%chk=000123839.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000123839

0 1
 O   -1.807300      -1.174000      0.2035000    
 O    3.010100       1.393000      6.3699998E-02
 O   -4.921600      0.7674000     -1.2800000E-02
 O    4.665700      0.6366000       2.753000    
 O    2.349800      -3.924100      -2.116000    
 O    3.135900      -1.022500       3.022000    
 O    3.054600      -1.784300      -2.414700    
 O    4.864500       3.563400      -2.105700    
 O    5.358600       2.769300     -2.8999999E-02
 O   -8.484200      0.2968000     -3.2299999E-02
 O   -7.349600       2.250200     -0.1789000    
 N    3.052400      -1.396300      0.3033000    
 N   -4.635300      -1.467600      0.1824000    
 C    1.829200     -0.6890000      0.2226000    
 C  -0.5823000      0.7187000      6.2100001E-02
 C  -0.5427000     -0.6667000      0.1811000    
 C    1.832100      0.7032000      0.1033000    
 C   0.6327000      -1.410800      0.2644000    
 C   0.6330000       1.424300      2.1800000E-02
 C   -1.959000       1.062300      1.0200000E-02
 C    4.220100     -0.7696000      0.8842000    
 C    3.148500      -2.746900     -0.2068000    
 C   -2.657300     -0.1195000      9.9600002E-02
 C   -4.066600     -0.2867000      9.0899996E-02
 C    3.932800     -0.4183000       2.315700    
 C    2.852800      -2.741900      -1.679300    
 C    3.263000       2.170500      -1.103000    
 C   -6.151900      0.1837000      1.7000001E-02
 C   -5.973600      -1.172200      0.1353000    
 C    4.601600       2.844800     -0.9852000    
 C   -7.306000       1.006300     -7.2400004E-02
 H   0.5767000      -2.486000      0.3732000    
 H   0.6268000       2.507300     -5.1899999E-02
 H   -2.378100       2.055400     -8.1400000E-02
 H    5.042300      -1.496100      0.9433000    
 H    4.646800      4.3099999E-02  0.2979000    
 H    2.476700      -3.427800      0.3250000    
 H    4.159300      -3.155100     -9.0300001E-02
 H    3.277500       1.514000      -1.980200    
 H    2.508000       2.954800      -1.218600    
 H   -6.723800      -1.947500      0.1890000    
 H    4.473500      0.8521000       3.690500    
 H    2.166800      -3.910200      -3.079600    
 H    5.734100       4.014600      -2.055600    
 H   -9.263700      0.8890000     -9.5899999E-02


%chk=000123839-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000123839

0 1
O -1.850612 -1.040393 0.173062
O 2.811754 1.997814 -0.186771
O -5.126926 0.709884 0.098017
O 4.604886 -0.437596 3.570148
O 3.051632 -3.604075 -2.164790
O 2.981085 -1.917698 2.808179
O 3.135755 -1.328045 -2.618531
O 5.424892 2.718860 -2.559488
O 5.656673 1.972705 -0.369362
O -8.730107 0.067202 0.199351
O -7.646899 2.135562 0.030950
N 3.114744 -0.787326 0.192098
N -4.771020 -1.564511 0.256568
C 1.801681 -0.240484 0.118256
C -0.763769 1.011136 0.015776
C -0.596090 -0.404080 0.113173
C 1.650071 1.188966 -0.053863
C 0.640649 -1.052648 0.178371
C 0.400056 1.818359 -0.075143
C -2.184802 1.254027 0.015891
C 4.018079 -0.289640 1.237922
C 3.334441 -2.154213 -0.275409
C -2.805506 0.010844 0.112450
C -4.191463 -0.354961 0.160726
C 3.780133 -0.982308 2.582901
C 3.158410 -2.263722 -1.791667
C 3.454091 1.877482 -1.511582
C -6.384482 0.061131 0.164364
C -6.146384 -1.307846 0.259985
C 4.932905 2.184910 -1.362801
C -7.587339 0.887854 0.121733
H 0.695351 -2.133416 0.323413
H 0.353405 2.904569 -0.191604
H -2.700477 2.210078 -0.043548
H 5.075283 -0.432751 0.948263
H 3.901383 0.801120 1.351556
H 2.706606 -2.919380 0.221314
H 4.379060 -2.444216 -0.053939
H 3.350913 0.846367 -1.909621
H 2.991270 2.589544 -2.218083
H -6.879278 -2.106280 0.329513
H 4.440287 -0.898166 4.437745
H 2.971828 -3.675731 -3.154649
H 6.408852 2.852502 -2.485013
H -9.538120 0.646268 0.169538


