%chk=000025740.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000025740

0 1
 O   0.1954000       1.657500     -0.1780000    
 N    1.612200     -0.1599000     -0.3370000    
 N  -0.6463000     -0.5353000     -0.1667000    
 C    2.850500      0.6119000     -0.4163000    
 C    3.474100      0.7814000      0.9670000    
 C    3.933400     -0.1727000      -1.153000    
 C    4.176000     -0.5462000       1.247400    
 C    4.473100      -1.161900     -0.1215000    
 C   0.3529000      0.4396000     -0.2218000    
 C   -2.042400     -0.3415000     -5.0799999E-02
 C   -2.879600      -1.444600     -1.1700000E-02
 C   -2.544300      0.9477000      2.2399999E-02
 C   -4.256600      -1.253300      0.1036000    
 C   -3.921100       1.139000      0.1379000    
 C   -4.777300      3.8400002E-02  0.1785000    
 H    2.643800       1.575600     -0.8920000    
 H    2.744300       1.027100       1.745000    
 H    4.220000       1.585400      0.9394000    
 H    4.738700      0.5068000      -1.458200    
 H    3.564000     -0.6808000      -2.049500    
 H    3.521200      -1.212600       1.820700    
 H    5.088000     -0.3979000       1.834200    
 H    5.544000      -1.338700     -0.2639000    
 H    3.966500      -2.129600     -0.2134000    
 H    1.670200      -1.173200     -0.3066000    
 H  -0.3406000      -1.504000     -0.2165000    
 H   -2.484500      -2.455000     -6.8999998E-02
 H   -1.948800       1.848100     -2.3000001E-03
 H   -4.923300      -2.110100      0.1353000    
 H   -4.328200       2.144400      0.1964000    
 H   -5.849300      0.1875000      0.2683000    


%chk=000025740-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000025740

0 1
O 0.281141 1.584146 -0.101771
N 1.644808 -0.260103 -0.516720
N -0.668344 -0.577817 -0.308933
C 2.883642 0.547939 -0.540377
C 3.407325 0.870089 0.886293
C 4.042497 -0.282154 -1.142789
C 4.150983 -0.420577 1.344471
C 4.545327 -1.181162 0.029170
C 0.406258 0.335395 -0.290695
C -2.047775 -0.310687 -0.093978
C -2.942635 -1.414813 -0.165964
C -2.559834 0.986109 0.184417
C -4.324813 -1.229600 0.037285
C -3.946907 1.152536 0.386581
C -4.839271 0.058090 0.316335
H 2.666671 1.469225 -1.107475
H 2.587870 1.172057 1.558614
H 4.111048 1.721754 0.817085
H 4.841406 0.415612 -1.452654
H 3.740818 -0.854238 -2.039276
H 3.490531 -1.047368 1.970671
H 5.036765 -0.178183 1.957512
H 5.633337 -1.356386 -0.039292
H 4.066361 -2.178793 -0.002232
H 1.734649 -1.273092 -0.608859
H -0.447821 -1.554448 -0.514777
H -2.553892 -2.419496 -0.381429
H -1.870683 1.830746 0.234007
H -4.998506 -2.091859 -0.022650
H -4.331914 2.156222 0.600811
H -5.913039 0.203957 0.474521


