%chk=000026072.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000026072

0 1
 O   -6.382100     -0.5932000      0.4107000    
 O   1.8500000E-02  -1.207900      -2.130000    
 O    2.597500       2.098700       1.739900    
 N   -3.738700      -1.442300     -0.2165000    
 N    2.214500      9.0300001E-02 -0.8489000    
 C   -2.516100      -1.389600      -1.015200    
 C    1.253400     -0.7456000     -9.7199999E-02
 C   -1.316400      -1.073900     -0.1273000    
 C   -4.887800      -1.830600      -1.046200    
 C   -3.997600     -0.1470000      0.4274000    
 C  -9.8000001E-03  -1.021700     -0.9134000    
 C   -6.153400      -1.866400     -0.1944000    
 C   -5.283800     -0.2234000       1.245100    
 C    1.927500      -1.976900      0.4814000    
 C    2.562000       1.353100     -0.5153000    
 C    2.853200     -0.3290000      -1.964700    
 C    3.471600       1.776200      -1.459200    
 C    1.823000      -3.178200     -0.1931000    
 C    2.627100      -1.863400       1.667500    
 C    3.656000      0.7119000      -2.376100    
 C    2.066900       2.087100      0.6093000    
 C    2.442100      -4.309300      0.3389000    
 C    3.246200      -2.994500       2.199400    
 C   0.8404000       2.941500      0.5033000    
 C    3.153700      -4.217400       1.535200    
 C   0.1837000       2.994700     -0.7017000    
 C   0.4276000       3.632700       1.615800    
 C  -0.9580000       3.789800     -0.8005000    
 C  -0.7143000       4.427700       1.516900    
 C   -1.407100       4.506200      0.3088000    
 H   -2.597000     -0.6467000      -1.820100    
 H   -2.348700      -2.362100      -1.495800    
 H   0.9146000     -0.1350000      0.7494000    
 H   -1.397500     -8.5500002E-02  0.3337000    
 H   -1.211900      -1.830000      0.6589000    
 H   -4.724900      -2.822900      -1.482000    
 H   -5.022100      -1.115500      -1.868400    
 H   -4.086700      0.6466000     -0.3257000    
 H   -3.212500      0.1322000       1.134500    
 H   -6.095500      -2.636700      0.5843000    
 H   -7.019600      -2.096000     -0.8233000    
 H   -5.510500      0.7570000       1.676600    
 H   -5.196300     -0.9376000       2.073000    
 H    2.711100      -1.312200      -2.392300    
 H    3.952200       2.744600      -1.488000    
 H    1.286400      -3.280000      -1.130100    
 H    2.705100     -0.9158000       2.191900    
 H    4.303200      0.7041000      -3.241800    
 H    2.372600      -5.261300     -0.1793000    
 H    3.800500      -2.922900       3.130600    
 H    3.636400      -5.098000       1.949000    
 H   0.4984000       2.451300      -1.585400    
 H   0.9452000       3.591100       2.568600    
 H   -1.498700       3.850200      -1.740600    
 H   -1.064600       4.985500       2.380500    
 H   -2.296500       5.124700      0.2320000    


%chk=000026072-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000026072

0 1
O -6.851985 -2.473914 0.516836
O -0.355976 -1.311721 -2.252392
O 0.950103 1.769630 1.482540
N -4.033568 -2.298540 -0.194669
N 1.692909 0.209276 -0.929636
C -2.859764 -1.980241 -1.043706
C 0.752542 -0.640109 -0.158390
C -1.745797 -1.290665 -0.237604
C -4.939835 -3.283967 -0.843864
C -4.806045 -1.094847 0.212802
C -0.452399 -1.099804 -1.015345
C -6.079039 -3.661771 0.115990
C -5.953187 -1.497658 1.153796
C 1.452544 -1.846183 0.489593
C 1.920584 1.595897 -0.720371
C 2.416873 -0.206293 -2.031890
C 2.831977 2.012716 -1.728792
C 1.594271 -3.086793 -0.181231
C 1.986946 -1.694836 1.794696
C 3.143180 0.888087 -2.540510
C 1.408589 2.348645 0.425557
C 2.266573 -4.160906 0.444645
C 2.660101 -2.768117 2.416910
C 1.436618 3.852505 0.383062
C 2.802119 -4.004351 1.743411
C 1.250802 4.597025 -0.813035
C 1.570546 4.546125 1.616156
C 1.220181 6.008598 -0.774771
C 1.553643 5.954547 1.650543
C 1.380405 6.691077 0.453262
H -3.130212 -1.350364 -1.926215
H -2.463816 -2.930068 -1.448572
H 0.384762 0.001511 0.661051
H -2.059686 -0.285681 0.115004
H -1.534442 -1.871627 0.682531
H -4.358125 -4.189933 -1.099703
H -5.380653 -2.877562 -1.789152
H -5.227722 -0.563804 -0.678642
H -4.142611 -0.389381 0.746399
H -5.656161 -4.154771 1.017923
H -6.803721 -4.335136 -0.370938
H -6.587479 -0.630334 1.400772
H -5.530575 -1.930626 2.086165
H 2.357823 -1.230295 -2.389184
H 3.257005 3.011333 -1.808145
H 1.175662 -3.219308 -1.186056
H 1.877745 -0.731574 2.306608
H 3.819019 0.859119 -3.392871
H 2.370536 -5.117616 -0.079276
H 3.072078 -2.642237 3.424331
H 3.322487 -4.838100 2.227886
H 1.093816 4.073292 -1.761407
H 1.679958 3.958042 2.533236
H 1.062337 6.574173 -1.699752
H 1.670500 6.479822 2.604852
H 1.360062 7.786411 0.479662


