%chk=000146457.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000146457

0 1
 O    5.545700      -1.184500     -7.9599999E-02
 O   -5.904100     -0.4175000     -0.1340000    
 C   0.5606000      -1.351900     -7.1999999E-03
 C  -0.3085000     -9.8600000E-02 -8.7700002E-02
 C    1.935900     -0.7442000     -6.3400000E-02
 C   0.4223000       1.033000     -0.1930000    
 C    1.836500      0.6494000     -0.1703000    
 C  -2.0400001E-02   2.446200     -0.3156000    
 C   0.3354000      -2.156200       1.269900    
 C   -1.754000     -0.1801000     -9.9699996E-02
 C    3.168300      -1.378700     -3.5500001E-02
 C    2.977900       1.434700     -0.2414000    
 C    4.319000     -0.5923000     -0.1068000    
 C    4.224500      0.8040000     -0.2078000    
 C  -0.1822000       3.116500       1.040300    
 C   -2.439700     -0.3425000      -1.307200    
 C   -2.473500     -9.8099999E-02   1.096200    
 C   -3.832300     -0.4218000      -1.318800    
 C   -3.866000     -0.1778000       1.084600    
 C   -4.545500     -0.3395000     -0.1229000    
 H   0.3993000      -1.977500     -0.8934000    
 H   0.6740000       3.023100     -0.9369000    
 H  -0.9823000       2.491100     -0.8410000    
 H    1.041100      -2.991700       1.336600    
 H   0.4687000      -1.541500       2.168000    
 H  -0.6743000      -2.579500       1.296400    
 H    3.230500      -2.459600      3.8500000E-02
 H    2.923300       2.515200     -0.3204000    
 H    5.128200       1.406200     -0.2625000    
 H  -0.5194000       4.150000      0.9108000    
 H   0.7655000       3.138900       1.588700    
 H  -0.9214000       2.598200       1.659500    
 H   -1.898800     -0.4089000      -2.248400    
 H   -1.960200      2.8700000E-02   2.046600    
 H   -4.349700     -0.5481000      -2.266100    
 H   -4.416100     -0.1130000       2.019400    
 H    5.428900      -2.147400     -7.6000001E-03
 H   -6.205900     -0.5283000      -1.051900    


%chk=000146457-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000146457

0 1
O 5.652441 -1.090633 -0.262282
O -6.087432 -0.461984 -0.226451
C 0.536325 -1.276113 -0.233050
C -0.361755 -0.026782 -0.123912
C 1.939638 -0.689387 -0.191868
C 0.422748 1.116226 -0.031637
C 1.846629 0.726867 -0.068031
C -0.004154 2.565893 0.039933
C 0.277486 -2.321475 0.885376
C -1.831640 -0.139027 -0.149735
C 3.184190 -1.333384 -0.259089
C 3.024642 1.510885 -0.020714
C 4.357892 -0.534693 -0.203231
C 4.282518 0.874556 -0.088156
C 0.118647 3.172671 1.465904
C -2.465639 -1.181656 -0.888210
C -2.685505 0.754529 0.567786
C -3.867601 -1.313803 -0.936268
C -4.085980 0.635495 0.530059
C -4.682258 -0.397455 -0.228817
H 0.375077 -1.771172 -1.215176
H 0.635254 3.157561 -0.645962
H -1.041025 2.679940 -0.323529
H 0.945153 -3.194975 0.770802
H 0.459878 -1.873963 1.878248
H -0.767046 -2.678586 0.854811
H 3.257224 -2.425387 -0.355335
H 2.975670 2.602104 0.065031
H 5.215694 1.444502 -0.052435
H -0.163362 4.241514 1.462414
H 1.152781 3.090998 1.845562
H -0.536670 2.646422 2.183874
H -1.853296 -1.889739 -1.457321
H -2.243356 1.531217 1.198116
H -4.321856 -2.121947 -1.524890
H -4.730092 1.320136 1.089886
H 5.606359 -2.076024 -0.335160
H -6.406279 -1.217330 -0.780140


