%chk=000086911.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000086911

0 1
 N    5.557100     -0.3327000      0.1796000    
 N   -4.567400       1.383700     -0.1334000    
 N  -0.4922000      0.6487000      0.4724000    
 N   8.6900003E-02  0.5379000     -0.6321000    
 C    4.179600     -0.1131000     -2.6500000E-02
 C   -2.774000     -0.1948000      0.1814000    
 C   -4.135200      0.1133000     -2.3399999E-02
 C   -1.863400      0.8668000      0.2699000    
 C    3.305500      -1.197000     -0.1094000    
 C    3.690500       1.187700     -0.1456000    
 C    1.460400      0.3197000     -0.4297000    
 C   -2.358000      -1.532500      0.2919000    
 C    1.942500     -0.9801000     -0.3117000    
 C    2.327500       1.404700     -0.3477000    
 C   -5.039500     -0.9417000     -0.1110000    
 C    6.190200      -1.539500     -0.3141000    
 C    6.361400      0.6520000      0.8760000    
 C   -2.305600       2.177000      0.1568000    
 C   -3.283800      -2.567800      0.2003000    
 C   -4.626100      -2.271600     -1.3000000E-03
 C   -3.656200       2.379500     -4.2399999E-02
 H    3.651600      -2.221800     -8.8000000E-03
 H    4.345000       2.053400     -9.7700000E-02
 H   -1.315600      -1.794100      0.4552000    
 H    1.268500      -1.830200     -0.3737000    
 H    1.954800       2.421200     -0.4425000    
 H   -6.096800     -0.7362000     -0.2687000    
 H    7.277500      -1.418600     -0.3768000    
 H    5.843000      -1.790800      -1.322800    
 H    5.991500      -2.383500      0.3546000    
 H    6.630100       1.476700      0.2076000    
 H    7.293800      0.2104000       1.245500    
 H    5.836300       1.053900       1.750000    
 H   -1.624100       3.018100      0.2221000    
 H   -2.959000      -3.600100      0.2874000    
 H   -5.355400      -3.073200     -7.3600002E-02
 H   -4.060000       3.382100     -0.1378000    


%chk=000086911-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000086911

0 1
N 5.787146 -0.262847 0.270924
N -4.694421 0.625009 -1.407188
N -0.601467 0.000410 -0.216695
N 0.318742 0.354554 -1.092273
C 4.438568 -0.121073 -0.040511
C -2.996826 -0.215733 0.220402
C -4.366224 0.010148 -0.203412
C -1.939834 0.223610 -0.663738
C 4.019138 0.380963 -1.318748
C 3.417196 -0.473290 0.912062
C 1.653327 0.167743 -0.671807
C -2.752789 -0.856952 1.476575
C 2.658881 0.519716 -1.616911
C 2.063257 -0.333110 0.602607
C -5.439312 -0.414408 0.645600
C 6.815232 0.103172 -0.715839
C 6.197629 -0.780154 1.586123
C -2.293848 0.844340 -1.877800
C -3.820584 -1.260560 2.282765
C -5.172516 -1.038615 1.865820
C -3.669206 1.018311 -2.197097
H 4.758482 0.660858 -2.073353
H 3.697337 -0.856518 1.897237
H -1.714987 -1.018557 1.780895
H 2.334951 0.903100 -2.590385
H 1.290347 -0.601545 1.329369
H -6.459971 -0.229449 0.296784
H 7.813647 -0.076378 -0.288726
H 6.749756 1.173493 -0.994796
H 6.725160 -0.499940 -1.640951
H 5.843046 -0.129878 2.410040
H 7.296451 -0.821245 1.635421
H 5.809814 -1.802843 1.762104
H -1.508509 1.185620 -2.557168
H -3.626204 -1.750790 3.243444
H -5.998357 -1.361177 2.509801
H -3.951650 1.501514 -3.140577


