%chk=000042526.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000042526

0 1
 N    2.215800     -0.4815000     -0.2254000    
 N   0.8625000     -0.1469000      3.9099999E-02
 N    3.270900       2.704700      -1.878800    
 N    1.939400      -4.191700      0.1707000    
 C   0.3828000      0.3757000       1.219000    
 C    2.846100      0.3810000      -1.237700    
 C    2.415300      -1.902300     -0.5530000    
 C  -0.9930000      0.5556000       1.059500    
 C   -1.320900      0.1228000     -0.2558000    
 C  -0.1597000     -0.3031000     -0.8583000    
 C    2.631100       1.849700     -0.8849000    
 C    1.757000      -2.783400      0.5046000    
 C    1.054500      0.6997000       2.403100    
 C   -1.736600       1.084800       2.132900    
 C   -2.589200      9.3800001E-02 -0.9265000    
 C   -1.078100       1.413500       3.323300    
 C   0.2961000       1.223100       3.454200    
 C   -3.400600      -1.037900     -0.8373000    
 C   -3.012200       1.197200      -1.668400    
 C   -1.860100       1.974100       4.464500    
 C    4.714200       2.463300      -1.912700    
 C    2.998100       4.114800      -1.597200    
 C    1.386300      -5.046000       1.222600    
 C    1.314000      -4.500600      -1.116200    
 C   -4.633300      -1.066200      -1.489600    
 C   -4.244900       1.168800      -2.320600    
 C   -5.055500      3.7000000E-02  -2.231000    
 H    2.447200      0.1720000      -2.239400    
 H    3.911000      0.1285000      -1.241900    
 H    3.490400      -2.120900     -0.5871000    
 H    2.010800      -2.085700      -1.553600    
 H   1.7100001E-02 -0.6997000      -1.850300    
 H    3.014800       2.062200      0.1222000    
 H    1.562000       2.090300     -0.8870000    
 H   0.6856000      -2.579800      0.6152000    
 H    2.226900      -2.574500       1.475000    
 H    2.124000      0.5531000       2.511100    
 H   -2.808900       1.232700       2.034900    
 H   0.7995000       1.479500       4.383700    
 H   -3.086800      -1.906500     -0.2631000    
 H   -2.392800       2.087700      -1.748200    
 H    4.958700       1.506100      -2.382900    
 H    5.171300       2.507000     -0.9174000    
 H    5.211300       3.215500      -2.537700    
 H    3.433600       4.754500      -2.373000    
 H    3.399100       4.427400     -0.6261000    
 H    1.919600       4.308700      -1.604000    
 H   0.3056000      -4.907500       1.343100    
 H    1.870400      -4.837200       2.183200    
 H    1.576500      -6.102300       1.001400    
 H    1.886700      -4.099600      -1.957600    
 H   0.2791000      -4.144600      -1.177700    
 H    1.299900      -5.585100      -1.282000    
 H   -2.232200       1.163400       5.098600    
 H   -1.244600       2.643200       5.075500    
 H   -2.713200       2.561500       4.108100    
 H   -5.264500      -1.947300      -1.419900    
 H   -4.573900       2.027900      -2.897900    
 H   -6.015300      1.5100000E-02  -2.738700    


%chk=000042526-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000042526

0 1
N 2.168019 -0.481740 -0.335350
N 0.797271 -0.145883 -0.112226
N 3.436325 2.850052 -1.709956
N 2.088200 -4.280650 0.075090
C 0.287573 0.246902 1.134887
C 2.822297 0.462756 -1.291192
C 2.339576 -1.921626 -0.698191
C -1.122474 0.471999 0.971979
C -1.449929 0.196425 -0.426477
C -0.248775 -0.169509 -1.048824
C 2.832894 1.903576 -0.743702
C 1.913880 -2.855556 0.451565
C 0.951284 0.433628 2.364692
C -1.866867 0.930049 2.094864
C -2.765359 0.273174 -1.092467
C -1.226554 1.126765 3.336543
C 0.177714 0.866593 3.456688
C -3.966681 -0.048235 -0.397979
C -2.870220 0.655322 -2.461133
C -2.006041 1.611556 4.549052
C 4.906187 2.732696 -1.800978
C 3.015454 4.245943 -1.467062
C 2.311550 -5.151923 1.248231
C 0.990663 -4.790333 -0.775117
C -5.219389 0.011543 -1.045176
C -4.120981 0.705421 -3.111013
C -5.305974 0.387961 -2.405688
H 2.335055 0.467962 -2.292784
H 3.854321 0.091450 -1.423367
H 3.414023 -2.079873 -0.894726
H 1.790620 -2.179015 -1.633504
H -0.076960 -0.480393 -2.077718
H 3.352318 1.912592 0.247840
H 1.788734 2.218179 -0.564513
H 0.863565 -2.630542 0.759334
H 2.558201 -2.638901 1.322871
H 2.026167 0.249515 2.450184
H -2.935262 1.151476 1.998353
H 0.661155 1.020905 4.429524
H -3.912199 -0.383904 0.642954
H -1.963001 0.939423 -3.007801
H 5.197336 1.711957 -2.103511
H 5.424508 2.968910 -0.836034
H 5.283967 3.428207 -2.571460
H 3.414432 4.897109 -2.265806
H 3.365484 4.653300 -0.484585
H 1.913636 4.312378 -1.491249
H 1.439080 -5.190245 1.948910
H 3.191038 -4.798310 1.814801
H 2.517560 -6.182962 0.907680
H 0.884943 -4.171208 -1.682434
H 0.001714 -4.801536 -0.250061
H 1.221343 -5.821537 -1.097321
H -1.985034 0.866389 5.367439
H -1.582031 2.549873 4.954773
H -3.063867 1.803347 4.298721
H -6.128523 -0.246186 -0.489565
H -4.174209 1.005945 -4.163892
H -6.278858 0.434392 -2.907511


