%chk=000027151.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000027151

1 1
 O    3.177900     -0.9920000      0.1385000    
 O    3.433500       1.372100     -0.2484000    
 O   0.6442000      -2.259900      0.4806000    
 N   -2.743300      0.2051000      0.2831000    
 C  -0.3904000     -9.1200002E-02  0.1974000    
 C  -0.2431000       1.305300     -3.0800000E-02
 C   0.7417000     -0.9209000      0.2644000    
 C    1.983100     -0.3410000      0.1033000    
 C    2.128800       1.007000     -0.1174000    
 C   -1.678600     -0.6044000      0.3507000    
 C    1.041400       1.854200     -0.1896000    
 C   -1.389000       2.106200     -9.2500001E-02
 C   -4.075100     -0.3717000      0.4488000    
 C   -2.636900       1.521700      6.9700003E-02
 C    4.092900      0.1000000     -8.5000001E-02
 C   -4.614300     -0.7929000     -0.9037000    
 C   0.5271000      -3.097600     -0.6691000    
 H   -1.883600      -1.653900      0.5275000    
 H    1.184200       2.916400     -0.3650000    
 H   -1.319000       3.176500     -0.2662000    
 H   -4.008500      -1.225200       1.132600    
 H   -4.726000      0.3731000      0.9201000    
 H   -3.552800       2.099100      2.5699999E-02
 H    4.677300     -0.1111000     -0.9879000    
 H    4.776300      0.1659000      0.7695000    
 H   -4.685400      6.1200000E-02  -1.585000    
 H   -5.612700      -1.227400     -0.7959000    
 H   -3.965700      -1.539700      -1.372900    
 H    1.435600      -3.038700      -1.276700    
 H  -0.3437000      -2.818700      -1.270500    
 H   0.4009000      -4.129000     -0.3288000    


%chk=000027151-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000027151

1 1
O 3.115251 -1.073052 -0.371380
O 3.379578 1.302723 -0.389876
O 0.278054 -2.360801 -0.070153
N -2.900616 0.211232 0.298924
C -0.513577 -0.102908 0.028000
C -0.314290 1.343020 0.012332
C 0.606000 -1.022101 -0.097587
C 1.866182 -0.437517 -0.230845
C 2.033864 0.984077 -0.243031
C -1.820452 -0.612212 0.171489
C 0.989491 1.894693 -0.126345
C -1.485377 2.160144 0.146555
C -4.287144 -0.365779 0.396392
C -2.742379 1.594979 0.283601
C 4.130673 0.016352 -0.464324
C -4.993764 -0.396588 -0.970717
C 1.342264 -3.395583 -0.179627
H -1.998692 -1.688908 0.186569
H 1.163873 2.972080 -0.140092
H -1.394587 3.249278 0.145534
H -4.194085 -1.380307 0.818179
H -4.848818 0.247753 1.121533
H -3.651763 2.187959 0.391504
H 4.638560 -0.044548 -1.439163
H 4.812574 -0.048863 0.397908
H -5.102783 0.615235 -1.397830
H -6.004946 -0.820708 -0.846598
H -4.447099 -1.024932 -1.694545
H 2.046535 -3.310472 0.663342
H 1.875647 -3.296978 -1.138391
H 0.798625 -4.348767 -0.134859


