%chk=000019843.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000019843

0 1
 O    1.993900     -0.3806000      1.8800000E-02
 O    4.095300      -1.250300     -0.2061000    
 N   -3.175600     -0.2711000     -0.2558000    
 N    3.815600       1.048800      2.4999999E-03
 C   -4.898100       1.301200     -0.3740000    
 C   -3.610300       2.002400      4.7499999E-02
 C   -4.632400     -0.1817000     -0.1603000    
 C   -2.674800      0.8855000      0.4862000    
 C   -2.660800      -1.529500      0.2633000    
 C   -1.200200      -1.583500      0.1514000    
 C  -3.4000000E-03  -1.631900      6.1299998E-02
 C    1.453400      -1.692400     -4.9899999E-02
 C    3.362000     -0.2722000     -7.2099999E-02
 C    5.234000       1.384700     -7.4500002E-02
 C    2.901200       2.170500      0.1617000    
 H   -5.756700       1.643600      0.2125000    
 H   -5.106400       1.511700      -1.429600    
 H   -3.191000       2.550100     -0.8047000    
 H   -3.785200       2.720500      0.8550000    
 H   -4.994900     -0.4830000      0.8310000    
 H   -5.134300     -0.7940000     -0.9160000    
 H   -1.636700       1.134600      0.2433000    
 H   -2.757000      0.7421000       1.571500    
 H   -3.086100      -2.360600     -0.3122000    
 H   -2.955000      -1.682600       1.309500    
 H    1.732900      -2.152200      -1.004700    
 H    1.861900      -2.298200      0.7669000    
 H    5.525500       1.898100      0.8461000    
 H    5.394300       2.043900     -0.9324000    
 H    5.845000      0.4864000     -0.1932000    
 H    1.853400       1.869300      0.2149000    
 H    3.027400       2.845600     -0.6901000    
 H    3.158800       2.701100       1.083300    


%chk=000019843-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000019843

0 1
O 2.214844 -0.030242 -0.061594
O 4.085277 -0.995367 -1.114556
N -3.454684 -0.290714 -0.081192
N 4.305451 0.889290 0.276923
C -5.598507 0.739400 -0.361190
C -4.467878 1.709480 -0.850922
C -4.852599 -0.379991 0.416857
C -3.176023 1.164228 -0.196157
C -2.491600 -1.055720 0.740134
C -1.119705 -1.045760 0.202131
C 0.043689 -1.046411 -0.206449
C 1.402739 -1.088715 -0.740350
C 3.596575 -0.108862 -0.358706
C 5.761202 0.955800 0.082500
C 3.695411 1.900209 1.153217
H -6.331962 1.249240 0.287559
H -6.147340 0.321701 -1.221931
H -4.379013 1.667145 -1.949629
H -4.656689 2.758946 -0.565520
H -4.908679 -0.182158 1.519766
H -5.267083 -1.387577 0.232744
H -2.267843 1.338692 -0.797108
H -3.018206 1.632112 0.811031
H -2.847323 -2.103631 0.798866
H -2.453815 -0.674009 1.797026
H 1.415196 -0.895163 -1.829317
H 1.885541 -2.068362 -0.568440
H 6.286684 0.861044 1.052484
H 6.048675 1.919769 -0.380506
H 6.069224 0.131755 -0.578069
H 2.610255 1.742838 1.202417
H 3.896561 2.917572 0.763991
H 4.117325 1.829763 2.175091


