%chk=000100153.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000100153

0 1
 O  -0.7670000       2.217000      -1.050700    
 O    2.377700      -2.622200     -3.9500002E-02
 O   0.4185000      -1.877800     -0.7068000    
 N   -3.014500     -0.5627000     -9.2500001E-02
 N    1.151100      0.6472000      0.4227000    
 N    3.223200      5.7500001E-02 -3.5100002E-02
 N    1.576800      -1.666500     -0.2468000    
 C   -4.462700     -0.6284000      4.5400001E-02
 C   -3.572900     -0.5676000       1.252500    
 C   -2.593700      0.7800000     -0.4689000    
 C   -1.076900      0.8756000     -0.6657000    
 C  -0.2969000      0.5521000      0.6149000    
 C    1.977600     -0.3560000      3.7900001E-02
 C    1.886300       1.769900      0.6111000    
 C    3.173300       1.381900      0.3215000    
 H   -4.914100      -1.579700     -0.2030000    
 H   -5.050600      0.2452000     -0.2051000    
 H   -3.564200      0.3380000       1.844600    
 H   -3.422900      -1.480100       1.815300    
 H   -2.916900       1.570200      0.2247000    
 H   -3.062200       1.047400      -1.427100    
 H  -0.7659000      0.2321000      -1.494700    
 H  -0.5238000     -0.4348000       1.028100    
 H  -0.5409000       1.281800       1.398600    
 H   -1.038500       2.808500     -0.3281000    
 H    1.463100       2.714700      0.9229000    
 H    4.066300       1.988800      0.3516000    


%chk=000100153-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000100153

0 1
O -0.849550 2.853305 -0.214574
O 2.694382 -2.512825 1.480503
O 0.586374 -1.718488 1.891276
N -3.072016 -0.177670 -0.630115
N 1.092080 0.519552 0.229865
N 3.297324 -0.102869 0.153763
N 1.775892 -1.624170 1.355109
C -4.495106 -0.581897 -0.339183
C -3.358282 -1.153471 0.492041
C -2.696722 1.206546 -0.244110
C -1.177343 1.427614 -0.424438
C -0.372071 0.484716 0.484162
C 2.062318 -0.434905 0.585160
C 1.781696 1.509739 -0.465437
C 3.129907 1.108120 -0.500263
H -4.974284 -1.191592 -1.110640
H -5.152484 0.151537 0.148307
H -3.261261 -0.795542 1.526891
H -3.010448 -2.176762 0.322797
H -2.993527 1.467825 0.805436
H -3.209933 1.910026 -0.924124
H -0.918313 1.246530 -1.481011
H -0.720629 -0.545401 0.317562
H -0.553484 0.715949 1.551577
H -1.120326 3.122840 0.700577
H 1.272512 2.396612 -0.832993
H 3.972595 1.626780 -0.950340


