%chk=000062764.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000062764

0 1
 S    2.027400     -0.7568000       1.423600    
 N  -0.6642000      0.9621000     -4.1000000E-03
 C  -0.3720000     -0.4636000      3.9999999E-04
 C   -1.048700      -1.057400       1.269000    
 C   -1.032600      -1.116200      -1.247700    
 C  -8.0100000E-02   1.655500       1.143700    
 C  -0.1153000       1.641000      -1.177500    
 C   -2.577400     -0.9681000       1.260300    
 C   -2.562100      -1.041200      -1.254700    
 C   -3.165500      -1.621000      1.7000001E-02
 C  -0.1653000       3.119500      0.7377000    
 C  -0.1921000       3.109800     -0.7876000    
 C    1.154600     -0.6751000     -4.2700000E-02
 C    1.961500     -0.8144000      -1.144100    
 C    3.327400     -0.9927000     -0.7796000    
 C    3.504100     -0.9815000      0.5865000    
 H  -0.6873000     -0.6236000       2.207800    
 H  -0.7820000      -2.123100       1.334300    
 H  -0.7518000      -2.179600      -1.273800    
 H  -0.6628000     -0.7050000      -2.193900    
 H   0.9795000       1.499600       1.324400    
 H  -0.6315000       1.504700       2.076400    
 H  -0.7039000       1.473200      -2.084700    
 H   0.9335000       1.437500      -1.400400    
 H   -2.897700      7.8699999E-02   1.318600    
 H   -2.974300      -1.466800       2.152200    
 H   -2.947400      -1.590700      -2.121500    
 H   -2.886100     -6.9999998E-04  -1.375800    
 H   -2.979800      -2.701700      4.9199998E-02
 H   -4.252700      -1.485400      6.5000001E-03
 H   0.6796000       3.700100       1.122800    
 H   -1.086100       3.576500       1.119700    
 H   -1.126200       3.559900      -1.144100    
 H   0.6387000       3.684700      -1.209700    
 H    1.618300     -0.7964000      -2.170000    
 H    4.139000      -1.122900      -1.483500    
 H    4.429800      -1.094500       1.133000    


%chk=000062764-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000062764

0 1
S 2.173750 -0.923367 1.499157
N -0.557706 0.966884 -0.019159
C -0.309452 -0.518538 -0.004669
C -0.979873 -1.138587 1.261036
C -1.001875 -1.156910 -1.253449
C -0.163662 1.764278 1.174205
C -0.072185 1.737744 -1.194706
C -2.508360 -0.918082 1.291698
C -2.530824 -0.934750 -1.253639
C -3.181723 -1.503413 0.028420
C -0.441818 3.228585 0.743948
C -0.371328 3.212980 -0.819723
C 1.188765 -0.841825 -0.038377
C 2.033017 -1.004743 -1.132100
C 3.425217 -1.197088 -0.803773
C 3.678913 -1.178798 0.556817
H -0.516160 -0.734442 2.181201
H -0.761102 -2.224660 1.252570
H -0.780106 -2.242168 -1.236554
H -0.564390 -0.759871 -2.187922
H 0.914671 1.636658 1.432196
H -0.758125 1.471960 2.057322
H -0.601260 1.429432 -2.113556
H 1.021665 1.594165 -1.365854
H -2.721489 0.166536 1.345199
H -2.930159 -1.385451 2.203101
H -2.971336 -1.410873 -2.151810
H -2.739353 0.150362 -1.314950
H -3.074827 -2.608714 0.035109
H -4.267090 -1.284563 0.036452
H 0.293611 3.919908 1.191273
H -1.444833 3.545110 1.078356
H -1.336216 3.533134 -1.249124
H 0.409446 3.888079 -1.211672
H 1.666481 -1.006252 -2.161625
H 4.205979 -1.346898 -1.553874
H 4.622237 -1.301422 1.086177


