%chk=000002252.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000002252

0 1
 O    2.579100       1.002200      0.3298000    
 O  -0.2976000       2.857700     -0.2814000    
 O   -4.044900     -0.8062000      0.8746000    
 O   -3.612300     -0.5686000      -1.355200    
 N    1.880800       2.225500      0.2639000    
 N   -1.555200     -0.2065000       1.596700    
 C    2.058500      -1.362400     -6.7900002E-02
 C    1.613000      7.5400002E-02 -3.9999999E-02
 C   0.4101000      0.5780000     -0.3242000    
 C  -0.8636000     -4.1400000E-02 -0.7486000    
 C    1.880000      -1.915500      -1.487800    
 C    1.211700      -2.182600      0.9157000    
 C    3.536500      -1.451100      0.3385000    
 C   -2.016700      0.2185000      0.2346000    
 C   0.5784000       2.024100     -0.1234000    
 C   -3.357800     -0.4471000     -0.1252000    
 H  -0.7828000      -1.118100     -0.9030000    
 H   -1.133600      0.3689000      -1.730400    
 H   -2.219500       1.291600      0.3229000    
 H    2.406700      -1.296200      -2.224200    
 H    2.300700      -2.926100      -1.559000    
 H   0.8397000      -1.994500      -1.808700    
 H   0.1869000      -2.339200      0.5724000    
 H    1.176000      -1.713700       1.906000    
 H    1.641200      -3.183300       1.048300    
 H    3.704500      -1.078700       1.356300    
 H    4.184300     -0.8886000     -0.3449000    
 H    3.882700      -2.491600      0.3189000    
 H    2.361000       3.087000      0.4900000    
 H  -0.7142000      0.2952000       1.910200    
 H   -1.356800      -1.214300       1.633500    
 H   -2.284500     -2.0800000E-02   2.298700    


%chk=000002252-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000002252

0 1
O 2.730194 0.872008 0.301233
O -0.234025 2.564525 1.344146
O -4.371381 -0.120543 -0.236586
O -2.856512 -1.642058 -1.142035
N 1.985243 2.001525 0.784583
N -2.729185 1.137237 1.189351
C 2.311956 -1.494419 -0.313397
C 1.759244 -0.167285 0.193541
C 0.509997 0.283058 0.573333
C -0.787239 -0.492239 0.615711
C 1.677257 -1.813313 -1.702930
C 1.963255 -2.620175 0.706037
C 3.857004 -1.424050 -0.470602
C -2.028735 0.316093 0.157923
C 0.628319 1.710594 0.953316
C -3.110746 -0.614039 -0.478496
H -0.977044 -0.870011 1.642231
H -0.723736 -1.379187 -0.036558
H -1.729074 1.011845 -0.649324
H 1.919461 -1.023605 -2.436444
H 2.084632 -2.769339 -2.079552
H 0.579156 -1.911584 -1.653036
H 0.874742 -2.742199 0.835113
H 2.409144 -2.410128 1.694946
H 2.370093 -3.580570 0.340980
H 4.355036 -1.202786 0.489478
H 4.159223 -0.652640 -1.199650
H 4.221559 -2.401890 -0.832171
H 2.518008 2.865194 0.873664
H -2.213025 2.020263 1.341422
H -2.795646 0.633837 2.087513
H -4.164876 0.693481 0.393362


