%chk=000152434.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000152434

0 1
 O   -1.428600       3.067800      -1.430400    
 O   -1.427300      -3.062400      -1.431200    
 O  -1.9099999E-02   2.990200      0.4045000    
 O  -3.2400001E-02  -2.995700      0.4151000    
 O    5.433300     -1.2000001E-03 -0.4459000    
 O    5.018500     -1.6000000E-03   1.709800    
 N   -3.285100      2.4000001E-03   1.070900    
 N    4.628700     -2.0000001E-03  0.5170000    
 C  -0.9698000     -5.0000002E-04 -0.5589000    
 C   -1.607900       1.279700     -4.9000001E-03
 C   -1.609500      -1.276600     -3.1000001E-03
 C   0.5051000     -1.2000001E-03 -0.2754000    
 C   -2.724800       1.231100      0.7566000    
 C   -2.732100      -1.226300      0.7487000    
 C    1.407500     -2.4000001E-03  -1.332100    
 C   0.9519000     -1.0000000E-03   1.040400    
 C   -3.454700       2.422300       1.315900    
 C   -3.468800      -2.418000       1.297700    
 C  -0.9089000       2.542200     -0.2949000    
 C  -0.9140000      -2.541600     -0.2906000    
 C    2.777300     -3.1999999E-03  -1.069100    
 C    2.321700     -1.9000000E-03   1.303400    
 C    3.234400     -3.1000001E-03  0.2487000    
 C  -0.8467000       4.307400      -1.847000    
 C  -0.8487000      -4.304400      -1.845400    
 H   -1.143200     -1.0000000E-03  -1.644500    
 H   -4.125900      3.1000001E-03   1.637600    
 H    1.065300     -2.4999999E-03  -2.363200    
 H   0.2583000       0.000000       1.876800    
 H   -3.477300       2.372000       2.409700    
 H   -4.486800       2.439500      0.9496000    
 H   -2.992300       3.374000       1.039100    
 H   -3.497300      -2.373400       2.391700    
 H   -3.008800      -3.370200       1.018700    
 H   -4.499000      -2.429400      0.9258000    
 H    3.459100     -3.7000000E-03  -1.915700    
 H    2.641300     -1.3000000E-03   2.342400    
 H   -1.000800       5.074100      -1.081700    
 H   -1.344700       4.624500      -2.767100    
 H   0.2199000       4.174900      -2.052600    
 H   -1.013200      -5.071600      -1.082700    
 H   0.2202000      -4.177200      -2.042200    
 H   -1.341200      -4.617200      -2.770000    


%chk=000152434-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000152434

0 1
O -0.863767 2.291602 -1.907066
O -0.867340 -2.289848 -1.909305
O -1.952280 3.702558 -0.416602
O -1.953598 -3.700543 -0.416914
O 5.424976 -0.005664 -0.104636
O 4.893602 0.000593 2.113154
N -2.794236 0.000720 1.791632
N 4.566565 -0.001955 0.862162
C -1.111259 0.000979 -0.498677
C -1.795185 1.276044 0.026563
C -1.795515 -1.274225 0.026118
C 0.388530 0.000480 -0.137715
C -2.547200 1.243672 1.187389
C -2.547361 -1.242103 1.187000
C 1.373755 -0.002929 -1.157329
C 0.806722 0.003243 1.219851
C -3.183928 2.409270 1.909897
C -3.184012 -2.407984 1.909095
C -1.581958 2.532964 -0.718118
C -1.583106 -2.531118 -0.718824
C 2.745602 -0.003742 -0.842606
C 2.172086 0.002452 1.558810
C 3.126772 -0.001086 0.517414
C -0.593391 3.489975 -2.730806
C -0.599060 -3.488301 -2.733633
H -1.174439 0.001164 -1.597176
H -3.353508 0.000622 2.646375
H 1.049875 -0.004952 -2.202397
H 0.057480 0.006164 2.018523
H -2.723074 2.537163 2.909308
H -4.266926 2.234256 2.057685
H -3.042198 3.338509 1.343113
H -2.720827 -2.538306 2.907125
H -3.044662 -3.336539 1.340575
H -4.266378 -2.231710 2.059829
H 3.518376 -0.006327 -1.615744
H 2.512706 0.004543 2.597594
H -1.539436 3.958440 -3.050909
H -0.024632 3.114952 -3.593604
H -0.005804 4.225369 -2.156102
H -1.545883 -3.957219 -3.050726
H -0.009400 -4.223322 -2.160569
H -0.033085 -3.113260 -3.598257


