%chk=000003785.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000003785

0 1
 O   0.3173000       2.182900     -0.9141000    
 O   6.8899997E-02  -2.468500     -0.6260000    
 O    5.526600      -1.306900      0.8578000    
 O    6.511000       1.127500       1.505900    
 N   0.2319000     -0.1510000     -0.8489000    
 N    5.535000      0.9772000      0.5119000    
 C   -2.409100      4.8900001E-02  6.6799998E-02
 C    1.587900     -0.2578000      -1.376900    
 C   -1.699700       1.222600     -0.2240000    
 C   -1.832100      -1.221200     -7.0100002E-02
 C    2.643700     -0.2256000     -0.2774000    
 C  -0.2987000       1.142400     -0.6941000    
 C  -0.4346000      -1.350500     -0.5376000    
 C   -3.750000      0.1496000      0.5157000    
 C    4.065300     -0.3597000     -0.8236000    
 C   -2.302300       2.478300     -7.5000003E-02
 C   -2.564600      -2.376400      0.2306000    
 C   -4.339500       1.414700      0.6589000    
 C   -4.470700      -1.017000      0.8120000    
 C   -3.619300       2.570500      0.3654000    
 C   -3.880900      -2.271000      0.6700000    
 C    5.114000     -0.3090000      0.2727000    
 H    1.680500      -1.188800      -1.948800    
 H    1.765200      0.5650000      -2.079800    
 H    2.455600      -1.031400      0.4436000    
 H    2.556700      0.7085000      0.2920000    
 H    4.180500      -1.314600      -1.350000    
 H    4.265100      0.4310000      -1.557100    
 H   -1.763200       3.395200     -0.2975000    
 H   -2.128200      -3.366300      0.1278000    
 H   -5.367500       1.511500       1.002000    
 H   -5.500900     -0.9593000       1.157600    
 H   -4.086400       3.544300      0.4804000    
 H   -4.449100      -3.167100      0.9027000    
 H    5.123000       1.824800      0.1388000    
 H    7.314200       1.137600      0.9580000    


%chk=000003785-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000003785

0 1
O 0.315556 2.163355 -1.057809
O 0.109954 -2.493098 -0.755332
O 5.083283 -0.764184 1.350791
O 7.069017 0.981949 1.208803
N 0.189268 -0.162254 -0.908726
N 6.089889 0.892513 0.158075
C -2.481568 0.017117 0.071790
C 1.588451 -0.246590 -1.405994
C -1.764452 1.213255 -0.251176
C -1.871802 -1.267961 -0.088948
C 2.612503 -0.069000 -0.264350
C -0.368847 1.138149 -0.759695
C -0.477869 -1.382525 -0.595709
C -3.834943 0.108293 0.565793
C 4.057073 -0.101458 -0.817973
C -2.373003 2.467230 -0.087035
C -2.585637 -2.432857 0.232477
C -4.427494 1.404027 0.720605
C -4.536650 -1.100460 0.882879
C -3.708118 2.561616 0.399952
C -3.921605 -2.347493 0.718761
C 5.083120 -0.029010 0.300536
H 1.705258 -1.237033 -1.876115
H 1.716444 0.548991 -2.159907
H 2.497954 -0.875805 0.480574
H 2.430848 0.894858 0.244751
H 4.219652 -1.052719 -1.362421
H 4.211414 0.722617 -1.542649
H -1.797051 3.362968 -0.341387
H -2.090351 -3.400314 0.100428
H -5.455047 1.476576 1.095652
H -5.564863 -1.035361 1.257600
H -4.169353 3.546669 0.522777
H -4.465692 -3.264875 0.964768
H 6.233816 1.592375 -0.566859
H 6.726446 0.260838 1.834776


