%chk=000130907.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000130907

0 1
 O   -1.791500      -4.113700      0.2490000    
 O   -3.729700      3.6400001E-02 -0.6283000    
 O   -4.752600       2.513800     -0.4088000    
 N    2.794400      0.3836000      9.9200003E-02
 C    1.358700      0.6049000     -0.2142000    
 C   0.5108000     -0.6622000     -6.0600001E-02
 C   0.7518000       1.719100      0.6684000    
 C    3.295700     -0.7815000     -0.6474000    
 C    1.124700      -1.929900     -8.3300002E-02
 C    2.621300      -2.055700     -0.1480000    
 C  -0.8995000     -0.5486000      3.9600000E-02
 C  -0.7193000       1.914500      0.3769000    
 C    3.620400       1.551000     -0.2271000    
 C   -1.522100      0.7949000      6.8999998E-02
 C   0.3437000      -3.084700      2.3300000E-02
 C   -1.651700      -1.732700      0.1422000    
 C    5.069200       1.307800      0.1879000    
 C   -1.037800      -2.985500      0.1322000    
 C   -1.280200       3.198700      0.4555000    
 C   -2.884100       1.020700     -0.1987000    
 C   -3.433200       2.304700     -0.1350000    
 C   -2.633500       3.391900      0.1976000    
 C    5.943500       2.513400     -0.1205000    
 C   -1.099400      -5.360900      0.2312000    
 H    1.268000      0.9019000      -1.270600    
 H    1.258700       2.672100      0.4873000    
 H   0.8635000       1.479200       1.734200    
 H    4.359900     -0.9776000     -0.5127000    
 H    3.124700     -0.6558000      -1.725500    
 H    2.988400      -2.298900      0.8576000    
 H    2.896400      -2.883300     -0.8132000    
 H    3.565800       1.789000      -1.297400    
 H    3.281900       2.434600      0.3216000    
 H   0.8745000      -4.031100      2.2399999E-02
 H   -2.722400      -1.731300      0.3147000    
 H    5.126500       1.084600       1.260100    
 H    5.540700      0.4819000     -0.3481000    
 H  -0.6618000       4.054900      0.7130000    
 H   -3.055300       4.391500      0.2519000    
 H    5.942800       2.736200      -1.192400    
 H    5.591400       3.400800      0.4152000    
 H    6.977000       2.322400      0.1858000    
 H   -3.264000     -0.4750000      -1.312400    
 H   -5.159600       1.656300     -0.6230000    
 H  -0.5843000      -5.523200     -0.7218000    
 H   -1.853600      -6.149500      0.3235000    
 H  -0.4274000      -5.461000       1.090300    


%chk=000130907-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000130907

0 1
O -1.930979 -4.116746 0.306295
O -3.666652 0.152805 -0.937052
O -4.622755 2.627205 -0.613768
N 2.846473 0.340539 -0.062731
C 1.382928 0.575175 -0.213358
C 0.564792 -0.717786 -0.122112
C 0.824256 1.537691 0.870751
C 3.287834 -0.858030 -0.821162
C 1.156409 -1.999532 -0.120976
C 2.666210 -2.127880 -0.225077
C -0.855822 -0.593501 0.019325
C -0.631472 1.843827 0.557872
C 3.661904 1.532178 -0.430039
C -1.445734 0.769830 0.076209
C 0.353834 -3.164396 -0.007710
C -1.645761 -1.759622 0.174111
C 5.027582 1.572498 0.289117
C -1.042430 -3.040361 0.148382
C -1.178151 3.136795 0.689047
C -2.768867 1.066346 -0.333969
C -3.310739 2.371703 -0.198599
C -2.520614 3.406165 0.331971
C 5.869960 2.794781 -0.135942
C -1.360771 -5.465308 0.329846
H 1.167954 1.043657 -1.213547
H 1.401029 2.477812 0.905684
H 0.941267 1.043430 1.856024
H 4.388619 -0.921190 -0.766553
H 3.013838 -0.775919 -1.905263
H 3.091899 -2.290201 0.784619
H 2.935889 -3.008056 -0.840424
H 3.821859 1.580822 -1.538099
H 3.103346 2.446239 -0.159874
H 0.839958 -4.145297 -0.021686
H -2.708231 -1.710481 0.436130
H 4.846547 1.587906 1.380278
H 5.594714 0.644572 0.079222
H -0.549297 3.950618 1.066708
H -2.954021 4.405556 0.429089
H 6.074142 2.781798 -1.223496
H 5.346553 3.741973 0.095102
H 6.841850 2.811938 0.389387
H -3.206738 -0.687099 -1.194103
H -5.000890 1.785706 -0.984725
H -0.856092 -5.705914 -0.626313
H -2.218709 -6.137930 0.475216
H -0.645521 -5.585614 1.166793


