%chk=000148397.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000148397

0 1
 O   9.3000000E-03  -1.999400     -0.6144000    
 O   -1.030200       2.666200     -0.4117000    
 O   -2.675200     -0.1954000      0.2738000    
 O    3.374600       1.195700      0.6010000    
 O    3.826300      -1.195800      0.4761000    
 O    2.279300      -2.657000     -8.0399998E-02
 O   -4.591700     -0.5772000     -0.9585000    
 N    2.655600      -1.482900      0.1379000    
 C  -0.5285000      0.3237000     -0.5184000    
 C   0.3964000     -0.7113000     -0.3798000    
 C  -0.1404000       1.642400     -0.2815000    
 C    1.709500     -0.4275000     -4.1999999E-03
 C   -1.936700      2.2000000E-02 -0.9209000    
 C    2.097600      0.8913000      0.2327000    
 C    1.172500       1.926100      9.3999997E-02
 C  -0.4970000      -2.733400      0.4970000    
 C   -1.775500       3.028100      0.7489000    
 C    4.303200       1.464800     -0.4468000    
 C   -4.001000     -0.4885000      0.1094000    
 C   -4.648100     -0.6918000       1.445800    
 H   -2.373300      0.8525000      -1.489000    
 H   -1.986600     -0.8642000      -1.565100    
 H    1.474800       2.954100      0.2788000    
 H   -1.586200      -2.645500      0.5289000    
 H  -7.5300001E-02  -2.393500       1.449400    
 H  -0.2464000      -3.789000      0.3578000    
 H   -2.144300       2.152200       1.289900    
 H   -2.631500       3.630300      0.4324000    
 H   -1.149600       3.632100       1.413100    
 H    5.315400       1.354300     -4.7899999E-02
 H    4.175400       2.496000     -0.7903000    
 H    4.180100      0.7817000      -1.294000    
 H   -4.567500      0.2227000       2.038700    
 H   -4.173300      -1.529400       1.963000    
 H   -5.707500     -0.9241000       1.304700    


%chk=000148397-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000148397

0 1
O 0.044102 -2.061893 -0.522056
O -0.926149 2.740514 -0.428213
O -2.777434 -0.204154 0.376950
O 3.555283 1.138063 0.554145
O 3.815951 -1.481079 -0.623899
O 2.521992 -2.503655 0.950879
O -4.574497 -0.603104 -1.056555
N 2.767486 -1.546176 0.123095
C -0.513723 0.315278 -0.399562
C 0.424839 -0.741832 -0.248712
C -0.049245 1.653100 -0.238997
C 1.787586 -0.449080 0.020617
C -1.917483 0.026745 -0.848887
C 2.235120 0.890669 0.161374
C 1.303494 1.940916 0.035598
C -0.576193 -2.813177 0.603826
C -1.830091 3.032347 0.710843
C 4.454651 1.684394 -0.489437
C -4.118560 -0.528593 0.105092
C -4.887135 -0.773881 1.386363
H -2.345316 0.876702 -1.404997
H -1.963220 -0.885457 -1.465572
H 1.619067 2.978748 0.171397
H -1.451455 -2.263263 0.994214
H 0.178315 -2.973354 1.392154
H -0.884268 -3.773864 0.166054
H -2.416240 2.138543 0.991469
H -2.494437 3.834606 0.357237
H -1.241802 3.383023 1.580225
H 5.391489 1.923636 0.033981
H 4.027273 2.599432 -0.941727
H 4.630685 0.914168 -1.260523
H -4.282784 -0.534604 2.273204
H -5.193445 -1.834301 1.428685
H -5.809655 -0.169120 1.382136


