%chk=000292696.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000292696

0 1
S -0.803608 -1.438370 1.548648
O 5.266000 0.098740 -0.475737
N -1.155616 0.325014 -0.356474
C -2.593080 0.173105 -0.166250
C 1.182955 -0.203985 0.172896
C -0.265766 -0.381976 0.392453
C -0.748318 1.345822 -1.353839
C 1.930172 0.579459 1.062310
C 1.824338 -0.881907 -0.883615
C -3.221815 -1.018526 -0.560375
C -3.326482 1.239451 0.375596
C 3.926654 0.054604 -0.171325
C 3.309750 0.724600 0.892902
C 3.193293 -0.753519 -1.068833
C -4.605369 -1.133173 -0.407729
C -4.710546 1.105533 0.516562
C -5.349969 -0.074620 0.124758
C 6.139195 0.849620 0.403477
H 0.227174 1.099261 -1.808036
H -0.663871 2.340608 -0.882481
H -1.491817 1.408545 -2.167144
H 1.434081 1.076026 1.899129
H 1.241079 -1.518587 -1.551175
H -2.637712 -1.849478 -0.955828
H -2.826116 2.149584 0.698510
H 3.877680 1.333584 1.587967
H 3.714469 -1.268275 -1.873156
H -5.104398 -2.056883 -0.699650
H -5.290462 1.923906 0.941445
H -6.427693 -0.173983 0.241958
H 7.119416 0.687576 -0.064489
H 6.114003 0.429846 1.413461
H 5.869182 1.909098 0.392562


%chk=000292696-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000292696

0 1
S -0.776319 -0.608282 2.165125
O 5.303178 0.024322 -0.643761
N -1.199219 0.505843 -0.289647
C -2.619198 0.220299 -0.140311
C 1.165291 0.113787 0.302417
C -0.286497 0.049485 0.651436
C -0.856176 1.406945 -1.418920
C 2.111221 0.527708 1.274045
C 1.652762 -0.332114 -0.961782
C -3.097498 -1.082185 -0.412920
C -3.519982 1.250028 0.214061
C 3.956744 0.080460 -0.262577
C 3.493633 0.529800 1.001377
C 3.029011 -0.360693 -1.240236
C -4.479271 -1.353898 -0.325967
C -4.903029 0.973938 0.298011
C -5.386408 -0.326663 0.027247
C 6.306933 0.434532 0.343361
H 0.169261 1.785729 -1.305418
H -1.555228 2.261526 -1.426168
H -0.943725 0.885252 -2.390390
H 1.743762 0.836068 2.258152
H 0.949128 -0.697127 -1.718237
H -2.385614 -1.873093 -0.670672
H -3.139104 2.249809 0.450940
H 4.191599 0.867064 1.773182
H 3.409800 -0.727292 -2.198177
H -4.847643 -2.364908 -0.531648
H -5.598908 1.770357 0.583826
H -6.458810 -0.539850 0.095370
H 7.275308 0.296829 -0.159100
H 6.261184 -0.200342 1.249024
H 6.180615 1.497365 0.626854


