%chk=000122359.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000122359

0 1
 O   -3.654300      7.0500001E-02   1.046900    
 N    2.553400       1.492500     -0.1725000    
 C    1.217300     -0.3355000      0.4329000    
 C    1.577400      0.4339000       1.727500    
 C    2.412500      6.4000003E-02 -0.4590000    
 C    1.236100      -1.858700      0.6533000    
 C    2.428900       1.626800       1.279600    
 C  -0.1755000      7.6200001E-02 -7.8800000E-02
 C   0.9826000      -2.603500     -0.6506000    
 C    3.792400       2.052800     -0.6877000    
 C   -1.296500     -0.1155000      0.7265000    
 C  -0.3111000      0.6393000      -1.346300    
 C   0.9763000      -4.107300     -0.4282000    
 C   -2.557900      0.2574000      0.2626000    
 C   -1.572500       1.012200      -1.810300    
 C   -2.695900      0.8212000      -1.005800    
 C   -4.913300      0.4737000      0.5100000    
 H    2.181600     -0.1951000       2.394100    
 H   0.7102000      0.7713000       2.304000    
 H    3.319500     -0.4740000     -0.1462000    
 H    2.279500     -0.1341000      -1.526100    
 H   0.4912000      -2.156800       1.401700    
 H    2.207800      -2.169400       1.060400    
 H    1.945300       2.575600       1.533800    
 H    3.398600       1.590000       1.791400    
 H    1.756100      -2.373100      -1.390800    
 H   1.8100001E-02  -2.331800      -1.091300    
 H    3.850900       3.122900     -0.4607000    
 H    3.830700       1.955200      -1.778100    
 H    4.678800       1.563300     -0.2685000    
 H   -1.206700     -0.5535000       1.717100    
 H   0.5217000      0.8105000      -2.017100    
 H    1.936100      -4.449600     -2.8000001E-02
 H   0.1876000      -4.397700      0.2733000    
 H   0.7981000      -4.629900      -1.373400    
 H   -1.679900       1.450700      -2.798300    
 H   -3.645000       1.133000      -1.428300    
 H   -4.946600       1.553600      0.3295000    
 H   -5.673000      0.2527000       1.266800    
 H   -5.173700     -0.1046000     -0.3829000    


%chk=000122359-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000122359

0 1
O -3.797302 -0.730824 0.364817
N 2.837545 1.425647 -0.320664
C 1.139203 -0.160961 0.389029
C 1.625210 0.747316 1.600133
C 2.215173 0.138122 -0.714751
C 1.204883 -1.662199 0.793766
C 2.983635 1.333580 1.153045
C -0.269522 0.298647 -0.047361
C 0.944507 -2.677393 -0.344712
C 4.071331 1.756915 -1.048694
C -1.439548 -0.407264 0.308312
C -0.412062 1.519389 -0.770330
C 1.029420 -4.139214 0.145267
C -2.721638 0.076908 -0.053949
C -1.687435 1.993693 -1.128853
C -2.861046 1.282382 -0.779267
C -5.147017 -0.280155 0.025442
H 1.710200 0.158805 2.531015
H 0.901282 1.559668 1.775129
H 2.974954 -0.686093 -0.716725
H 1.785469 0.204004 -1.729657
H 0.498487 -1.857798 1.626117
H 2.216546 -1.851699 1.210502
H 3.192753 2.327216 1.588614
H 3.822635 0.646497 1.440166
H 1.683165 -2.520615 -1.156124
H -0.050680 -2.493672 -0.791740
H 4.457607 2.734131 -0.707477
H 3.860456 1.833301 -2.130473
H 4.881597 0.995453 -0.908331
H -1.400308 -1.342473 0.873617
H 0.487932 2.093444 -1.019562
H 2.025042 -4.359381 0.575821
H 0.274385 -4.339904 0.929032
H 0.853595 -4.852295 -0.681092
H -1.780049 2.934310 -1.684422
H -3.843351 1.669186 -1.066181
H -5.371438 0.704138 0.481909
H -5.819999 -1.043945 0.442766
H -5.288818 -0.217670 -1.071633


