%chk=000014684.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000014684

0 1
 N   0.4885000     -0.2921000       1.304000    
 N   0.8167000      -2.809300     -0.6190000    
 N   -1.307800      -2.681900      0.2265000    
 C  -0.6103000      0.4620000       1.903000    
 C    1.505800      0.3159000      0.5588000    
 C   0.2489000       2.577400      0.1773000    
 C   -1.547700      0.9501000      0.8344000    
 C    1.427400       1.629800      1.3800000E-02
 C   -1.111400       1.964300     -3.1599998E-02
 C   0.5187000      -1.729900       1.567300    
 C    2.705000     -0.3969000      0.2984000    
 C   -2.813700      0.3790000      0.6586000    
 C    2.521900       2.158300     -0.7138000    
 C   -1.955100       2.402100      -1.060300    
 C   3.4800000E-02  -2.427200      0.3468000    
 C    3.768300      0.1384000     -0.4340000    
 C    3.677600       1.421000     -0.9397000    
 C   -3.646400      0.8224000     -0.3679000    
 C   -3.217600       1.832300      -1.226400    
 C  -9.4800003E-02  -3.438300      -1.589100    
 C   -1.408800      -3.277600     -0.9074000    
 H  -0.2288000       1.294200       2.507900    
 H   -1.171700     -0.1534000       2.617500    
 H   0.2995000       3.039000       1.171900    
 H   0.3520000       3.415400     -0.5253000    
 H    1.492400      -2.106600       1.889900    
 H  -0.1599000      -1.990100       2.389600    
 H    2.875600      -1.401900      0.6714000    
 H   -3.157400     -0.4152000       1.315900    
 H    2.474300       3.168200      -1.117500    
 H   -1.636800       3.189500      -1.738600    
 H    4.665300     -0.4514000     -0.5983000    
 H    4.499500       1.849300      -1.504600    
 H   -4.628300      0.3776000     -0.5005000    
 H   -3.866600       2.176300      -2.026600    
 H  -9.3699999E-02  -2.909700      -2.545300    
 H   0.1348000      -4.496800      -1.732000    
 H   -2.342500      -3.641000      -1.356100    


%chk=000014684-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000014684

0 1
N 0.470893 -0.339247 1.151611
N 1.030250 -3.552284 -0.096846
N -1.180010 -2.913442 0.445778
C -0.866337 0.170167 1.582329
C 1.403258 0.363125 0.347084
C 0.255670 2.674900 0.745001
C -1.612815 0.994783 0.550323
C 1.363026 1.791625 0.161289
C -1.100194 2.270033 0.186636
C 0.775002 -1.710271 1.602903
C 2.460289 -0.363962 -0.287938
C -2.825725 0.537008 -0.012996
C 2.366328 2.409632 -0.619483
C -1.818191 3.072794 -0.728620
C 0.268098 -2.761219 0.638925
C 3.455511 0.287472 -1.042892
C 3.422887 1.686796 -1.216477
C -3.542609 1.345969 -0.925227
C -3.039297 2.618450 -1.279596
C 0.078955 -4.359140 -0.910344
C -1.287225 -3.860971 -0.468839
H -0.757141 0.755265 2.522505
H -1.475493 -0.717255 1.818595
H 0.250949 2.602616 1.851286
H 0.470333 3.729507 0.499670
H 1.860873 -1.841728 1.737398
H 0.294726 -1.871447 2.586444
H 2.492348 -1.455089 -0.224211
H -3.201212 -0.456436 0.259701
H 2.317022 3.498192 -0.750839
H -1.419323 4.053677 -1.014311
H 4.247702 -0.311401 -1.507205
H 4.189440 2.202287 -1.804017
H -4.484627 0.987570 -1.355348
H -3.591180 3.251294 -1.984022
H 0.263868 -4.195764 -1.990189
H 0.228335 -5.439029 -0.716190
H -2.256683 -4.211278 -0.832889


