%chk=000032078.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000032078

0 1
 O    2.740600      -2.221200      -1.612900    
 O   -4.658100      -1.893000     -9.6199997E-02
 O   -3.335300       2.681800      0.4106000    
 O   0.5732000      0.2567000      -1.800000    
 O   -5.277000      0.7159000      0.5978000    
 N    2.305400      -1.819000      0.6335000    
 C    3.675200      -1.829000       1.094400    
 C    4.056800     -0.4851000       1.734500    
 C    3.873000      0.6867000      0.7996000    
 C    3.876900      -2.973600       2.082400    
 C    1.953300      -2.017400     -0.6904000    
 C   0.4550000      -1.977900     -0.9224000    
 C    4.922800       1.092800     -2.4300000E-02
 C    2.653800       1.363000      0.7602000    
 C  -8.4600002E-02 -0.5864000      -1.194000    
 C   -1.457300     -0.2422000     -0.7219000    
 C    4.753300       2.175500     -0.8875000    
 C    2.484200       2.445500     -0.1030000    
 C   -1.765100       1.072500     -0.3721000    
 C   -2.432300      -1.235300     -0.6280000    
 C   -3.715000     -0.9137000     -0.1841000    
 C   -3.047900       1.394100      7.1800001E-02
 C   -4.022600      0.4009000      0.1659000    
 C    3.534100       2.851700     -0.9269000    
 C   -4.261800      -3.210100     -0.4730000    
 C   -2.282300       3.635500      0.2855000    
 C   -5.518300      0.6314000       2.000400    
 H    4.334100      -2.005900      0.2354000    
 H    5.100000     -0.5158000       2.075300    
 H    3.456100     -0.3129000       2.638100    
 H    1.575600      -1.655100       1.321200    
 H    3.630100      -3.934800       1.618200    
 H    4.916600      -3.019000       2.422500    
 H    3.233800      -2.858200       2.962100    
 H   0.2210000      -2.614400      -1.782900    
 H  -3.2600001E-02  -2.411000     -4.1999999E-02
 H    5.876500      0.5722000     -4.1000000E-03
 H    1.827600       1.059100       1.397300    
 H    5.570400       2.491300      -1.529600    
 H    1.534600       2.971800     -0.1339000    
 H  -0.9688000       1.803900     -0.4574000    
 H   -2.157500      -2.238100     -0.9324000    
 H    3.401700       3.694200      -1.599300    
 H   -3.992800      -3.263300      -1.533500    
 H   -3.472100      -3.597700      0.1798000    
 H   -5.132700      -3.859500     -0.3350000    
 H   -1.450100       3.409800      0.9613000    
 H   -1.957900       3.745700     -0.7549000    
 H   -2.687600       4.604600      0.5953000    
 H   -5.362300     -0.3915000       2.357500    
 H   -4.867800       1.322400       2.545800    
 H   -6.558800      0.9112000       2.186400    


%chk=000032078-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000032078

0 1
O 2.292589 -3.360769 0.016603
O -4.768628 -1.930347 -1.217326
O -4.318372 2.256361 1.064745
O 0.397627 0.291168 1.248355
O -5.851689 0.288393 -0.333487
N 2.591811 -1.286947 1.041708
C 4.024873 -1.487274 1.335389
C 4.716720 -0.103551 1.499328
C 4.702109 0.746025 0.236700
C 4.217105 -2.372208 2.589461
C 1.841185 -2.231406 0.396772
C 0.366119 -1.884805 0.095442
C 5.634133 0.500171 -0.805137
C 3.748809 1.780998 0.057799
C -0.276379 -0.596951 0.622022
C -1.730235 -0.386928 0.375024
C 5.614543 1.263828 -1.993191
C 3.724377 2.548066 -1.129528
C -2.317914 0.806533 0.863453
C -2.527941 -1.322953 -0.335887
C -3.899953 -1.070650 -0.540592
C -3.683583 1.071467 0.654182
C -4.508638 0.125426 -0.034549
C 4.657691 2.292500 -2.159955
C -4.197186 -3.156316 -1.781820
C -3.492283 3.261509 1.742109
C -6.768530 0.938665 0.628398
H 4.461648 -2.017089 0.466950
H 5.759279 -0.298140 1.815139
H 4.226476 0.437547 2.333371
H 2.104151 -0.415517 1.308791
H 3.697231 -3.334960 2.450535
H 5.290114 -2.579005 2.759980
H 3.810313 -1.874831 3.489566
H 0.273865 -1.893286 -1.009566
H -0.226044 -2.754562 0.438418
H 6.382705 -0.293230 -0.682509
H 3.019313 1.989630 0.850731
H 6.344407 1.060597 -2.785295
H 2.979463 3.343173 -1.249127
H -1.664268 1.508841 1.387531
H -2.084861 -2.244406 -0.719022
H 4.642129 2.887882 -3.079926
H -3.412209 -2.928520 -2.528930
H -3.781470 -3.811406 -0.991235
H -5.041602 -3.660358 -2.273312
H -3.073180 2.866462 2.687086
H -2.671157 3.609204 1.087044
H -4.176931 4.095017 1.956766
H -6.646125 0.500737 1.635739
H -6.593443 2.023833 0.670709
H -7.771064 0.711483 0.235644


