%chk=000290221.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000290221

0 1
S 1.531132 1.926378 0.692966
O -1.270478 -1.459477 0.715172
N -0.777597 0.672342 -0.010257
N 0.819293 -2.642783 -1.528262
C 5.310184 -0.558965 0.218803
C 5.506227 0.959305 0.089290
C 4.004611 -1.029459 -0.446495
C 4.359683 1.740263 0.764895
C 2.870104 -0.116912 -0.113843
C 3.059226 1.122279 0.423163
C 1.469323 -0.440477 -0.359133
C 0.614939 0.564670 0.030874
C 1.095035 -1.656760 -0.988691
C -1.672014 -0.392689 0.318770
C -3.105432 -0.003835 0.138015
C -3.949771 0.006106 1.256012
C -3.603703 0.297574 -1.136120
C -5.298633 0.335893 1.096640
C -4.954731 0.621271 -1.287711
C -5.799943 0.643550 -0.172715
H 5.299581 -0.841770 1.290134
H 6.169194 -1.090448 -0.231549
H 5.560198 1.236816 -0.981639
H 6.472806 1.255909 0.536123
H 3.771979 -2.068947 -0.132211
H 4.127278 -1.071226 -1.550498
H 4.397839 2.804889 0.455138
H 4.499909 1.736735 1.868554
H -1.161436 1.599717 -0.215907
H -3.557318 -0.251335 2.241220
H -2.946489 0.265992 -2.005945
H -5.960526 0.345949 1.962132
H -5.350197 0.851134 -2.276591
H -6.853370 0.896314 -0.294434


%chk=000290221-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000290221

0 1
S 1.596553 2.141592 0.477495
O -1.209063 -0.999733 1.258962
N -0.762821 0.793376 -0.187276
N 0.634645 -2.659786 -1.349809
C 5.308644 -0.634377 0.332413
C 5.591981 0.855505 0.021560
C 3.994147 -1.112331 -0.333156
C 4.482450 1.773588 0.605108
C 2.878471 -0.106407 -0.125987
C 3.127955 1.183622 0.305240
C 1.468061 -0.368595 -0.375472
C 0.635071 0.723531 -0.118572
C 0.992218 -1.613208 -0.892334
C -1.635858 -0.103566 0.482634
C -3.096684 0.121310 0.207759
C -4.022388 -0.329729 1.183869
C -3.578139 0.723813 -0.984806
C -5.406701 -0.154310 0.985483
C -4.965945 0.892942 -1.184073
C -5.882104 0.462331 -0.196768
H 5.235131 -0.767220 1.430084
H 6.149597 -1.263041 -0.014163
H 5.644238 0.995990 -1.075929
H 6.571142 1.156877 0.437672
H 3.691431 -2.096103 0.073280
H 4.154310 -1.266325 -1.419890
H 4.571381 2.793349 0.183132
H 4.618317 1.874340 1.701575
H -1.184682 1.607706 -0.639353
H -3.632838 -0.820307 2.081774
H -2.886415 1.014035 -1.785089
H -6.114897 -0.500182 1.746002
H -5.331932 1.345223 -2.112099
H -6.958376 0.594094 -0.353367


