%chk=000256417.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000256417

0 1
S -0.257119 0.875292 0.005623
N -5.221374 0.382267 0.181109
N -3.410902 1.794725 0.002715
N -3.973849 -1.793672 0.317812
N -1.550548 -1.464935 0.231207
C 4.930931 0.466019 -0.070081
C 6.177569 -0.427717 -0.020854
C 3.644040 -0.363834 0.027821
C 7.465075 0.401368 -0.118477
C 2.396966 0.533846 -0.021752
C 8.713424 -0.490942 -0.069207
C 1.130542 -0.305097 0.076285
C 9.997996 0.329173 -0.165853
C -2.953992 0.474102 0.100476
C -4.085565 -0.428570 0.202889
C -1.674063 -0.126353 0.121625
C -6.625819 -0.074893 0.185219
C -4.749517 1.723687 0.041335
C -7.214082 -0.069418 -1.221442
C -2.696718 -2.237560 0.324934
H 4.966478 1.206205 0.752744
H 4.928927 1.056925 -1.006563
H 6.143369 -1.167580 -0.843799
H 6.180768 -1.018495 0.915511
H 3.646671 -0.954189 0.964767
H 3.609110 -1.103635 -0.795493
H 7.501336 1.141770 0.703631
H 7.464095 0.992612 -1.054320
H 2.404685 1.125092 -0.961191
H 2.442202 1.274634 0.803717
H 8.717074 -1.081587 0.867769
H 8.679886 -1.230826 -0.892760
H 1.085863 -0.889891 1.015556
H 1.048394 -1.039557 -0.748336
H 10.081542 1.047102 0.657958
H 10.044336 0.898065 -1.101412
H 10.883116 -0.315658 -0.129937
H -6.658292 -1.107573 0.615802
H -7.212412 0.584799 0.865061
H -5.429357 2.563598 -0.011125
H -7.203596 0.928916 -1.675227
H -8.254598 -0.417949 -1.212015
H -6.655683 -0.735821 -1.895144
H -2.536409 -3.324545 0.413619


%chk=000256417-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000256417

0 1
S -0.338287 1.250671 0.034982
N -5.322303 0.427196 0.216992
N -3.608816 1.965488 0.143628
N -3.990029 -1.662871 0.174612
N -1.578785 -1.213710 0.090918
C 4.983113 0.516569 -0.052763
C 6.196880 -0.439823 -0.061000
C 3.625346 -0.221939 -0.031871
C 7.554997 0.297522 -0.079495
C 2.418777 0.747789 -0.018146
C 8.769963 -0.658139 -0.085075
C 1.083694 -0.012682 0.007002
C 10.122856 0.085904 -0.103132
C -3.082305 0.661363 0.129772
C -4.136348 -0.308390 0.171311
C -1.761059 0.139907 0.088663
C -6.687011 -0.136286 0.226302
C -4.941043 1.777722 0.193249
C -7.145757 -0.585027 -1.175637
C -2.677880 -2.033692 0.133864
H 5.049704 1.185382 0.830663
H 5.028806 1.174818 -0.945361
H 6.131551 -1.108676 -0.944800
H 6.150645 -1.099052 0.831185
H 3.579897 -0.880989 0.859769
H 3.555569 -0.887329 -0.917224
H 7.621431 0.967465 0.803441
H 7.603940 0.955799 -0.972263
H 2.463905 1.402113 -0.911511
H 2.491341 1.410196 0.867444
H 8.719971 -1.315538 0.807066
H 8.702883 -1.327202 -0.967387
H 0.975433 -0.644634 0.902780
H 0.941417 -0.645540 -0.883396
H 10.228500 0.737741 0.784731
H 10.210543 0.726894 -1.000793
H 10.974156 -0.619610 -0.107378
H -6.685849 -0.996856 0.917948
H -7.364000 0.633268 0.638137
H -5.676642 2.579814 0.220278
H -7.149540 0.260928 -1.885176
H -8.169004 -0.997952 -1.121441
H -6.476909 -1.370620 -1.565419
H -2.473249 -3.108091 0.134729


