%chk=000234477.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000234477

0 1
S -0.837926 0.407857 -1.543234
N -0.900595 0.216925 1.125596
N 4.897370 2.857549 -0.021153
C 0.027579 -0.160193 0.019281
C 1.299247 0.645758 0.031481
C 0.235142 -1.661036 0.012664
C -2.183049 0.639468 0.687533
C -2.309296 0.852257 -0.707288
C 2.350273 0.280001 -0.830363
C 1.445464 1.784151 0.839732
C 1.293864 -2.205449 0.760550
C -0.637879 -2.520874 -0.666186
C -3.260288 0.915182 1.537922
C -3.473734 1.348942 -1.262685
C 3.527142 1.018897 -0.877222
C 2.618116 2.535591 0.809786
C -4.439463 1.417059 0.970389
C -4.550902 1.633276 -0.405732
C 3.670850 2.154157 -0.048197
C 1.486062 -3.586956 0.811116
C -0.440741 -3.905471 -0.615160
C 0.619574 -4.440974 0.119811
H -0.875200 -0.402591 1.937029
H 2.244956 -0.596034 -1.474673
H 0.630497 2.093815 1.499774
H 1.974718 -1.544931 1.301084
H -1.478897 -2.128332 -1.242426
H -3.184177 0.758942 2.609035
H -3.561945 1.515936 -2.335115
H 4.331632 0.718251 -1.541982
H 2.718157 3.407115 1.450149
H -5.285087 1.641871 1.620699
H -5.476318 2.024442 -0.821148
H 2.311933 -3.999221 1.388479
H -1.119959 -4.565894 -1.152320
H 0.771219 -5.518353 0.156157
H 5.487470 2.767669 -0.835065
H 4.866592 3.804799 0.326281


%chk=000234477-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000234477

0 1
S -0.896704 0.704098 -1.680113
N -0.820575 0.432835 0.999356
N 5.122352 2.869225 -0.048530
C 0.084453 0.024257 -0.112624
C 1.425906 0.744724 -0.053321
C 0.202726 -1.519805 -0.127532
C -2.171749 0.651167 0.694481
C -2.431305 0.842243 -0.691903
C 2.567068 0.228424 -0.721131
C 1.549195 1.996337 0.601482
C 1.069043 -2.133745 0.820269
C -0.596790 -2.348955 -0.949842
C -3.234403 0.738653 1.623038
C -3.720625 1.134920 -1.160404
C 3.788423 0.925111 -0.726274
C 2.766096 2.699298 0.614779
C -4.537354 1.033322 1.152401
C -4.785292 1.233247 -0.224824
C 3.912139 2.175520 -0.052893
C 1.127980 -3.537932 0.942669
C -0.534199 -3.756610 -0.831155
C 0.324637 -4.357959 0.115384
H -0.564264 0.085751 1.926273
H 2.498973 -0.730462 -1.246993
H 0.667110 2.416406 1.095507
H 1.710334 -1.507345 1.452018
H -1.258305 -1.886514 -1.689172
H -3.050368 0.584786 2.692514
H -3.906666 1.281914 -2.229513
H 4.654232 0.505269 -1.253170
H 2.835117 3.663905 1.133116
H -5.362348 1.101947 1.870281
H -5.797339 1.458092 -0.576948
H 1.803655 -3.992273 1.676360
H -1.158277 -4.382119 -1.479552
H 0.371672 -5.449029 0.206090
H 5.933232 2.505548 -0.540155
H 5.204621 3.769348 0.414629


