%chk=000133069.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000133069

0 1
 O  -0.4583000      0.6668000      0.8722000    
 O   1.8300001E-02   2.520700     -0.4084000    
 O    2.747300       2.300700      -1.284800    
 N   -3.056900     -0.3470000      -1.277600    
 C   -2.643200     -0.2911000       1.287200    
 C   -1.841600      0.8119000      0.5728000    
 C   -2.246500      -1.653200      0.6915000    
 C   -4.126600     -6.1000001E-02  0.9653000    
 C   -2.074700      0.7108000     -0.9453000    
 C   -2.521200      -1.647700     -0.8207000    
 C   -4.321700     -7.3299997E-02 -0.5600000    
 C   0.3770000       1.598200      0.3125000    
 C    1.819800       1.309500      0.7171000    
 C    2.227300     -9.9699996E-02  0.3171000    
 C    2.760200       2.375800      0.1376000    
 C    3.166900     -0.7653000       1.078900    
 C    1.646000     -0.6732000     -0.7962000    
 C    3.540800      -2.058200      0.7122000    
 C    2.019900      -1.966000      -1.162800    
 C    2.967300      -2.658600     -0.4086000    
 H   -2.457000     -0.2832000       2.366200    
 H   -2.177100       1.789100      0.9455000    
 H   -2.822400      -2.453700       1.171300    
 H   -1.187000      -1.861600      0.8805000    
 H   -4.459700      0.8986000       1.377900    
 H   -4.738600     -0.8445000       1.427900    
 H   -2.457500       1.669300      -1.319400    
 H   -1.161700      0.5170000      -1.515000    
 H   -1.600200      -1.882700      -1.368800    
 H   -3.226300      -2.448700      -1.076200    
 H   -5.072400     -0.8253000     -0.8338000    
 H   -4.734900      0.8873000     -0.8923000    
 H    1.844700       1.398700       1.811900    
 H    3.790200       2.214200      0.4713000    
 H    2.459600       3.386300      0.4344000    
 H    3.618600     -0.3039000       1.951800    
 H   0.9414000     -0.1498000      -1.430500    
 H    1.862900       2.564900      -1.589200    
 H    4.279100      -2.597000       1.298800    
 H    1.580500      -2.430200      -2.041000    
 H    3.260000      -3.664300     -0.6954000    


%chk=000133069-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000133069

0 1
O -0.524556 0.720318 0.820623
O 0.126826 2.342052 -0.708871
O 2.826157 2.900039 -0.913801
N -3.141402 -0.939261 -0.979652
C -2.839389 0.140298 1.370301
C -1.946502 0.852773 0.336199
C -2.487152 -1.372093 1.429872
C -4.310576 0.307560 0.891685
C -2.142507 0.160695 -1.058600
C -2.663564 -1.976134 -0.011271
C -4.451499 -0.389719 -0.513817
C 0.421325 1.496469 0.182383
C 1.838441 1.190797 0.679302
C 2.354696 -0.107473 0.041407
C 2.760586 2.430677 0.467394
C 2.450184 -1.282292 0.830370
C 2.738100 -0.163633 -1.324183
C 2.924878 -2.490378 0.272636
C 3.212908 -1.372569 -1.880601
C 3.306302 -2.539704 -1.087894
H -2.701387 0.605874 2.361973
H -2.166702 1.934699 0.285237
H -3.158254 -1.868827 2.155337
H -1.452278 -1.501433 1.790745
H -4.575201 1.380905 0.831779
H -4.986407 -0.152800 1.635963
H -2.475325 0.896554 -1.810224
H -1.182158 -0.262459 -1.404957
H -1.706966 -2.375368 -0.392708
H -3.395467 -2.803477 -0.013765
H -5.171658 -1.225953 -0.472003
H -4.813481 0.322632 -1.276977
H 1.758970 1.017196 1.769427
H 3.793847 2.161418 0.742282
H 2.414977 3.246802 1.139315
H 2.151110 -1.250660 1.885314
H 2.688679 0.743327 -1.934377
H 1.883925 3.069719 -1.198573
H 2.997014 -3.388116 0.896988
H 3.512412 -1.402318 -2.934339
H 3.673393 -3.475537 -1.524021


