%chk=000086691.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000086691

0 1
 O  -0.7327000      0.9746000     -0.2927000    
 O   -1.077400      -1.024200      -1.381200    
 N    2.700900     -0.2570000      0.3810000    
 C   0.6872000      0.9147000     -0.4647000    
 C    1.249300     -0.1679000      0.4599000    
 C    1.245900       2.301000     -0.1703000    
 C    3.123600     -0.6203000     -0.9734000    
 C    3.212900      -1.229400       1.349000    
 C   -1.409200     -0.1739000     -0.5672000    
 C   -2.632600     -0.2466000      0.2792000    
 C   -2.948400      0.8517000       1.247900    
 C   -3.419500      -1.322700      0.1325000    
 H   0.8714000      0.6885000      -1.521200    
 H   0.8022000      -1.147500      0.2527000    
 H   0.9483000      7.5900003E-02   1.488500    
 H    2.322200       2.361200     -0.3547000    
 H    1.050900       2.587300      0.8693000    
 H   0.7493000       3.050400     -0.7968000    
 H    2.944500      0.1869000      -1.689700    
 H    2.632500      -1.532000      -1.332700    
 H    4.206600     -0.7915000      -1.000400    
 H    2.928400     -0.9446000       2.368000    
 H    4.308100      -1.255000       1.326700    
 H    2.839500      -2.241700       1.155900    
 H   -2.145000      0.9572000       1.984400    
 H   -3.071200       1.804500      0.7225000    
 H   -3.875400      0.6577000       1.798200    
 H   -4.325100      -1.433900      0.7206000    
 H   -3.195600      -2.120900     -0.5672000    


%chk=000086691-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000086691

0 1
O -0.721101 0.757738 0.281003
O -1.082068 -0.885971 -1.341159
N 2.889181 -0.352598 0.121432
C 0.720407 0.848519 -0.134637
C 1.512830 -0.225503 0.651161
C 1.171700 2.275153 0.165378
C 2.967449 -1.219315 -1.074489
C 3.883293 -0.730911 1.145204
C -1.517707 -0.165991 -0.405414
C -2.926055 -0.154723 0.118628
C -3.272936 0.773934 1.263652
C -3.818861 -0.992165 -0.477969
H 0.765536 0.625432 -1.216106
H 0.955476 -1.191533 0.610273
H 1.564081 0.085611 1.711178
H 2.256417 2.345769 -0.027161
H 0.980668 2.531071 1.223191
H 0.644650 3.005388 -0.472271
H 2.225757 -0.903866 -1.827355
H 2.774021 -2.296363 -0.841962
H 3.972070 -1.137870 -1.527050
H 3.857064 -0.008234 1.979854
H 4.895788 -0.703112 0.702735
H 3.724438 -1.755926 1.566420
H -2.657606 0.552270 2.154111
H -3.065570 1.825488 0.996392
H -4.337907 0.678710 1.535466
H -4.863761 -1.038230 -0.152642
H -3.505656 -1.640274 -1.303764


