%chk=000036017.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000036017

0 1
 O    7.773200     -0.4898000      5.7999999E-03
 O    6.676100       1.498400      4.4100001E-02
 N  -0.8576000      0.1583000      5.5999998E-03
 N   -3.429800       1.847900     -3.5999999E-03
 N   -2.395400      -1.681300      1.0800000E-02
 N   -5.485300      0.9857000     -2.7000001E-03
 N   -4.812500      -1.350300      7.0000002E-03
 C    2.878000     -0.6023000     -2.6799999E-02
 C    1.574300      0.2002000     -2.7000001E-02
 C    4.131500      0.2748000     -3.2499999E-02
 C   0.3233000     -0.6735000      1.0100000E-02
 C    5.402100     -0.5751000     -1.8900000E-02
 C   -2.149700     -0.3416000      6.0999999E-03
 C   -3.263100      0.4924000      1.6000000E-03
 C   -4.553300     -2.0600000E-02  2.0000001E-03
 C    6.650700      0.2759000      1.3500000E-02
 C   -4.777200       2.094900     -6.0000001E-03
 C   -3.685300      -2.094100      1.0900000E-02
 H    2.892800      -1.261200     -0.9040000    
 H    2.896600      -1.251800      0.8572000    
 H    1.546300      0.8397000     -0.9188000    
 H    1.569200      0.8770000      0.8373000    
 H    4.126700      0.9213000     -0.9187000    
 H    4.119100      0.9375000      0.8417000    
 H   0.3363000      -1.297700      0.9113000    
 H   0.3156000      -1.338400     -0.8615000    
 H    5.409200      -1.219600      0.8671000    
 H    5.438600      -1.201300     -0.9171000    
 H  -0.7440000       1.166000      4.6999999E-03
 H   -2.696300       2.544300     -5.2999998E-03
 H   -5.172800       3.100600     -1.0100000E-02
 H   -3.831800      -3.168900      1.4900000E-02
 H    8.587900      5.6100000E-02  2.7200000E-02


%chk=000036017-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000036017

0 1
O 7.853783 -0.646133 -0.030754
O 6.829772 1.437104 -0.002295
N -0.866793 0.277989 0.006478
N -3.620050 1.935661 -0.006971
N -2.296236 -1.598057 0.001329
N -5.644006 0.864363 -0.014171
N -4.752156 -1.456122 -0.008900
C 2.888303 -0.596312 0.000670
C 1.610448 0.271941 -0.005191
C 4.178422 0.251491 -0.012502
C 0.330847 -0.584496 0.012320
C 5.446430 -0.622332 -0.010240
C -2.146773 -0.235681 0.001491
C -3.330313 0.561983 -0.004158
C -4.604660 -0.091344 -0.008919
C 6.725866 0.190891 -0.013981
C -5.017130 2.048787 -0.012902
C -3.568493 -2.119992 -0.004128
H 2.876068 -1.270470 -0.880294
H 2.881513 -1.250685 0.896518
H 1.614041 0.919687 -0.906226
H 1.622857 0.943316 0.878525
H 4.188737 0.909437 -0.902578
H 4.197016 0.925226 0.865422
H 0.308834 -1.237039 0.906567
H 0.298160 -1.258990 -0.864630
H 5.471595 -1.288333 0.874929
H 5.470462 -1.297447 -0.888168
H -0.727307 1.287382 0.015365
H -2.963529 2.714436 -0.005850
H -5.516754 3.015600 -0.016202
H -3.622495 -3.212987 -0.004173
H 8.676942 -0.085373 -0.030485


