%chk=000101422.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000101422

0 1
 O  -0.6463000      -2.205500     -0.5312000    
 O    3.605900     -0.4679000      0.4257000    
 N    1.838000       1.026200      0.1888000    
 N   -1.573300      0.6383000     -0.5057000    
 N    1.492700      -1.359000     -5.1800001E-02
 N  -0.2093000       2.357800     -0.1144000    
 C  -0.3333000      0.1039000     -0.3030000    
 C   0.4817000       1.177000     -6.5600000E-02
 C   0.1011000      -1.255200     -0.3164000    
 C    2.405300     -0.2728000      0.2048000    
 C   -1.447700       1.998000     -0.3820000    
 C   -2.798000     -6.8200000E-02 -0.7955000    
 C    2.665900       2.200200      0.4359000    
 C    2.057300      -2.704400     -3.8400002E-02
 C   -3.522300     -0.4337000      0.4253000    
 C   -4.117600     -0.7346000       1.423500    
 H   -2.286900       2.671000     -0.4951000    
 H   -3.415600      0.5916000      -1.416400    
 H   -2.566800     -0.9432000      -1.408800    
 H    3.707500       1.925500      0.6200000    
 H    2.280100       2.729200       1.312700    
 H    2.623100       2.856000     -0.4392000    
 H    1.313800      -3.478800     -0.2396000    
 H    2.508900      -2.883600      0.9426000    
 H    2.848300      -2.758500     -0.7931000    
 H   -4.645200      -1.001500       2.309200    


%chk=000101422-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000101422

0 1
O -0.401760 -2.438977 -0.555107
O 3.783208 -0.363653 0.112442
N 1.880545 1.008504 0.195148
N -1.608622 0.414425 -0.184541
N 1.690635 -1.367649 -0.222152
N -0.279298 2.225578 0.239291
C -0.283457 -0.050776 -0.166891
C 0.500331 1.084103 0.094654
C 0.260215 -1.372759 -0.335393
C 2.528556 -0.238994 0.034477
C -1.550705 1.776829 0.059412
C -2.804138 -0.417667 -0.485516
C 2.679250 2.219399 0.472047
C 2.401277 -2.658765 -0.376929
C -3.970858 -0.057784 0.334660
C -4.971141 0.228962 0.992892
H -2.439652 2.399355 0.115392
H -3.054484 -0.314124 -1.558933
H -2.505081 -1.470026 -0.325639
H 3.735459 1.917582 0.516679
H 2.366676 2.665008 1.430916
H 2.527797 2.962909 -0.328136
H 1.639992 -3.433630 -0.547833
H 2.983236 -2.879187 0.532395
H 3.098366 -2.605806 -1.228992
H -5.839049 0.474942 1.577956


