%chk=000114143.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000114143

2 1
 N    4.163100      0.4610000     -0.3067000    
 N  -0.2389000      -1.480900      0.6395000    
 N   -3.274600     -0.3470000     -0.7284000    
 C    3.222200      0.1049000      0.7811000    
 C    1.965100     -0.5387000      0.2124000    
 C   0.9312000     -0.8852000       1.280000    
 C    4.569300     -0.7841000      -1.108800    
 C    3.522800       1.463800      -1.277800    
 C    5.440200       1.098100      0.2607000    
 C   -1.296000     -0.6996000      0.2057000    
 C   -2.376500      -1.331700     -0.3954000    
 C   -1.549100      0.6971000      0.2359000    
 C   -2.798100      0.8915000     -0.3570000    
 C  -0.2559000      -2.807900      0.4847000    
 C   -2.423300      -2.714900     -0.5709000    
 C   -1.329300      -3.449600     -0.1139000    
 C  -0.8393000       1.817800      0.7094000    
 C   -3.375000       2.158500     -0.5005000    
 C   -1.404900       3.090700      0.5732000    
 C   -2.653200       3.256200     -2.3200000E-02
 H    2.975400       1.020300       1.332400    
 H    3.733500     -0.5814000       1.466900    
 H    1.474200      0.1165000     -0.5123000    
 H    2.205900      -1.466700     -0.3165000    
 H   0.6288000     -4.8799999E-02   1.907800    
 H    1.348700      -1.624300       1.976300    
 H    5.390800     -0.5045000      -1.776300    
 H    4.900000      -1.554500     -0.4063000    
 H    3.726800      -1.128900      -1.712900    
 H    2.762000      0.9650000      -1.882500    
 H    3.096100       2.285200     -0.6950000    
 H    4.307200       1.840900      -1.941900    
 H    6.109400       1.346400     -0.5683000    
 H    5.154200       2.001000      0.8080000    
 H    5.911500      0.3739000      0.9315000    
 H   0.6045000      -3.364400      0.8397000    
 H   -4.162900     -0.5074000      -1.183000    
 H   -3.270400      -3.201500      -1.041600    
 H   -1.319000      -4.529600     -0.2296000    
 H   0.1439000       1.751300       1.158800    
 H   -4.346800       2.288700     -0.9648000    
 H  -0.8605000       3.960500      0.9316000    
 H   -3.073000       4.254100     -0.1206000    


%chk=000114143-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000114143

2 1
N 4.315402 0.506410 -0.349561
N -0.296433 -1.531992 0.648953
N -3.452516 -0.413941 -0.625349
C 3.233146 0.044805 0.660520
C 1.919429 -0.478940 0.042463
C 0.959535 -0.921890 1.183988
C 4.746057 -0.645370 -1.260940
C 3.813780 1.674229 -1.201745
C 5.534930 0.975260 0.459253
C -1.354213 -0.742028 0.228951
C -2.540354 -1.398475 -0.288716
C -1.581332 0.684534 0.199910
C -2.911612 0.850248 -0.342679
C -0.381250 -2.910443 0.570303
C -2.635119 -2.797098 -0.375117
C -1.523154 -3.550578 0.068391
C -0.847272 1.850856 0.570702
C -3.506180 2.115693 -0.519975
C -1.439197 3.111040 0.399296
C -2.754020 3.242993 -0.142400
H 3.041294 0.916937 1.311713
H 3.713683 -0.738593 1.274000
H 1.424900 0.298385 -0.566281
H 2.109426 -1.352025 -0.607478
H 0.682692 -0.075736 1.834068
H 1.445904 -1.678901 1.822567
H 5.580074 -0.302930 -1.892205
H 5.078073 -1.492769 -0.641624
H 3.906359 -0.946037 -1.903236
H 2.989522 1.339384 -1.847407
H 3.476013 2.486767 -0.540305
H 4.642700 2.032961 -1.830621
H 6.318666 1.309227 -0.237085
H 5.238175 1.810365 1.111964
H 5.911198 0.137703 1.066174
H 0.480139 -3.472372 0.936615
H -4.385940 -0.579451 -1.003613
H -3.530198 -3.294690 -0.759155
H -1.540727 -4.642045 0.037074
H 0.154686 1.792145 1.006611
H -4.515176 2.223479 -0.928660
H -0.894738 4.013391 0.692718
H -3.186249 4.241292 -0.260682


