%chk=000130185.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000130185

0 1
 O   0.8924000      -1.259800      0.5882000    
 O    1.675500       2.907100      -1.361200    
 O    5.234400      0.3504000      0.1891000    
 O   -2.233200      0.5132000      -2.219300    
 O   9.9999998E-03  0.8839000       1.846600    
 O   -4.623500      0.2368000       1.792700    
 O    3.566000      -2.348100      -1.291900    
 O    4.293000      -3.867700      0.2279000    
 O   -4.152500      -2.097000     -0.7337000    
 O   -6.079400      -1.586100      -1.817100    
 N    3.075000     -0.4580000      0.4531000    
 N    3.476000       1.675300     -0.5450000    
 N   1.1100000E-02  0.8534000     -0.8378000    
 N   -3.482200      0.3827000     -0.2265000    
 N   -2.324500      0.5667000       1.872500    
 C    1.189400       1.030000      1.6600000E-02
 C    1.684500     -0.3426000      0.3617000    
 C    2.116300       1.955300     -0.7134000    
 C    4.016500      0.5161000      5.4000001E-02
 C   -1.088800      0.7078000     -0.1993000    
 C    3.602200      -1.699500       1.012800    
 C   -2.330200      0.5246000      -1.000300    
 C   -1.068000      0.7306000       1.290000    
 C   -3.553800      0.3856000       1.189600    
 C    4.440700       2.632000      -1.080700    
 C   -4.739900      0.2145000     -0.9467000    
 C   -2.393700      0.5759000       3.329800    
 C    3.859100      -2.752600     -3.4200002E-02
 C   -5.072300      -1.230200      -1.217600    
 H    1.176100       1.762100      0.8320000    
 H    2.884000      -2.109900       1.730700    
 H    4.545500      -1.503000       1.532300    
 H    3.963700       3.547600      -1.438600    
 H    4.977800       2.156100      -1.907400    
 H    5.164900       2.887400     -0.3005000    
 H   -4.677800      0.7274000      -1.912400    
 H   -5.562200      0.6489000     -0.3690000    
 H   -2.805400     -0.3803000       3.668500    
 H   -3.072300       1.374500       3.646300    
 H   -1.414800      0.7305000       3.790300    
 H    3.742100      -3.050200      -1.954000    
 H   -4.391700      -3.029600     -0.9220000    


%chk=000130185-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000130185

0 1
O 0.977224 -1.035621 0.846857
O 1.956086 3.107785 -1.381654
O 5.371772 0.235730 -0.021344
O -2.257766 0.929745 -2.131569
O -0.359403 1.385269 2.311615
O -4.691867 -0.198500 1.676430
O 3.149103 -2.327652 -1.346482
O 3.518682 -4.023873 0.206077
O -3.763127 -2.182896 -0.832432
O -5.877215 -1.921803 -1.772385
N 3.169442 -0.366783 0.479828
N 3.678510 1.701592 -0.666085
N 0.053010 1.196258 -0.619011
N -3.472020 0.404588 -0.216183
N -2.502084 0.540381 1.992451
C 1.333161 1.277897 0.095635
C 1.786419 -0.146643 0.485460
C 2.318944 2.092777 -0.743910
C 4.147996 0.518333 -0.064265
C -1.069814 0.990029 0.009129
C 3.641194 -1.685870 0.940681
C -2.280771 0.792346 -0.887334
C -1.259826 0.985550 1.515891
C -3.614428 0.210035 1.175874
C 4.708191 2.559867 -1.307220
C -4.647604 0.069454 -1.039859
C -2.712256 0.419976 3.458245
C 3.425110 -2.812757 -0.069082
C -4.856766 -1.429123 -1.255407
H 1.224667 1.795394 1.079735
H 3.118692 -1.966350 1.868203
H 4.723257 -1.605369 1.140215
H 4.195752 3.449223 -1.700073
H 5.198920 2.012283 -2.127609
H 5.471009 2.842565 -0.565174
H -4.505553 0.540283 -2.027740
H -5.562556 0.468112 -0.575259
H -3.099077 -0.584088 3.688701
H -3.445360 1.168657 3.800299
H -1.744320 0.591011 3.948725
H 3.021073 -3.087309 -1.976146
H -3.936403 -3.148703 -0.997730


