%chk=000037405.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000037405

0 1
 O    2.400800      -2.056900      -1.063600    
 O  -0.1768000      0.5918000       1.833000    
 O    3.523300       2.319300     -0.2601000    
 N    2.902300      0.1578000     -0.7377000    
 N    1.615100       1.480700      0.7098000    
 C   0.6950000     -0.6631000     -4.9899999E-02
 C  -0.2277000     -0.2801000      -1.220800    
 C   0.1546000      -1.930600      0.6282000    
 C    2.071900     -0.9487000     -0.6411000    
 C   0.6650000      0.4969000      0.9402000    
 C   -1.615800      2.2000000E-02 -0.7408000    
 C    1.056300      -2.368000       1.762200    
 C    2.726400       1.390000     -0.1197000    
 C   -2.555900      -1.000000     -0.6624000    
 C   -1.952300       1.321900     -0.3781000    
 C   -3.847400     -0.7189000     -0.2164000    
 C   -3.243600       1.603000      6.8099998E-02
 C   -4.191200      0.5826000      0.1489000    
 H  -0.2598000      -1.084000      -1.969500    
 H   0.1648000      0.5919000      -1.762800    
 H   6.2300000E-02  -2.754500     -9.0400003E-02
 H  -0.8321000      -1.778800       1.076000    
 H    2.060800      -2.637800       1.424500    
 H    1.153500      -1.604600       2.539700    
 H   0.6347000      -3.258900       2.241300    
 H    3.770800      3.0500000E-02  -1.249700    
 H    1.534300       2.328500       1.264300    
 H   -2.308200      -2.016100     -0.9566000    
 H   -1.231700       2.131900     -0.4508000    
 H   -4.586200      -1.512700     -0.1566000    
 H   -3.512500       2.617200      0.3489000    
 H   -5.197100      0.8018000      0.4948000    


%chk=000037405-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000037405

0 1
O 2.266605 -2.022633 -1.309181
O 0.032263 0.703852 1.971483
O 3.805042 2.235439 -0.257356
N 2.970456 0.118942 -0.799214
N 1.825556 1.491114 0.743929
C 0.727541 -0.645908 0.030870
C -0.284847 -0.223348 -1.146781
C 0.226837 -1.920809 0.762061
C 2.041179 -0.936811 -0.716299
C 0.822165 0.529796 1.011138
C -1.716733 0.047729 -0.723389
C 1.189483 -2.437595 1.851741
C 2.923462 1.351485 -0.121738
C -2.680548 -0.994328 -0.726386
C -2.131557 1.353421 -0.354834
C -4.020792 -0.740833 -0.360657
C -3.469918 1.611127 0.011900
C -4.419333 0.563552 0.012248
H -0.248717 -1.063874 -1.864092
H 0.136460 0.665761 -1.653669
H 0.075693 -2.705383 -0.001620
H -0.752805 -1.684352 1.210472
H 2.170908 -2.718258 1.428797
H 1.342738 -1.684710 2.645486
H 0.767098 -3.338611 2.330469
H 3.798448 -0.034501 -1.384143
H 1.826263 2.333132 1.329080
H -2.381380 -2.005826 -1.027187
H -1.404079 2.174686 -0.358057
H -4.752694 -1.556054 -0.371677
H -3.772225 2.625398 0.294610
H -5.458968 0.762500 0.294897


