%chk=000202701.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000202701

0 1
S -3.386040 -3.464148 -0.097924
S -4.448625 -1.816320 -0.670661
N 0.334586 -1.958906 0.549387
N -5.950466 4.554224 0.411959
C 6.311630 -0.130758 -0.479573
C 5.094855 -0.415726 0.411142
C 7.520525 0.320854 0.351033
C 3.885915 -0.867351 -0.419500
C 8.737713 0.606182 -0.539113
C 2.672157 -1.153183 0.473251
C 9.946157 1.058196 0.291503
C 1.464746 -1.602880 -0.364997
C 11.164679 1.343916 -0.597584
C -0.914197 -2.281217 -0.211957
C 12.370444 1.794617 0.224055
C -1.923137 -2.865338 0.774952
C -5.520041 -1.407507 0.741886
C -6.345693 -0.268766 0.243153
C -5.931326 1.052739 0.467427
C -7.538002 -0.513740 -0.460106
C -6.715762 2.114734 -0.007961
C -8.310843 0.550736 -0.930147
C -7.908366 1.870076 -0.707719
C -6.292049 3.465739 0.224276
H 6.058073 0.645461 -1.227114
H 6.572553 -1.035731 -1.061581
H 4.835355 0.488952 0.994153
H 5.349237 -1.192519 1.158238
H 7.775067 -0.455387 1.098304
H 7.260491 1.225661 0.933571
H 4.148133 -1.772960 -1.000739
H 3.632818 -0.090780 -1.167010
H 8.998562 -0.298734 -1.121114
H 8.483577 1.382204 -1.286644
H 2.416785 -0.253752 1.065209
H 2.919899 -1.940151 1.214970
H 10.201754 0.283311 1.039522
H 9.687187 1.963075 0.874099
H 1.727433 -2.514870 -0.947050
H 1.196937 -0.817235 -1.104153
H 10.910974 2.120582 -1.345397
H 11.426542 0.438492 -1.179333
H 0.152555 -1.180698 1.192883
H -1.341070 -1.400389 -0.741298
H -0.665327 -3.032996 -0.996599
H 12.157207 2.712419 0.783712
H 13.234782 1.995668 -0.418593
H 12.672084 1.031318 0.950297
H -1.487428 -3.747963 1.298081
H -2.188708 -2.145135 1.569526
H -6.136351 -2.281130 1.034394
H -4.919155 -1.141413 1.632395
H -5.003664 1.257723 1.002937
H -7.859174 -1.539738 -0.645797
H -9.233789 0.351311 -1.476013
H -8.511201 2.701228 -1.073836


%chk=000202701-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000202701

0 1
S -3.485374 -3.696346 0.110553
S -4.448183 -1.833367 -0.762168
N 0.306662 -1.989587 0.568297
N -6.080377 4.681997 0.604975
C 6.362733 -0.123784 -0.456199
C 5.152364 -0.483801 0.434539
C 7.611942 0.303604 0.347158
C 3.914955 -0.932784 -0.375259
C 8.813773 0.680080 -0.548588
C 2.689798 -1.252748 0.510076
C 10.068244 1.100060 0.250601
C 1.479903 -1.749370 -0.304837
C 11.266936 1.480240 -0.648579
C -0.889248 -2.514243 -0.125752
C 12.517142 1.897012 0.156320
C -1.930224 -2.961599 0.910197
C -5.679663 -1.382400 0.651519
C -6.496148 -0.203771 0.183245
C -6.089027 1.118188 0.482135
C -7.670360 -0.402760 -0.591589
C -6.850112 2.227563 0.025658
C -8.429382 0.697527 -1.046771
C -8.028002 2.014518 -0.742574
C -6.429690 3.568614 0.342228
H 6.075701 0.694945 -1.149020
H 6.619757 -0.994673 -1.095196
H 4.883840 0.393442 1.059896
H 5.441545 -1.290989 1.139336
H 7.907768 -0.519872 1.030474
H 7.353350 1.166981 0.995550
H 4.179038 -1.828311 -0.976094
H 3.647137 -0.138367 -1.102918
H 9.067923 -0.181079 -1.201829
H 8.518727 1.507575 -1.227589
H 2.402882 -0.340885 1.076891
H 2.950794 -2.022112 1.262372
H 10.367496 0.272059 0.927109
H 9.815653 1.959973 0.905992
H 1.737153 -2.708685 -0.796558
H 1.263626 -1.018078 -1.125022
H 10.967004 2.307919 -1.323561
H 11.516818 0.620758 -1.303888
H 0.083363 -1.150476 1.123652
H -1.358472 -1.783856 -0.829410
H -0.580827 -3.389010 -0.728705
H 12.301121 2.772471 0.797644
H 13.358432 2.164994 -0.509258
H 12.855792 1.075189 0.815332
H -1.530057 -3.777177 1.539582
H -2.244946 -2.132184 1.567132
H -6.293626 -2.278234 0.827656
H -5.083248 -1.154216 1.547982
H -5.181484 1.292675 1.070064
H -7.984611 -1.423803 -0.836078
H -9.334511 0.529341 -1.639112
H -8.610800 2.872841 -1.090809


