%chk=000146659.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000146659

0 1
 O   -2.599800       2.230300       1.589100    
 O   -3.315900       1.514400      -1.907000    
 N   0.1401000       2.068800      0.1351000    
 C   -2.288400       2.052300      0.2089000    
 C   -3.434600       1.314700     -0.4980000    
 C  -0.9799000       1.306400      0.1331000    
 C  -0.9676000     -8.6000003E-02  9.6500002E-02
 C   -3.447400     -0.1664000     -0.1810000    
 C   -2.238100     -0.8432000      0.1032000    
 C    1.502500      7.5300001E-02  2.6300000E-02
 C   0.3016000     -0.6776000      3.3000000E-02
 C    1.341500       1.473600      8.2300000E-02
 C    2.824500     -0.4973000     -3.4000002E-02
 C   -4.667200     -0.8615000     -0.2074000    
 C   -2.311900      -2.218300      0.3898000    
 C    3.946600      0.3667000     -3.4100000E-02
 C    2.467000       2.280700      8.0700003E-02
 C   -4.708000      -2.223900      7.0500001E-02
 C   -3.532200      -2.900200      0.3733000    
 C    3.751400       1.746500      2.3700001E-02
 C    3.093000      -1.888100     -9.3099996E-02
 C    5.252000     -0.1514000     -9.1499999E-02
 C    4.395200      -2.392400     -0.1500000    
 C    5.475400      -1.523400     -0.1494000    
 H   -2.156500       3.046600     -0.2356000    
 H   -4.387700       1.758200     -0.1844000    
 H   0.3641000      -1.760500     -2.6000001E-02
 H   -5.591600     -0.3400000     -0.4428000    
 H   -1.423500      -2.791400      0.6421000    
 H    2.358600       3.363400      0.1237000    
 H   -3.417600       2.753900       1.639900    
 H   -3.860200      0.8481000      -2.359600    
 H   -5.654400      -2.755700      5.3599998E-02
 H   -3.560200      -3.962800      0.5976000    
 H    4.598700       2.429500      2.4800001E-02
 H    2.286200      -2.616400     -9.5899999E-02
 H    6.112300      0.5155000     -9.1499999E-02
 H    4.559100      -3.465200     -0.1945000    
 H    6.488900      -1.910100     -0.1934000    


%chk=000146659-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000146659

0 1
O -2.783578 2.300530 1.506581
O -3.288577 1.470671 -2.011517
N 0.053287 2.109135 0.100215
C -2.373782 2.070304 0.103598
C -3.508553 1.282432 -0.553151
C -1.048013 1.331666 0.051955
C -1.002917 -0.106362 0.013722
C -3.506381 -0.189837 -0.185236
C -2.272884 -0.873263 0.038651
C 1.458255 0.074679 0.005168
C 0.268801 -0.706380 -0.030621
C 1.296989 1.505609 0.089693
C 2.807086 -0.491972 -0.035624
C -4.728492 -0.894842 -0.119489
C -2.313024 -2.264749 0.320938
C 3.939505 0.400693 0.025831
C 2.453563 2.364048 0.149398
C -4.754008 -2.281503 0.146482
C -3.535906 -2.965584 0.365707
C 3.727500 1.828635 0.120365
C 3.058800 -1.895019 -0.132036
C 5.264010 -0.135050 -0.009384
C 4.366155 -2.399552 -0.165665
C 5.480693 -1.514539 -0.103392
H -2.253847 3.033402 -0.427850
H -4.471354 1.743110 -0.256163
H 0.345104 -1.795078 -0.101608
H -5.668075 -0.348334 -0.269715
H -1.386953 -2.808573 0.535588
H 2.273608 3.441217 0.211586
H -2.066090 2.831278 1.938541
H -3.841489 0.807582 -2.497698
H -5.707314 -2.818111 0.197151
H -3.540635 -4.038155 0.588428
H 4.605812 2.483218 0.164556
H 2.223088 -2.600158 -0.184153
H 6.113380 0.556657 0.037885
H 4.532583 -3.479594 -0.240834
H 6.499653 -1.915111 -0.129903


