%chk=000045588.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000045588

0 1
 N   -2.585200      0.3153000       1.162400    
 N    1.052500      -1.700500      2.8999999E-02
 C   -1.800100      0.6209000     -5.3199999E-02
 C   -2.700200      0.2740000      -1.244800    
 C   -4.025300     -0.1418000     -0.6248000    
 C  -0.4745000     -9.0300001E-02 -2.3000000E-02
 C   -3.985700      0.4784000      0.7564000    
 C   0.8125000      0.5169000     -2.2100000E-02
 C  -0.2941000      -1.453900      8.6000003E-03
 C    1.752600     -0.5153000      1.1100000E-02
 C    1.269100       1.849700     -4.6399999E-02
 C    3.132100     -0.2802000      2.1500001E-02
 C    1.638800      -3.022900      6.4400002E-02
 C    2.646100       2.100000     -3.6499999E-02
 C    3.561500       1.049800     -2.7000001E-03
 H   -1.627000       1.704900     -7.2999999E-02
 H   -2.306200     -0.5184000      -1.889800    
 H   -2.848500       1.164700      -1.867600    
 H   -4.883200      0.1969000      -1.213000    
 H   -4.072900      -1.235100     -0.5496000    
 H   -4.248400       1.542000      0.7154000    
 H   -4.663900     -2.3100000E-02   1.452200    
 H   -2.348200      0.9583000       1.916100    
 H   -1.011800      -2.263800      1.7500000E-02
 H   0.5720000       2.682100     -7.2600000E-02
 H    3.850000      -1.093100      4.7400001E-02
 H   0.8469000      -3.776200      7.1800001E-02
 H    2.260400      -3.148500     -0.8259000    
 H    2.240000      -3.109400      0.9731000    
 H    3.004100       3.125800     -5.5000000E-02
 H    4.626500       1.267000      4.6999999E-03


%chk=000045588-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000045588

0 1
N -2.843707 -0.330326 0.961478
N 1.179478 -1.756949 0.298984
C -1.852248 0.456145 0.178290
C -2.556032 0.513029 -1.211865
C -4.077473 0.603970 -0.876530
C -0.486131 -0.178931 0.188980
C -4.188721 0.205421 0.632308
C 0.787921 0.479466 -0.037858
C -0.205511 -1.530837 0.389260
C 1.811649 -0.534731 0.035839
C 1.172897 1.822152 -0.296215
C 3.182766 -0.240692 -0.137283
C 1.858563 -3.041168 0.464797
C 2.538821 2.121531 -0.468553
C 3.533560 1.101472 -0.390533
H -1.759599 1.507718 0.556475
H -2.327806 -0.418945 -1.756319
H -2.195626 1.362969 -1.816949
H -4.467515 1.624717 -1.036338
H -4.661449 -0.076994 -1.518619
H -4.456088 1.106954 1.233885
H -4.965503 -0.560124 0.810208
H -2.633465 -0.382684 1.966940
H -0.902475 -2.342142 0.588913
H 0.420128 2.616239 -0.361543
H 3.951031 -1.019791 -0.079222
H 1.113960 -3.820469 0.692176
H 2.395606 -3.331358 -0.457891
H 2.586810 -3.001976 1.296680
H 2.848405 3.153884 -0.667233
H 4.587654 1.366650 -0.530663


