%chk=000039653.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000039653

0 1
 O    1.554200     -2.6799999E-02 -0.5098000    
 O   0.1983000      0.1171000       1.355000    
 N  -0.7950000      -1.832100     -0.9519000    
 N    5.127900      0.5648000      0.1829000    
 C  -0.7398000     -0.3695000     -0.8077000    
 C   -2.042300      0.2771000     -0.3960000    
 C   -2.983800      -1.997400      0.1747000    
 C   -3.104700     -0.4975000      0.1039000    
 C   -1.528500      -2.462700      0.1488000    
 C   0.3654000     -6.5300003E-02  0.1566000    
 C   -2.192700       1.669200     -0.4887000    
 C   -4.301900      0.1254000      0.4811000    
 C   -3.384400       2.280900     -0.1002000    
 C   -4.438300       1.509700      0.3833000    
 C    2.702200      0.2567000      0.2963000    
 C    3.934800      0.2627000     -0.5937000    
 C    6.310200      0.6122000     -0.6808000    
 C    5.318400     -0.4244000       1.246400    
 H  -0.4727000      4.6300001E-02  -1.788000    
 H   -3.457700      -2.368400       1.091200    
 H   -3.524200      -2.425300     -0.6791000    
 H   -1.039700      -2.259800       1.109200    
 H   -1.506900      -3.549900      1.2800000E-02
 H   0.1450000      -2.220000      -1.021900    
 H   -1.379500       2.284700     -0.8655000    
 H   -5.135100     -0.4663000      0.8519000    
 H   -3.490900       3.359000     -0.1768000    
 H   -5.367900       1.985700      0.6811000    
 H    2.571500       1.232700      0.7792000    
 H    2.753200     -0.5248000       1.060800    
 H    4.017400     -0.7005000      -1.115500    
 H    3.790100       1.017800      -1.377300    
 H    6.185700       1.370900      -1.461500    
 H    7.197300      0.8992000     -0.1052000    
 H    6.507700     -0.3517000      -1.163900    
 H    5.280000      -1.454300      0.8727000    
 H    6.293900     -0.2827000       1.728000    
 H    4.588400     -0.3031000       2.052400    


%chk=000039653-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000039653

0 1
O 1.361294 -0.169395 -0.257058
O 0.647836 -1.798303 1.257829
N -1.389847 -2.578818 -0.681389
N 4.923674 0.876524 0.325380
C -0.751858 -1.261138 -0.753516
C -1.756661 -0.125780 -0.487061
C -3.495714 -1.831279 0.318614
C -3.048860 -0.403372 0.036653
C -2.296183 -2.780639 0.474455
C 0.459310 -1.125401 0.219443
C -1.387512 1.212082 -0.776089
C -3.939059 0.677502 0.265129
C -2.284983 2.275700 -0.550607
C -3.570210 2.007229 -0.023344
C 2.569051 0.119584 0.575264
C 3.701948 0.462731 -0.401656
C 5.829643 1.689836 -0.512092
C 5.632370 -0.251893 0.966350
H -0.336570 -1.116856 -1.769091
H -4.126764 -1.859685 1.227617
H -4.118812 -2.184805 -0.526589
H -1.788323 -2.602930 1.447393
H -2.639423 -3.830404 0.457159
H -0.715592 -3.343963 -0.797825
H -0.386627 1.413912 -1.173126
H -4.935066 0.464228 0.673599
H -1.986245 3.303812 -0.783384
H -4.274516 2.826313 0.160860
H 2.337227 0.981515 1.223747
H 2.779981 -0.763366 1.202340
H 3.877961 -0.408455 -1.082354
H 3.370435 1.307095 -1.033078
H 5.291534 2.575557 -0.893430
H 6.678105 2.044311 0.100145
H 6.248304 1.132566 -1.388397
H 6.014538 -1.003010 0.228591
H 6.493207 0.134401 1.539935
H 4.968004 -0.775807 1.674381


