%chk=000044317.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000044317

0 1
 O   -4.000400      -1.210600      0.2388000    
 C   0.9222000      0.3209000      1.6799999E-02
 C   0.2943000     -0.9461000      0.1009000    
 C   -1.106900      -1.050000      0.1466000    
 C   -1.931000      8.2900003E-02  0.1121000    
 C   -1.335700       1.354600      2.9899999E-02
 C    2.360800      0.3904000     -2.8500000E-02
 C   6.8200000E-02   1.453200     -1.6200000E-02
 C    3.114200     -0.8118000      1.3100000E-02
 C    1.070200      -2.107700      0.1390000    
 C   -3.331600     -2.2700001E-02  0.1580000    
 C    2.458700      -2.042100      9.6100003E-02
 C   -1.710900      -2.428200      0.2341000    
 C   -2.157000       2.494800     -4.0000002E-03
 C    3.098000       1.598400     -0.1140000    
 C    4.518600     -0.7788000     -2.8899999E-02
 C   -4.133200       1.118000      0.1231000    
 C   -3.546300       2.376300      4.2199999E-02
 C    4.494900       1.617600     -0.1553000    
 C    5.205500      0.4282000     -0.1124000    
 C   -4.352800      -1.837200     -0.9913000    
 H   0.4958000       2.452400     -7.9599999E-02
 H   0.6857000      -3.119300      0.1517000    
 H    3.024900      -2.971700      0.1178000    
 H   -2.520100      -2.492300      0.9634000    
 H   -1.983900      -2.807700     -0.7524000    
 H   -1.064100      -3.180000      0.6884000    
 H   -1.719000       3.488900     -6.7299999E-02
 H    2.596200       2.561800     -0.1508000    
 H    5.094800      -1.701800      3.3000000E-03
 H   -5.216300       1.034900      0.1601000    
 H   -4.168100       3.266200      1.5200000E-02
 H    5.021800       2.565000     -0.2208000    
 H    6.290600      0.4377000     -0.1441000    
 H   -5.335800      -1.472700      -1.306100    
 H   -4.426100      -2.916400     -0.8303000    
 H   -3.630100      -1.634900      -1.789200    


%chk=000044317-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000044317

0 1
O -4.203584 -1.219063 0.060592
C 0.902970 0.269184 0.045393
C 0.280764 -1.041190 0.165654
C -1.140303 -1.187202 0.261241
C -1.982209 -0.023876 0.168038
C -1.346066 1.293743 0.118468
C 2.368381 0.380775 -0.059269
C 0.067157 1.398647 0.060631
C 3.170163 -0.813925 -0.028469
C 1.147192 -2.207629 0.191942
C -3.438698 -0.017665 0.132811
C 2.518725 -2.100579 0.097855
C -1.701746 -2.579883 0.527265
C -2.137832 2.494933 0.140598
C 3.041681 1.631471 -0.196785
C 4.591010 -0.723633 -0.127989
C -4.175043 1.166046 0.165945
C -3.525331 2.438760 0.190521
C 4.440452 1.704261 -0.292815
C 5.225981 0.518873 -0.257218
C -4.374708 -1.727865 -1.313783
H 0.491932 2.406909 0.028716
H 0.697581 -3.200211 0.274361
H 3.145468 -3.000483 0.112112
H -2.766465 -2.536561 0.786340
H -1.588678 -3.246142 -0.351427
H -1.162008 -3.057746 1.364721
H -1.618809 3.460107 0.118998
H 2.467675 2.562206 -0.234125
H 5.181549 -1.647303 -0.102072
H -5.267339 1.091390 0.158503
H -4.124480 3.354670 0.221911
H 4.928749 2.679382 -0.397729
H 6.317038 0.579945 -0.332481
H -4.885321 -0.973577 -1.943370
H -5.000004 -2.629647 -1.224984
H -3.399743 -1.986921 -1.770701


