%chk=000024221.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000024221

0 1
 O   -2.208400     -0.6868000     -0.2623000    
 O   -3.619300       1.816400     -0.3879000    
 O    4.093100      0.9970000      0.7578000    
 N   5.7399999E-02   2.064200     -2.0000001E-03
 C   -2.380600       1.678100      0.3139000    
 C   -2.268100      0.2311000      0.8271000    
 C   -1.255200       2.122500     -0.6301000    
 C    1.095400       2.511000     -0.9212000    
 C   -3.455700     -0.1690000       1.696100    
 C    2.464200       2.433100     -0.2525000    
 C    2.805700       1.006700      0.1565000    
 C   -1.095100      -1.479100     -0.3369000    
 C  -0.7921000      -2.343800      0.7098000    
 C  -0.2755000      -1.412700      -1.458900    
 C   0.3431000      -3.150800      0.6339000    
 C   0.8597000      -2.219900      -1.534900    
 C    1.168900      -3.088900     -0.4884000    
 C    4.462300     -0.3090000       1.180000    
 H   -2.416200       2.365900       1.168500    
 H   -1.363500      0.1716000       1.448100    
 H   -1.280300       1.511400      -1.540300    
 H   -1.470600       3.148500     -0.9576000    
 H   6.4599998E-02   2.642100      0.8378000    
 H    1.099300       1.889600      -1.824900    
 H   0.9126000       3.547500      -1.228900    
 H   -3.613100      0.5477000       2.508000    
 H   -3.296800      -1.156000       2.141900    
 H   -4.376800     -0.2481000       1.108500    
 H    3.231900       2.808800     -0.9402000    
 H    2.505000       3.090000      0.6258000    
 H    2.076100      0.6194000      0.8765000    
 H    2.811800      0.3546000     -0.7247000    
 H   -4.333600       1.835700      0.2711000    
 H   -1.427400      -2.414900       1.586800    
 H  -0.5121000     -0.7405000      -2.278500    
 H   0.5831000      -3.828800       1.447600    
 H    1.503200      -2.171100      -2.408400    
 H    2.053200      -3.716700     -0.5473000    
 H    5.458700     -0.2576000       1.626900    
 H    3.760800     -0.6817000       1.932800    
 H    4.497000     -0.9929000      0.3263000    


%chk=000024221-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000024221

0 1
O -1.754222 -0.310736 -0.530965
O -3.691685 1.971542 -0.286197
O 3.910654 0.932433 1.091398
N -0.037475 2.558193 0.100445
C -2.401322 1.851636 0.402682
C -1.994537 0.399058 0.746117
C -1.378251 2.537012 -0.523268
C 1.106551 2.656623 -0.838667
C -3.050820 -0.357758 1.568237
C 2.451986 2.438557 -0.116674
C 2.590671 1.023861 0.453274
C -0.830354 -1.365883 -0.564760
C -0.112959 -1.861609 0.554630
C -0.633637 -1.945615 -1.844761
C 0.802868 -2.925004 0.376755
C 0.279471 -3.006150 -2.004357
C 1.007095 -3.504107 -0.894917
C 4.147281 -0.388709 1.663839
H -2.443281 2.391293 1.379482
H -1.035548 0.489972 1.292712
H -1.325701 1.943987 -1.452110
H -1.773910 3.542635 -0.789987
H 0.033328 3.269928 0.841628
H 0.970649 1.872963 -1.609559
H 1.139080 3.634541 -1.378602
H -3.312993 0.203352 2.485244
H -2.683498 -1.353357 1.869923
H -3.967624 -0.519815 0.971440
H 3.280019 2.620035 -0.827864
H 2.571548 3.172947 0.704891
H 1.787977 0.819597 1.193516
H 2.504674 0.264768 -0.357364
H -4.390863 1.509066 0.240571
H -0.252257 -1.437086 1.553246
H -1.202731 -1.547494 -2.690725
H 1.353355 -3.303909 1.245891
H 0.424431 -3.445445 -2.997838
H 1.715278 -4.329578 -1.021564
H 5.155138 -0.362123 2.108311
H 3.402672 -0.631322 2.453944
H 4.105642 -1.183697 0.887805


