%chk=000099869.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000099869

0 1
 N  -8.1000002E-03  -2.510400     -3.1999999E-03
 C    1.119900      -1.677300      0.4234000    
 C   -1.125400      -1.682100     -0.4247000    
 C    1.530200     -0.7404000     -0.7275000    
 C   -1.529500     -0.7415000      0.7253000    
 C    2.258100      -2.597600      0.8643000    
 C   -2.267800      -2.600100     -0.8600000    
 C    2.663700      0.1921000     -0.3733000    
 C   -2.661400      0.1934000      0.3724000    
 C    2.376700       1.433400      0.1717000    
 C   -2.372400       1.432800     -0.1763000    
 C    3.970400     -0.2108000     -0.5991000    
 C   -3.968500     -0.2051000      0.6033000    
 C    3.423700       2.294800      0.4992000    
 C   -3.418100       2.296400     -0.5025000    
 C    5.017400      0.6507000     -0.2715000    
 C   -5.014100      0.6587000      0.2769000    
 C    4.744000       1.903500      0.2776000    
 C   -4.738700       1.909400     -0.2760000    
 H   0.8866000      -1.107400       1.327400    
 H  -0.8956000      -1.108200      -1.327700    
 H   0.2810000      -3.117200     -0.7704000    
 H   0.7202000     -8.1699997E-02  -1.054500    
 H    1.809800      -1.324900      -1.615300    
 H  -0.7188000     -8.1900001E-02   1.048400    
 H   -1.807400      -1.323700       1.615200    
 H    3.068600      -2.037600       1.341100    
 H    2.675200      -3.158200      2.0199999E-02
 H    1.904700      -3.325000       1.604900    
 H   -3.083500      -2.037500      -1.324300    
 H   -2.675500      -3.165600     -1.4500000E-02
 H   -1.925200      -3.323400      -1.609900    
 H    1.352300       1.746700      0.3517000    
 H   -1.347800       1.742700     -0.3602000    
 H    4.195300      -1.181800      -1.030800    
 H   -4.194900      -1.174500       1.037800    
 H    3.211000       3.269900      0.9277000    
 H   -3.203800       3.269800     -0.9338000    
 H    6.045500      0.3465000     -0.4450000    
 H   -6.042500      0.3579000      0.4542000    
 H    5.559300       2.574200      0.5327000    
 H   -5.552900       2.581900     -0.5300000    


%chk=000099869-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000099869

0 1
N -0.016729 -2.309430 0.049843
C 1.230102 -1.581935 0.370473
C -1.204584 -1.532232 -0.369917
C 1.920589 -0.942747 -0.894529
C -1.908745 -0.920118 0.886743
C 2.195257 -2.523506 1.115571
C -2.160497 -2.448795 -1.157534
C 3.000518 0.068837 -0.551462
C -2.997498 0.082229 0.540523
C 2.647872 1.351852 -0.051988
C -2.660432 1.370474 0.044745
C 4.378831 -0.241695 -0.686123
C -4.371668 -0.243971 0.677266
C 3.638984 2.292860 0.303660
C -3.662802 2.301981 -0.305466
C 5.375363 0.696942 -0.333326
C -5.379910 0.684842 0.330614
C 5.009197 1.968609 0.164792
C -5.028851 1.961927 -0.164235
H 0.960090 -0.749518 1.050997
H -0.924572 -0.678103 -1.036056
H 0.153306 -3.128691 -0.547897
H 1.131237 -0.453327 -1.498821
H 2.341142 -1.764489 -1.507622
H -1.132657 -0.429732 1.505874
H -2.313180 -1.757122 1.485419
H 3.133488 -2.004183 1.377722
H 2.454327 -3.395928 0.482818
H 1.722913 -2.900722 2.038461
H -3.085628 -1.911714 -1.426064
H -2.433209 -3.329895 -0.546024
H -1.688781 -2.806183 -2.092729
H 1.586867 1.617124 0.048416
H -1.602885 1.648560 -0.055480
H 4.670957 -1.225466 -1.074550
H -4.651181 -1.231893 1.064148
H 3.345872 3.278514 0.683446
H -3.381709 3.292294 -0.682224
H 6.434243 0.438237 -0.449113
H -6.435507 0.414106 0.448794
H 5.779781 2.698477 0.437264
H -5.808213 2.684430 -0.431531


