%chk=000057773.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000057773

0 1
 O  -8.9999996E-03  0.1470000      1.6400000E-02
 O   0.8343000     -0.1707000      -2.101800    
 N   -3.674700      0.4200000      0.1741000    
 C   -4.637100      0.6585000       1.249300    
 C   -4.094000     -0.8405000     -0.4380000    
 C   -5.964700      0.2847000      0.6070000    
 C   -5.608100     -0.7032000     -0.4996000    
 C   -2.302500      0.3741000      0.6565000    
 C   -1.334300      0.1684000     -0.4975000    
 C    2.313700     -3.5300002E-02 -0.2370000    
 C   0.9843000     -3.0500000E-02 -0.8980000    
 C    2.993700       1.158800     -8.6700000E-02
 C    2.837100      -1.233600      0.2112000    
 C    4.242700       1.154400      0.5343000    
 C    4.086200      -1.237900      0.8322000    
 C    2.434900       2.458300     -0.5684000    
 C    2.108700      -2.528600      5.2000001E-02
 C    4.788900     -4.3900002E-02  0.9938000    
 H   -4.631300       1.700000       1.585900    
 H   -4.448900      1.0100000E-02   2.114700    
 H   -3.825300      -1.706200      0.1810000    
 H   -3.687200     -0.9851000      -1.443600    
 H   -6.449700       1.167300      0.1736000    
 H   -6.654200     -0.1537000       1.335500    
 H   -6.104600      -1.668300     -0.3564000    
 H   -5.925100     -0.3026000      -1.469800    
 H   -2.156000     -0.4136000       1.407800    
 H   -2.050500       1.317700       1.157700    
 H   -1.428800      0.9849000      -1.223800    
 H   -1.513800     -0.7857000      -1.004700    
 H    4.804100       2.075200      0.6688000    
 H    4.527000      -2.162300       1.196200    
 H    3.118800       3.292500     -0.3768000    
 H    2.260300       2.424400      -1.648900    
 H    1.494100       2.685000     -5.6000002E-02
 H    2.682500      -3.371200      0.4532000    
 H    1.154400      -2.500700      0.5883000    
 H    1.923700      -2.737600      -1.006800    
 H    5.761400     -4.7200002E-02   1.477400    


%chk=000057773-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000057773

0 1
O -0.022342 0.172347 0.129362
O 0.786247 0.893113 -1.923549
N -3.754318 0.113917 0.330164
C -4.727054 -0.068896 1.438599
C -4.267195 -0.718980 -0.794623
C -6.088034 0.020272 0.716117
C -5.819225 -0.633200 -0.679139
C -2.349435 -0.127382 0.702809
C -1.404222 0.379927 -0.391233
C 2.371085 0.226624 -0.168592
C 1.016084 0.459715 -0.766359
C 3.383461 1.213268 -0.402785
C 2.659434 -0.962753 0.573572
C 4.672887 1.001195 0.141769
C 3.970147 -1.138309 1.081691
C 3.119029 2.481014 -1.197444
C 1.635137 -2.059239 0.820416
C 4.969166 -0.164477 0.877986
H -4.589387 0.711021 2.208715
H -4.614256 -1.068157 1.934133
H -3.929733 -1.782336 -0.692176
H -3.894512 -0.342073 -1.763497
H -6.372628 1.079277 0.592945
H -6.890887 -0.488764 1.277094
H -6.267907 -1.639609 -0.748186
H -6.252284 -0.022426 -1.489056
H -2.139369 -1.211556 0.896373
H -2.132038 0.422843 1.636701
H -1.562432 1.454697 -0.588097
H -1.511592 -0.169882 -1.343156
H 5.448211 1.758657 -0.019633
H 4.203688 -2.051700 1.640759
H 3.988292 3.158172 -1.143588
H 2.912195 2.249318 -2.256316
H 2.233406 3.026838 -0.823964
H 2.131664 -2.966032 1.206402
H 0.876141 -1.734945 1.553107
H 1.088615 -2.332345 -0.099836
H 5.974961 -0.316254 1.285614


