%chk=000038183.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000038183

1 1
 O   0.9035000      0.6154000       1.994600    
 N   -4.082500     -0.1719000     -0.1448000    
 C   -2.956200      -1.023200      0.3051000    
 C   -5.427900     -0.7635000      0.3004000    
 C   -4.099700     -5.1300000E-02  -1.675700    
 C   -3.968000       1.242600      0.4421000    
 C   -1.623600     -0.4313000     -0.1396000    
 C  -0.4128000      -1.273200      0.2877000    
 C   -5.473000     -0.8169000       1.811900    
 C   -4.212100      -1.432600      -2.283100    
 C   -5.155600       2.065900     -6.5000001E-03
 C   0.9399000     -0.6228000     -9.1300003E-02
 C    2.082700      -1.622100     -3.4400001E-02
 C    1.224200      0.5905000      0.8073000    
 C    2.366300      -2.421000      -1.142200    
 C    2.848800      -1.740300       1.125300    
 C    1.930800       1.775800      0.2429000    
 C    3.415800      -3.338500      -1.090100    
 C    3.898400      -2.657700       1.177200    
 C    2.851300       1.611400     -0.7923000    
 C    1.671100       3.049300      0.7495000    
 C    4.181700      -3.456800      6.9399998E-02
 C    3.512200       2.720400      -1.320600    
 C    2.332100       4.158200      0.2210000    
 C    3.252600       3.993700     -0.8140000    
 H   -3.094300      -2.056200     -2.7700000E-02
 H   -2.940700      -1.038200       1.399200    
 H   -6.263700     -0.2224000     -0.1497000    
 H   -5.475300      -1.798100     -5.2299999E-02
 H   -4.996200      0.4945000      -1.980000    
 H   -3.226400      0.5067000      -2.022700    
 H   -3.851600       1.193000       1.527800    
 H   -3.074800       1.718300      2.6799999E-02
 H   -1.474800      0.5645000      0.2850000    
 H   -1.563600     -0.3387000      -1.227300    
 H  -0.4970000      -2.255400     -0.1962000    
 H  -0.4565000      -1.461500       1.368100    
 H   0.8514000     -0.2566000      -1.123200    
 H   -4.708800      -1.454100       2.261800    
 H   -5.462200      0.1625000       2.294900    
 H   -6.429500      -1.269400       2.103600    
 H   -3.353100      -2.075900      -2.078600    
 H   -5.133200      -1.962400      -2.032300    
 H   -4.234300      -1.320400      -3.374700    
 H   -5.216300       2.235800      -1.083000    
 H   -6.119900       1.720800      0.3710000    
 H   -5.036300       3.070200      0.4219000    
 H    1.775700      -2.338600      -2.050700    
 H    2.652900      -1.155000       2.017000    
 H    3.636100      -3.961000      -1.952300    
 H    4.492300      -2.753600       2.081400    
 H    3.088200      0.6387000      -1.208400    
 H   0.9534000       3.197400       1.552100    
 H    4.998100      -4.171900      0.1104000    
 H    4.230500       2.592600      -2.125200    
 H    2.129200       5.150000      0.6145000    
 H    3.767300       4.857000      -1.225300    


%chk=000038183-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000038183

1 1
O 0.143441 1.139831 1.192295
N -4.264540 -0.225489 -0.150332
C -2.952386 -1.033799 0.055038
C -5.450043 -1.040875 0.430879
C -4.523145 0.035222 -1.656612
C -4.119505 1.140093 0.578263
C -1.695421 -0.465235 -0.623111
C -0.448060 -1.224244 -0.096479
C -5.419484 -1.262123 1.948444
C -4.609974 -1.216678 -2.538406
C -5.376210 2.017342 0.597885
C 0.893935 -0.519758 -0.435556
C 2.069786 -1.429333 -0.045269
C 0.985592 0.854903 0.280642
C 2.737618 -2.198978 -1.030697
C 2.463872 -1.556822 1.311210
C 2.051474 1.826252 -0.106594
C 3.781156 -3.080220 -0.669579
C 3.509952 -2.433989 1.672689
C 3.004866 1.558814 -1.129063
C 2.099598 3.075687 0.574981
C 4.171140 -3.199141 0.684308
C 3.978038 2.522311 -1.463302
C 3.072506 4.035725 0.240648
C 4.014114 3.761938 -0.781799
H -3.160161 -2.061059 -0.291399
H -2.792113 -1.065476 1.145407
H -6.367859 -0.507343 0.131782
H -5.435345 -2.009988 -0.093569
H -5.465072 0.605120 -1.712595
H -3.705541 0.693216 -1.993331
H -3.787554 0.904776 1.602330
H -3.291684 1.665540 0.076397
H -1.569275 0.600014 -0.369465
H -1.751731 -0.560232 -1.724241
H -0.418382 -2.251297 -0.506709
H -0.510187 -1.306034 1.004835
H 0.943271 -0.345251 -1.529859
H -4.536587 -1.829721 2.284916
H -5.481961 -0.324086 2.523890
H -6.306403 -1.863652 2.215409
H -3.689766 -1.823532 -2.517397
H -5.470255 -1.860809 -2.293624
H -4.750899 -0.881038 -3.581060
H -5.711900 2.322378 -0.407009
H -6.221936 1.554781 1.132961
H -5.122247 2.944614 1.141366
H 2.441066 -2.112230 -2.084326
H 1.962327 -0.962687 2.085094
H 4.289950 -3.669279 -1.440318
H 3.812399 -2.518070 2.722108
H 3.006439 0.596999 -1.649750
H 1.365518 3.265111 1.364825
H 4.983773 -3.877394 0.965110
H 4.712012 2.308015 -2.246892
H 3.104828 4.992575 0.771972
H 4.773555 4.507303 -1.041641


