%chk=000125544.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000125544

0 1
 O   -3.144000      0.3505000     -0.8819000    
 O   -4.579100      -2.277800     -0.1311000    
 O   -4.942000       2.454200     -0.4850000    
 O    5.456000       1.203000     -0.9749000    
 N  -0.9275000      0.1065000     -7.1999997E-02
 N    2.873700      -1.009100     -0.1182000    
 N   0.5228000       1.753000      0.3595000    
 N   0.5828000      -1.755500     -0.4201000    
 N    3.406900       1.332200      0.3682000    
 C   -2.208300     -0.5596000     -0.2781000    
 C   -2.858900      -1.074500      0.9978000    
 C   -4.320100      -1.087700      0.6107000    
 C   -4.448100      0.1239000     -0.3066000    
 C   0.3135000     -0.4551000     -0.1402000    
 C   -4.859600       1.384800      0.4408000    
 C    1.186800      0.5811000      0.1312000    
 C    2.612600      0.3462000      0.1393000    
 C  -0.7496000       1.433500      0.2312000    
 C    4.278100      -1.427200     -0.1192000    
 C    5.089500     -0.4584000      0.7415000    
 C    4.841900      0.9913000      0.2990000    
 C    1.872600      -1.955300     -0.3918000    
 H   -2.045600      -1.372500     -0.9960000    
 H   -2.698400     -0.3750000       1.826800    
 H   -2.460700      -2.051700       1.287800    
 H   -5.004300      -1.067200       1.463800    
 H   -5.135200     -5.9900001E-02  -1.140300    
 H   -4.119900       1.658400       1.200000    
 H   -5.836400       1.256400      0.9172000    
 H   -1.577800       2.118800      0.3510000    
 H    4.651700      -1.435800      -1.149500    
 H    4.382000      -2.440900      0.2844000    
 H    4.799300     -0.5746000       1.793500    
 H    6.153200     -0.7077000      0.6551000    
 H   -4.441500      -3.030700      0.4689000    
 H    5.365400       1.646700       1.004000    
 H    2.274200      -2.961300     -0.5973000    
 H   -5.206700       3.245700      1.4000000E-02
 H    5.174000       2.084000      -1.273900    


%chk=000125544-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000125544

0 1
O -3.436740 0.123210 -1.181066
O -5.186602 -2.086360 -0.100321
O -4.146520 2.591988 0.081557
O 5.469749 1.181900 -0.755858
N -1.126090 0.050239 -0.575327
N 2.749837 -0.933645 0.067723
N 0.256710 1.862796 -0.366056
N 0.507250 -1.787029 -0.260955
N 3.279523 1.465145 0.225380
C -2.350657 -0.766216 -0.799633
C -2.802283 -1.524746 0.483693
C -4.304921 -1.169778 0.633909
C -4.421161 0.195883 -0.071111
C 0.153693 -0.450273 -0.348633
C -4.147056 1.366585 0.885769
C 0.995781 0.680833 -0.218504
C 2.414729 0.489392 0.036443
C -1.010949 1.449983 -0.587360
C 4.195548 -1.285953 0.175248
C 4.913658 -0.272469 1.078284
C 4.685951 1.135632 0.502474
C 1.812838 -1.951587 -0.062043
H -2.151117 -1.443850 -1.646161
H -2.225248 -1.168700 1.354272
H -2.631323 -2.609128 0.387727
H -4.604935 -1.119778 1.701664
H -5.402831 0.319404 -0.554666
H -3.173962 1.233427 1.406623
H -4.957781 1.386437 1.646292
H -1.874416 2.086314 -0.773792
H 4.647925 -1.242026 -0.832867
H 4.277899 -2.315535 0.563955
H 4.519822 -0.316044 2.110399
H 5.994496 -0.491863 1.102742
H -5.031219 -3.012529 0.214559
H 5.069790 1.911106 1.192488
H 2.208994 -2.970459 0.004421
H -4.011150 3.375439 0.671667
H 5.116069 1.944953 -1.283335


