%chk=000201387.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000201387

0 1
S 3.944534 0.416695 -0.095051
N -0.038030 -0.435146 0.048305
C -1.266032 0.419056 0.016293
C -2.510974 -0.483640 0.043997
C 1.209824 0.389459 0.118636
C 2.405064 -0.547168 -0.038680
C -3.790985 0.338327 -0.069944
H -1.308667 1.156014 0.846665
H -1.247785 1.004647 -0.930251
H -2.453115 -1.216185 -0.787866
H -2.530148 -1.085407 0.972979
H 1.287655 0.980979 1.056813
H 1.189908 1.125512 -0.719373
H -0.077819 -1.069202 0.853695
H 2.337597 -1.105977 -0.998029
H 2.447013 -1.311462 0.756923
H -3.892042 1.053195 0.754421
H -3.824136 0.908187 -1.006169
H -4.676408 -0.308166 -0.052585
H 4.019745 0.801783 1.195022


%chk=000201387-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000201387

0 1
S 4.077613 0.339911 -0.116358
N -0.039120 -0.388207 0.125875
C -1.275524 0.420896 0.032857
C -2.526146 -0.480113 0.015363
C 1.222326 0.380911 0.122167
C 2.415973 -0.573069 -0.046625
C -3.836514 0.330890 -0.073981
H -1.371446 1.164782 0.865422
H -1.230906 1.004564 -0.908367
H -2.444418 -1.177795 -0.839308
H -2.539915 -1.103934 0.933772
H 1.367641 1.004668 1.041527
H 1.199986 1.081468 -0.733453
H -0.082616 -1.045197 0.918336
H 2.344921 -1.108423 -1.006455
H 2.462529 -1.317052 0.767811
H -3.946188 1.011797 0.791153
H -3.860012 0.947265 -0.992249
H -4.717761 -0.335327 -0.093216
H 4.004776 0.873466 1.161530


