%chk=000054271.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000054271

0 1
 O  -0.3627000       3.224100     -0.9422000    
 O   -2.475400      -3.424400      0.8805000    
 O    4.624900      -1.697400     -0.1537000    
 O    5.705300      0.7914000      0.1761000    
 C   9.8999999E-02  0.1243000      1.6200000E-02
 C  -0.4057000      -1.187800     -0.1576000    
 C  -0.8590000       1.163500      0.1369000    
 C   -1.791000      -1.422500     -0.2059000    
 C   -2.247400      0.9338000      8.9599997E-02
 C   -2.719300     -0.3797000     -8.4799998E-02
 C    1.524700      0.3288000      6.1099999E-02
 C    2.389300     -0.7893000     -6.8999998E-02
 C   0.4774000      -2.263700     -0.2824000    
 C  -0.4923000       2.607100      0.3290000    
 C    1.853600      -2.067900     -0.2384000    
 C   -2.302100      -2.827700     -0.3933000    
 C   -3.173600       1.984200      0.2125000    
 C   -4.103800     -0.6160000     -0.1329000    
 C    2.143700       1.593200      0.2291000    
 C    3.784400     -0.6245000     -2.9100001E-02
 C   -4.545600       1.736100      0.1630000    
 C   -5.010600      0.4366000     -9.6000005E-03
 C    3.532600       1.743700      0.2670000    
 C    4.353300      0.6342000      0.1380000    
 H   0.1672000      -3.297400     -0.3838000    
 H   -1.236700       3.178800      0.8856000    
 H   0.2946000       2.786100       1.061200    
 H    2.492700      -2.943400     -0.3334000    
 H   -3.243500      -2.881800     -0.9458000    
 H   -1.656900      -3.460800      -1.006600    
 H   -2.935600       3.037500      0.2877000    
 H   -4.543500      -1.601600     -0.2365000    
 H    1.701400       2.561800      0.1297000    
 H   -5.251300       2.557700      0.2468000    
 H   -6.078500      0.2420000     -4.5000002E-02
 H    3.965900       2.736900      0.3548000    
 H  -0.1418000       4.158000     -0.7858000    
 H   -2.937000      -2.795300       1.460200    
 H    5.457600      -1.512600      0.3108000    
 H    6.131500      4.7800001E-02 -0.2806000    


%chk=000054271-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000054271

0 1
O -0.371634 3.594822 -0.227812
O -2.153063 -3.711458 0.814446
O 4.827518 -1.515212 0.176945
O 5.761434 0.968545 -0.222535
C 0.087414 0.175840 0.023857
C -0.414602 -1.188323 -0.098992
C -0.855397 1.221024 0.250429
C -1.805360 -1.456137 -0.238000
C -2.260651 0.970488 0.071751
C -2.747086 -0.373761 -0.206434
C 1.543443 0.396375 -0.064832
C 2.435952 -0.732704 0.062713
C 0.531513 -2.287263 -0.004580
C -0.447373 2.557339 0.838913
C 1.884320 -2.069797 0.128847
C -2.266616 -2.893674 -0.420685
C -3.212978 2.048840 0.138809
C -4.166202 -0.559834 -0.383444
C 2.115965 1.672421 -0.357650
C 3.840061 -0.509579 0.038674
C -4.576207 1.828365 -0.041803
C -5.058934 0.505991 -0.297986
C 3.506983 1.860305 -0.416447
C 4.379436 0.774896 -0.184657
H 0.145843 -3.308839 0.020839
H -1.200061 2.865520 1.591565
H 0.530894 2.463845 1.346387
H 2.543881 -2.942160 0.231884
H -3.299795 -2.944591 -0.803996
H -1.626104 -3.426094 -1.142095
H -2.846463 3.070340 0.269940
H -4.563695 -1.556690 -0.593185
H 1.461274 2.510802 -0.615614
H -5.279589 2.667450 -0.007983
H -6.131788 0.334933 -0.438924
H 3.939029 2.835273 -0.659246
H -0.152691 4.465695 0.195108
H -2.570383 -3.210673 1.560770
H 4.448763 -2.382660 0.453642
H 6.208752 0.094141 -0.069219


