -0.881558 0.652993
C -2.593702 1.158006 -0.119470
C -2.886061 -0.471484 1.778009
C -1.770753 0.372380 2.408938
C -1.624325 1.193410 -1.287072
C -3.847353 1.981143 -0.355671
C -3.175864 -1.284780 -0.568482
C 0.325178 -0.431926 1.484543
C 2.376447 -0.359560 0.196562
C 3.090494 -1.168075 -0.709167
C 2.880362 0.890751 0.600358
C 4.311933 -0.712875 -1.205562
C 4.105513 1.325518 0.090150
C 4.821116 0.529862 -0.809952
H -2.734870 -1.568213 1.961375
H -3.872957 -0.210438 2.224149
H -2.005172 0.668508 3.465876
H -2.096144 0.898778 -2.233254
H -1.218170 2.203626 -1.446503
H -0.756477 0.532170 -1.134576
H -4.523667 1.969564 0.511800
H -3.613700 3.034803 -0.561751
H -4.425239 1.605552 -1.210586
H -3.158003 -1.022169 -1.635378
H 2.687705 -2.136284 -1.008098
H 2.326958 1.512581 1.301583
H 4.873529 -1.331885 -1.905331
H 4.504320 2.291836 0.398720
H 5.775738 0.875328 -1.202185


%chk=000272769-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000272769

0 1
S -1.865452 2.130588 1.194497
O -2.986265 -2.516823 -0.061737
N -2.940843 -0.200845 0.309022
N -0.474599 -0.139264 2.207486
N 1.268005 -0.679436 0.535837
C -2.897704 1.195899 -0.191036
C -2.923521 -0.323383 1.775766
C -1.741395 0.543704 2.284082
C -2.158154 1.346466 -1.531706
C -4.306111 1.825332 -0.229139
C -2.931265 -1.333189 -0.497043
C 0.398705 -0.314005 1.340673
C 2.583068 -0.328518 0.173160
C 3.208725 -1.075065 -0.858412
C 3.288076 0.732339 0.807376
C 4.527275 -0.763823 -1.250762
C 4.606026 1.033784 0.406924
C 5.232034 0.289884 -0.621978
H -2.795096 -1.386524 2.035657
H -3.864682 0.051916 2.220124
H -1.912766 0.870203 3.320929
H -2.755128 0.943363 -2.371614
H -1.989233 2.417587 -1.733751
H -1.176968 0.844207 -1.505201
H -4.822365 1.712152 0.738449
H -4.241343 2.904105 -0.454449
H -4.915317 1.338356 -1.014569
H -2.883753 -1.099936 -1.580010
H 2.650261 -1.889420 -1.329831
H 2.801087 1.307215 1.603360
H 5.005462 -1.345401 -2.046431
H 5.145904 1.851075 0.898125
H 6.256131 0.528158 -0.928497


