%chk=000024253.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000024253

0 1
 O   -2.490100     -0.7909000     -0.1401000    
 O   -4.050300       1.624900     -9.5100001E-02
 O    4.223300     -0.1531000      0.7147000    
 N  -0.3741000       2.087700     -5.8200002E-02
 C   -2.743900       1.554600      0.4832000    
 C   -1.742200       2.073100     -0.5573000    
 C   -2.498200      0.1124000      0.9629000    
 C   0.5429000       2.603300      -1.065800    
 C    1.974000       2.601400     -0.5316000    
 C    2.425400       1.188300     -0.1664000    
 C   -3.571500     -0.3649000       1.935400    
 C    3.836400       1.179600      0.4070000    
 C   -1.344600      -1.515000     -0.3318000    
 C  -0.8860000      -2.373100      0.6679000    
 C  -0.6353000      -1.394600      -1.526900    
 C   0.2818000      -3.110400      0.4726000    
 C   0.5325000      -2.132000      -1.722200    
 C    5.528900     -0.2012000       1.274100    
 C   0.9910000      -2.990000     -0.7223000    
 H   -2.747100       2.226700       1.349700    
 H   -1.816200       1.469700      -1.470000    
 H   -2.047700       3.087100     -0.8483000    
 H   -1.536300      9.9900000E-02   1.493600    
 H   0.4968000       1.989800      -1.973800    
 H   0.2713000       3.629400      -1.341000    
 H    2.641900       3.016500      -1.295900    
 H    2.045900       3.256100      0.3459000    
 H  -0.3201000       2.657700      0.7852000    
 H    2.390100      0.5397000      -1.050700    
 H    1.753600      0.7291000      0.5688000    
 H   -3.340400      -1.365100       2.314900    
 H   -3.659800      0.3127000       2.790200    
 H   -4.548500     -0.4416000       1.445700    
 H    3.870900       1.788600       1.318100    
 H    4.538000       1.601100     -0.3226000    
 H   -4.075500       1.003800     -0.8432000    
 H   -1.428100      -2.489200       1.601200    
 H  -0.9873000     -0.7307000      -2.311400    
 H   0.6381000      -3.779800       1.250100    
 H    1.085200      -2.037600      -2.652300    
 H    6.264500      0.1926000      0.5662000    
 H    5.566300      0.3636000       2.210600    
 H    5.773700      -1.245300       1.486800    
 H    1.900600      -3.563700     -0.8743000    


%chk=000024253-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000024253

0 1
O -2.172603 -0.540483 -0.440163
O -3.973426 1.446144 0.026838
O 3.813546 0.066669 1.592925
N -0.420636 2.735865 -0.060061
C -2.586145 1.624945 0.475880
C -1.768421 2.417469 -0.576061
C -1.926850 0.264820 0.794734
C 0.667904 2.896044 -1.049603
C 2.058586 2.830113 -0.377287
C 2.330249 1.464430 0.291175
C -2.525717 -0.447838 2.011617
C 3.701726 1.390138 0.964737
C -1.315528 -1.607228 -0.764312
C -0.135456 -1.935643 -0.050929
C -1.692620 -2.361036 -1.904155
C 0.662676 -3.015551 -0.494355
C -0.887734 -3.436385 -2.330961
C 5.103176 -0.126477 2.249560
C 0.296765 -3.771504 -1.629993
H -2.664130 2.210119 1.411350
H -1.652412 1.781373 -1.474004
H -2.366970 3.306544 -0.876329
H -0.842228 0.448492 0.906824
H 0.581274 2.064184 -1.775575
H 0.588588 3.844245 -1.635859
H 2.827947 3.038620 -1.148858
H 2.142052 3.643112 0.375537
H -0.433643 3.505142 0.622683
H 2.259391 0.656644 -0.463222
H 1.546585 1.268776 1.045131
H -2.129243 -1.473488 2.110395
H -2.277164 0.105061 2.936573
H -3.624632 -0.499103 1.922145
H 3.807160 2.186765 1.738094
H 4.520469 1.526674 0.220287
H -3.957330 0.716066 -0.647406
H 0.177189 -1.369850 0.831192
H -2.610464 -2.090340 -2.435979
H 1.577725 -3.257620 0.057489
H -1.186626 -4.013840 -3.213182
H 5.945221 -0.052876 1.527283
H 5.266381 0.617470 3.059639
H 5.084405 -1.138653 2.684165
H 0.920865 -4.606808 -1.964357


