%chk=000152665.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000152665

0 1
 O    4.129000     -0.1366000       1.757300    
 O   -5.667900      0.2143000      0.3825000    
 C    2.768500     -0.7422000     -0.1921000    
 C  -0.1558000     -0.4714000      0.4380000    
 C   -1.570400     -0.4130000     -0.2480000    
 C    2.038500      0.5862000     -0.2281000    
 C    2.029500      -1.756600      0.6982000    
 C   0.5482000      -1.843600      0.3186000    
 C   0.7230000      0.7152000      3.3799998E-02
 C    4.149100     -0.3116000      0.3432000    
 C    3.030400       1.707700     -0.4266000    
 C    4.406600       1.041300     -0.3238000    
 C   -2.480400      -1.519300      0.3470000    
 C    2.908200      -1.294400      -1.629700    
 C   -2.202400      0.9589000      2.9700000E-02
 C   -1.464900     -0.6010000      -1.782600    
 C   3.4299999E-02   1.995900      2.4800001E-02
 C   -1.302000       2.103300      5.1800001E-02
 C   -3.940100      -1.379500     -6.4599998E-02
 C   -3.514800       1.141400      0.2495000    
 C   -4.466500      4.8000002E-03  0.2214000    
 H  -0.3229000     -0.3346000       1.520600    
 H    2.090000      -1.477200       1.757300    
 H    2.493300      -2.746800      0.6132000    
 H   0.4510000      -2.256300     -0.6893000    
 H   6.1200000E-02  -2.563200      0.9879000    
 H    4.937400      -1.034600      0.1113000    
 H    2.908200       2.187300      -1.402800    
 H    2.928800       2.463200      0.3600000    
 H    4.829000      0.9068000      -1.326000    
 H    5.099900       1.665600      0.2499000    
 H   -2.425700      -1.485000       1.444200    
 H   -2.128800      -2.514200      4.8700001E-02
 H    1.935400      -1.464900      -2.102500    
 H    3.454400     -0.6139000      -2.291600    
 H    3.449900      -2.247100      -1.624600    
 H   -2.418600     -0.3965000      -2.282900    
 H  -0.7252000      6.9700003E-02  -2.232900    
 H   -1.181100      -1.625600      -2.043800    
 H   0.6243000       2.906700     -9.2000002E-03
 H   -1.743600       3.096500      7.7399999E-02
 H   -4.539800      -2.099900      0.5031000    
 H   -4.077800      -1.589500      -1.130000    
 H   -3.937500       2.121900      0.4457000    
 H    3.481000      0.5523000       1.980900    


%chk=000152665-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000152665

0 1
O 4.060523 -0.101801 1.901396
O -5.776067 0.216539 0.555864
C 2.804879 -0.764892 -0.196019
C -0.168461 -0.485129 0.408950
C -1.605728 -0.409016 -0.236164
C 2.048684 0.560470 -0.298270
C 2.020234 -1.798054 0.645125
C 0.534449 -1.851339 0.217370
C 0.706752 0.699124 -0.027835
C 4.156482 -0.285137 0.441156
C 3.049050 1.679658 -0.599952
C 4.451828 1.062304 -0.276632
C -2.504190 -1.532020 0.358043
C 3.105496 -1.335046 -1.617772
C -2.215440 0.965278 0.103890
C -1.534376 -0.528014 -1.790329
C 0.040711 1.996528 -0.046920
C -1.326959 2.119223 0.086121
C -3.996448 -1.371428 -0.002566
C -3.568274 1.125007 0.346815
C -4.538089 0.021550 0.330048
H -0.333084 -0.350574 1.503679
H 2.095129 -1.529180 1.715784
H 2.480788 -2.799010 0.536076
H 0.465846 -2.170870 -0.840004
H 0.013119 -2.622454 0.813634
H 4.963626 -1.027003 0.328060
H 2.987574 2.003198 -1.657024
H 2.849261 2.581579 0.007865
H 5.029346 0.887603 -1.201407
H 5.063707 1.709398 0.374078
H -2.398917 -1.521289 1.462430
H -2.147914 -2.518775 0.008217
H 2.174920 -1.667454 -2.109346
H 3.577268 -0.586253 -2.278015
H 3.786082 -2.204097 -1.541929
H -2.523945 -0.348224 -2.245142
H -0.832540 0.211478 -2.214062
H -1.200867 -1.536389 -2.094458
H 0.652560 2.901505 -0.146825
H -1.784568 3.114476 0.153690
H -4.621095 -2.117901 0.519841
H -4.152941 -1.540205 -1.087464
H -3.978620 2.120321 0.563100
H 3.333109 0.546816 2.091803


