%chk=000126894.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000126894

0 1
 O  -0.5906000      0.4031000     -7.3100001E-02
 O   -1.564100     -0.7395000       1.670300    
 O    2.129900      -3.371100     -0.9577000    
 O    2.621400      -2.180300      0.9270000    
 N    1.771500       2.013800     -7.3100001E-02
 C    1.739400      0.6213000     -0.5862000    
 C   0.6850000     -0.2086000      0.1442000    
 C    2.818200       2.847500     -0.8251000    
 C   0.4054000       2.690900     -0.2495000    
 C    2.126300       2.036400       1.419900    
 C   0.6403000      -1.671600     -0.3004000    
 C   -2.937900      1.0700000E-02 -0.2066000    
 C   -1.641100     -0.1662000      0.5903000    
 C   -4.100200     -0.6502000      0.5521000    
 C   -3.238000       1.506500     -0.3722000    
 C   -2.792000     -0.6614000      -1.578300    
 C    1.926500      -2.481200     -8.1500001E-02
 H    2.742500      0.1971000     -0.4669000    
 H    1.512000      0.6736000      -1.658500    
 H   0.8908000     -0.2098000       1.219700    
 H    2.830800       3.859600     -0.4100000    
 H    3.792600       2.368300     -0.6926000    
 H    2.539600       2.867800      -1.882700    
 H  -0.2525000       2.462700      0.5920000    
 H   0.5716000       3.774200     -0.2182000    
 H  -2.2000000E-03   2.437200      -1.232300    
 H    1.295300       1.645600       2.011300    
 H    3.033400       1.443400       1.567600    
 H    2.305000       3.077000       1.709300    
 H  -0.1507000      -2.225500      0.2175000    
 H   0.3706000      -1.708400      -1.364600    
 H   -3.918700      -1.720900      0.7018000    
 H   -5.044000     -0.5444000      5.5000000E-03
 H   -4.235000     -0.2000000       1.542500    
 H   -2.481700       2.004500     -0.9880000    
 H   -4.208800       1.664800     -0.8551000    
 H   -3.255400       2.015200      0.5984000    
 H   -2.528000      -1.719900      -1.472000    
 H   -3.724400     -0.6011000      -2.150600    
 H   -2.005500     -0.1896000      -2.178200    


%chk=000126894-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000126894

0 1
O -0.868645 -0.411986 -0.828944
O -1.377115 0.877334 1.029946
O 3.587826 -2.143093 -1.787524
O 3.257228 -0.529137 -0.129282
N 1.700619 1.945178 0.481908
C 1.094990 1.132952 -0.726359
C 0.617103 -0.320398 -0.485591
C 3.120756 2.371413 0.094697
C 0.838767 3.176545 0.734359
C 1.798101 1.144063 1.782389
C 1.326499 -1.325720 -1.392969
C -3.225615 -0.100150 -0.331460
C -1.762189 0.191037 0.042021
C -4.157649 0.757955 0.555869
C -3.459516 0.218818 -1.835419
C -3.482829 -1.617040 -0.074538
C 2.871478 -1.355518 -1.089914
H 1.884637 1.117249 -1.489400
H 0.248852 1.739522 -1.091957
H 0.712779 -0.621408 0.566390
H 3.550872 2.954815 0.925175
H 3.682125 1.434640 -0.084842
H 3.069262 2.991795 -0.814827
H -0.171318 2.837076 1.008771
H 1.284687 3.759835 1.555788
H 0.808172 3.790158 -0.180351
H 0.780673 0.890787 2.112559
H 2.411764 0.255039 1.550918
H 2.292921 1.788588 2.527912
H 0.915571 -2.338233 -1.234381
H 1.172998 -1.080816 -2.460731
H -3.983188 0.561107 1.627313
H -5.211075 0.521979 0.320425
H -3.996487 1.836821 0.381746
H -2.797718 -0.384939 -2.477752
H -4.509205 -0.007057 -2.097547
H -3.278670 1.288057 -2.052505
H -3.317638 -1.877779 0.986914
H -4.532170 -1.856374 -0.325338
H -2.820352 -2.241612 -0.697467


