%chk=000094236.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000094236

0 1
 O    6.654900       1.267800     -0.8569000    
 O    6.884700       1.356900       1.437400    
 C   -1.036500     -0.2923000      0.4425000    
 C   0.1812000     -0.8921000     -0.2633000    
 C   -2.360800     -0.6248000     -0.2536000    
 C    1.488300     -0.5101000      0.4390000    
 C   -3.579900      2.5000000E-02  0.4070000    
 C    2.722500      -1.039700     -0.2998000    
 C   -4.872500     -0.3588000     -0.3175000    
 C    4.034800     -0.6705000      0.3982000    
 C   -6.130300      0.2366000      0.3224000    
 C    5.282600      -1.198300     -0.3224000    
 C   -7.426700     -0.1709000     -0.3845000    
 C    6.619900     -0.7822000      0.3113000    
 C   -8.640800      0.5100000      0.2534000    
 C   -9.962400      0.1582000     -0.4330000    
 C    7.797500      -1.325800     -0.4974000    
 C    6.726300      0.7313000      0.3969000    
 C   -11.16270      0.8882000      0.1497000    
 C    6.779700       2.691500     -0.9293000    
 H   -1.073100     -0.6541000       1.477400    
 H  -0.9240000      0.7979000      0.4913000    
 H   8.7099999E-02  -1.984200     -0.2959000    
 H   0.2089000     -0.5396000      -1.301500    
 H   -2.305800     -0.3005000      -1.300400    
 H   -2.491400      -1.714000     -0.2667000    
 H    1.556500      0.5822000      0.5145000    
 H    1.479300     -0.9023000       1.463200    
 H   -3.639000     -0.2904000       1.455500    
 H   -3.464700       1.115400      0.4023000    
 H    2.732200     -0.6409000      -1.321600    
 H    2.653600      -2.131100     -0.3837000    
 H   -4.966200      -1.451800     -0.3335000    
 H   -4.812800     -3.1300001E-02  -1.362800    
 H    4.024000      -1.061300       1.423100    
 H    4.085700      0.4218000      0.4772000    
 H   -6.180800     -7.4199997E-02   1.373400    
 H   -6.043800       1.330400      0.3199000    
 H    5.246900     -0.8643000      -1.367800    
 H    5.231800      -2.294500     -0.3511000    
 H   -7.367900      0.1045000      -1.444300    
 H   -7.545700      -1.259800     -0.3381000    
 H    6.674400      -1.176200       1.333400    
 H   -8.700600      0.2306000       1.312700    
 H   -8.501300       1.597900      0.2206000    
 H   -9.891600      0.3969000      -1.501000    
 H   -10.13240     -0.9226000     -0.3599000    
 H    7.762000      -1.000900      -1.543100    
 H    7.798400      -2.420800     -0.4864000    
 H    8.748900     -0.9823000     -7.6800004E-02
 H   -11.04400       1.972100      5.4800000E-02
 H   -12.07710      0.5976000     -0.3766000    
 H   -11.28770      0.6477000       1.210200    
 H    6.707100       2.986100      -1.979600    
 H    7.753500       3.006200     -0.5423000    
 H    5.968700       3.170800     -0.3730000    


%chk=000094236-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000094236

0 1
O 6.890397 1.230496 -0.889879
O 7.155168 1.345075 1.417867
C -1.066338 -0.155425 0.378688
C 0.182219 -0.749789 -0.311264
C -2.390135 -0.543096 -0.317943
C 1.510601 -0.356054 0.372949
C -3.643703 0.044253 0.368920
C 2.753767 -0.959013 -0.319110
C -4.962665 -0.335783 -0.341042
C 4.085135 -0.562410 0.357379
C -6.220449 0.247645 0.341409
C 5.316473 -1.174754 -0.345843
C -7.535282 -0.125861 -0.379904
C 6.669245 -0.840482 0.340960
C -8.796280 0.456785 0.297285
C -10.108267 0.086701 -0.431917
C 7.852410 -1.555563 -0.364408
C 6.923287 0.664120 0.392231
C -11.364112 0.673330 0.248435
C 7.156240 2.686745 -0.954583
H -1.096127 -0.491608 1.436382
H -0.977602 0.950946 0.407439
H 0.095471 -1.856594 -0.332929
H 0.205669 -0.420386 -1.371397
H -2.359562 -0.203443 -1.374669
H -2.476047 -1.649667 -0.350908
H 1.600878 0.750324 0.389772
H 1.487545 -0.681063 1.434206
H -3.681246 -0.302603 1.422949
H -3.555006 1.150293 0.409508
H 2.774004 -0.637246 -1.381464
H 2.664000 -2.065806 -0.331969
H -5.049699 -1.441921 -0.384106
H -4.923603 0.012821 -1.394568
H 4.067898 -0.880691 1.420457
H 4.172997 0.543690 0.365723
H -6.265500 -0.106666 1.392676
H -6.131067 1.353291 0.390608
H 5.356398 -0.830978 -1.397450
H 5.213165 -2.278965 -0.369473
H -7.488264 0.228248 -1.431297
H -7.624363 -1.231603 -0.429362
H 6.627963 -1.163264 1.398588
H -8.848725 0.099512 1.347267
H -8.707453 1.562351 0.350344
H -10.053611 0.443274 -1.480996
H -10.196014 -1.017966 -0.484169
H 7.924913 -1.235069 -1.418213
H 7.696712 -2.649417 -0.340971
H 8.814029 -1.336387 0.133518
H -11.313744 1.778048 0.287148
H -12.287228 0.395928 -0.293338
H -11.459294 0.306703 1.288137
H 7.082595 2.939298 -2.021799
H 8.162286 2.910282 -0.560935
H 6.408821 3.240415 -0.361441


