%chk=000127626.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000127626

0 1
 O   -1.276200      -2.919100     -0.4876000    
 O   -2.262900      3.1399999E-02  -2.639800    
 O   -1.829100      -1.223300       1.928700    
 O    4.980300      0.8159000     -0.6062000    
 C   -1.376400     -0.4899000     -0.3839000    
 C  -0.5365000      0.8324000     -0.4421000    
 C   0.8705000      0.7523000      0.2939000    
 C    1.628600     -0.5012000     -0.2842000    
 C  -0.5438000      -1.724200     -0.7532000    
 C   -2.614400     -0.3603000      -1.323800    
 C   0.8130000      -1.789900     -5.0999999E-02
 C   -1.388100       2.083000     -8.2400002E-02
 C   -3.476000      0.6886000     -0.6092000    
 C    3.150600     -0.6357000      7.0200004E-02
 C    1.698100       2.015800     -7.0900001E-02
 C   -2.803400       2.067600     -0.6846000    
 C   -2.161200     -0.6096000      0.9285000    
 C   0.7036000      0.7103000       1.830300    
 C   -3.452300      0.1380000      0.7902000    
 C    3.149900       1.959000      0.3801000    
 C    3.845700      0.7221000     -0.1320000    
 C    3.449200      -1.128000       1.493500    
 C    3.815400      -1.643400     -0.9050000    
 C   -4.384400      0.2080000       1.740400    
 H  -0.2848000      0.9705000      -1.505700    
 H    1.624700     -0.3470000      -1.376600    
 H  -0.3464000      -1.713800      -1.833500    
 H   -3.169200      -1.305000      -1.398800    
 H    1.337900      -2.666500     -0.4449000    
 H   0.6801000      -2.004600       1.014100    
 H  -0.8828000       2.994900     -0.4199000    
 H   -1.494900       2.180500       1.001800    
 H   -4.483000      0.7318000      -1.036800    
 H    1.241400       2.911900      0.3658000    
 H    1.682900       2.156300      -1.160200    
 H   -3.418400       2.813400     -0.1655000    
 H   -2.748800       2.391100      -1.731500    
 H    1.632500      0.9173000       2.361600    
 H   7.1000000E-03   1.470500       2.191500    
 H   0.3545000     -0.2543000       2.195100    
 H    3.251000       1.993100       1.468100    
 H    3.675400       2.836800     -1.4400000E-02
 H    4.525000      -1.301700       1.622800    
 H    3.177300     -0.4062000       2.263200    
 H    2.942000      -2.072500       1.712900    
 H    3.648100      -1.354500      -1.948900    
 H    4.901200      -1.690600     -0.7564000    
 H    3.439300      -2.661500     -0.7675000    
 H   -1.963900      -3.008200      -1.168000    
 H   -3.089500      0.1848000      -3.128200    
 H   -5.311300      0.7440000       1.566400    
 H   -4.247800     -0.2613000       2.708300    


%chk=000127626-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000127626

0 1
O -1.246179 -2.988878 -0.482672
O -2.098863 0.092357 -2.675222
O -1.808517 -1.167057 2.025232
O 5.034693 0.781415 -0.645345
C -1.393427 -0.488901 -0.370181
C -0.539447 0.850849 -0.414380
C 0.864996 0.774575 0.321864
C 1.605134 -0.489694 -0.263490
C -0.530102 -1.720998 -0.738886
C -2.590109 -0.319507 -1.359152
C 0.797090 -1.779863 0.020063
C -1.415607 2.064746 0.015843
C -3.500263 0.709090 -0.628215
C 3.149804 -0.649490 0.033276
C 1.683058 2.032273 -0.104900
C -2.803793 2.099484 -0.674742
C -2.177144 -0.600354 0.966361
C 0.717835 0.763776 1.867767
C -3.495283 0.120139 0.777925
C 3.164452 1.968424 0.337557
C 3.877002 0.710221 -0.148539
C 3.481645 -1.143351 1.479660
C 3.766753 -1.672964 -0.960517
C -4.457733 0.174608 1.732469
H -0.305810 0.984766 -1.492356
H 1.569361 -0.336462 -1.368821
H -0.312755 -1.630842 -1.827392
H -3.133157 -1.288138 -1.449207
H 1.342176 -2.672741 -0.331368
H 0.596483 -1.917407 1.096366
H -0.882145 3.004786 -0.214909
H -1.569934 2.051059 1.111111
H -4.517571 0.768878 -1.057756
H 1.231405 2.947786 0.321701
H 1.641655 2.137494 -1.209064
H -3.446801 2.853859 -0.183542
H -2.689522 2.392724 -1.735722
H 1.693528 0.864106 2.369978
H 0.105696 1.618979 2.206673
H 0.239770 -0.153049 2.244476
H 3.222779 1.991619 1.444718
H 3.730545 2.842283 -0.029980
H 4.567489 -1.330606 1.563132
H 3.198163 -0.424641 2.264873
H 2.955842 -2.092419 1.685125
H 3.481647 -1.442235 -2.003543
H 4.867019 -1.633125 -0.901920
H 3.439136 -2.701135 -0.728350
H -1.881011 -3.157221 -1.223580
H -2.846066 0.073540 -3.323713
H -5.411631 0.691382 1.576117
H -4.292485 -0.315137 2.699877


