%chk=000034533.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000034533

0 1
 O    1.730700      -1.876800      0.1306000    
 N  -0.4515000      0.5192000      0.5531000    
 N   0.2070000      0.3907000     -0.5050000    
 C   -2.470000     -0.8125000      0.3111000    
 C   -1.821100      0.4217000      0.2776000    
 C    1.581300      0.4889000     -0.2281000    
 C   -3.834600     -0.8908000      3.3300001E-02
 C    2.319900     -0.6489000      8.5000001E-02
 C   -2.536900       1.577800     -3.3399999E-02
 C   -1.724600      -2.064200      0.6416000    
 C   -4.550500      0.2652000     -0.2779000    
 C   -3.901500       1.499500     -0.3112000    
 C    2.195700       1.737400     -0.2710000    
 C    3.683300     -0.5372000      0.3574000    
 C    3.559200       1.849100      1.2000001E-03
 C    4.303000      0.7117000      0.3154000    
 C    1.710600      -2.630800      -1.079800    
 H   -4.354100      -1.845200      5.3199999E-02
 H   -2.041200       2.544700     -6.1400000E-02
 H   -2.406200      -2.869100      0.9386000    
 H   -1.160500      -2.405600     -0.2310000    
 H   -1.038700      -1.909700       1.480900    
 H   -5.612900      0.2044000     -0.4947000    
 H   -4.459000       2.399500     -0.5535000    
 H    1.624500       2.629000     -0.5157000    
 H    4.269100      -1.418700      0.6038000    
 H    4.041700       2.821500     -3.1599998E-02
 H    5.364600      0.7987000      0.5276000    
 H    1.216500      -3.585600     -0.8804000    
 H    2.730200      -2.830400      -1.424800    
 H    1.148500      -2.101100      -1.855200    


%chk=000034533-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000034533

0 1
O 2.772122 -0.606280 -2.337063
N -0.412777 -0.137007 0.507738
N 0.484544 -0.311458 -0.434891
C -2.763845 -0.049348 1.084989
C -1.770668 -0.262690 0.074501
C 1.836452 -0.194629 -0.003991
C -4.125965 -0.163532 0.714305
C 2.885282 -0.350606 -0.975218
C -2.157815 -0.580673 -1.259560
C -2.375725 0.289782 2.511335
C -4.508030 -0.478900 -0.609045
C -3.517094 -0.688480 -1.600104
C 2.200811 0.069377 1.355601
C 4.243086 -0.237813 -0.558330
C 3.537927 0.176602 1.749927
C 4.568680 0.021050 0.779705
C 1.489414 -0.781516 -3.034882
H -4.896980 -0.002541 1.476831
H -1.372621 -0.738602 -2.004567
H -3.273394 0.421785 3.139830
H -1.749324 -0.504669 2.954384
H -1.776947 1.216707 2.553330
H -5.570004 -0.561326 -0.866299
H -3.810311 -0.934196 -2.626886
H 1.380932 0.182503 2.071306
H 5.015529 -0.361635 -1.323092
H 3.792572 0.378001 2.795674
H 5.620741 0.102160 1.074141
H 1.781820 -0.964385 -4.081194
H 0.864525 0.123126 -2.948857
H 0.929564 -1.638408 -2.623919


