%chk=000031633.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000031633

1 1
 N  -0.2233000      -1.063900      6.9999998E-04
 N    4.584600     -0.8806000     -1.2000001E-03
 C   0.9142000     -0.3439000      6.0000003E-04
 C   -1.453600     -0.5176000      3.9999999E-04
 C   0.8396000       1.063800      6.0000003E-04
 C   -1.585100      0.8860000      3.0000001E-04
 C  -0.4236000       1.668200      6.9999998E-04
 C    2.157500     -0.9856000      3.9999999E-04
 C    2.031300       1.806500      9.9999997E-05
 C  -0.1160000      -2.538700      5.0000002E-04
 C   -2.590100      -1.333700     -9.9999997E-05
 C   -2.872400       1.446900     -1.9999999E-04
 C    3.331200     -0.2329000     -3.9999999E-04
 C    3.268600       1.159500     -6.0000003E-04
 C   -3.860900     -0.7603000     -8.9999998E-04
 C   -4.002000      0.6263000     -1.0000000E-03
 H  -0.5033000       2.754300      6.0000003E-04
 H    2.290200      -2.059300     -5.1500000E-02
 H    2.005500       2.893900       0.000000    
 H   0.7352000      -2.883100      0.5880000    
 H  -0.9302000      -3.018400      0.5414000    
 H  -6.1400000E-02  -2.881200      -1.035600    
 H   -2.584900      -2.414600     -5.4000001E-02
 H   -3.005600       2.526400     -1.0000000E-03
 H    4.178200       1.755100     -1.2000001E-03
 H   -4.743400      -1.393700     -1.3600000E-02
 H   -4.993400       1.070200     -4.4000000E-03
 H    4.634000      -1.890600      3.9999999E-04
 H    5.435900     -0.3345000     -1.3000000E-03


%chk=000031633-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000031633

1 1
N -0.228358 -1.174268 0.065623
N 4.645991 -0.797633 -0.151617
C 0.952046 -0.416587 0.019597
C -1.502340 -0.576748 0.000551
C 0.846061 1.037456 0.061243
C -1.606523 0.866523 0.038969
C -0.417186 1.641978 0.089990
C 2.227158 -1.020858 -0.057180
C 2.059637 1.817837 0.063864
C -0.119542 -2.650664 0.192983
C -2.696967 -1.347156 -0.105068
C -2.899542 1.484241 0.013136
C 3.402755 -0.223855 -0.065689
C 3.301050 1.220053 0.009081
C -3.944941 -0.708374 -0.137391
C -4.057594 0.712246 -0.066664
H -0.493159 2.734565 0.133692
H 2.337714 -2.103490 -0.146626
H 1.974397 2.908791 0.105971
H 0.736362 -2.899493 0.837123
H -1.015679 -3.050777 0.683445
H 0.005891 -3.130386 -0.793555
H -2.668646 -2.434354 -0.195363
H -2.957862 2.577437 0.050251
H 4.214392 1.823960 0.011124
H -4.850480 -1.316792 -0.228057
H -5.043637 1.184079 -0.088247
H 4.767127 -1.808079 -0.203182
H 5.488674 -0.225150 -0.170307


