%chk=000071133.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000071133

0 1
 O   -5.890600       1.260600      6.1600000E-02
 O   2.2500001E-02  -1.221800     -0.1440000    
 O    2.674100     -0.8620000      -1.042200    
 O    1.037900      -1.114600       1.920000    
 N   -3.582100     -0.3982000     -8.2599998E-02
 C   -3.533100      0.9353000      0.5327000    
 C   -4.621400     -0.4357000      -1.121000    
 C   -2.280100     -0.7615000     -0.6383000    
 C   -4.905200       1.296700       1.094500    
 C   -5.967800     -4.1000001E-02 -0.5209000    
 C   -1.214000     -0.8320000      0.4396000    
 C    2.337800      -1.792600     -2.2100000E-02
 C    1.084300      -1.328100      0.7144000    
 C    3.521000      -1.896200      0.9387000    
 C    2.054000      -3.137200     -0.6843000    
 C    2.940800      0.4222000     -0.6442000    
 C    4.242300      0.7847000     -0.3169000    
 C    1.906700       1.348300     -0.5717000    
 C    4.513500       2.091300      8.8799998E-02
 C    2.178000       2.655100     -0.1661000    
 C    3.481500       3.026600      0.1641000    
 H   -2.838400      0.9758000       1.375800    
 H   -3.228200       1.688200     -0.2056000    
 H   -4.369300      0.2548000      -1.936300    
 H   -4.702600      -1.444200      -1.542400    
 H   -2.341000      -1.745800      -1.120900    
 H   -1.964600     -6.2500000E-02  -1.424800    
 H   -4.886400       2.313600       1.499700    
 H   -5.201400      0.6217000       1.906800    
 H   -6.300400     -0.7617000      0.2361000    
 H   -6.730700     -9.6000005E-03  -1.305500    
 H   -1.497800      -1.562000       1.207400    
 H   -1.049200      0.1405000      0.9124000    
 H    4.459200      -2.079200      0.4031000    
 H    3.373900      -2.729400       1.636900    
 H    3.652000      -1.005500       1.562300    
 H    1.285900      -3.048800      -1.461500    
 H    1.717600      -3.883800      4.3000001E-02
 H    2.951000      -3.519600      -1.185000    
 H    5.059700      7.4100003E-02 -0.3946000    
 H   0.8929000       1.086600     -0.8556000    
 H    5.529300       2.382200      0.3401000    
 H    1.375800       3.385300     -0.1147000    
 H    3.693200       4.044800      0.4771000    


%chk=000071133-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000071133

0 1
O -6.035013 1.237121 0.079413
O 0.045288 -1.353271 -0.079278
O 2.754445 -0.901281 -1.010768
O 1.041224 -1.375081 2.019771
N -3.523255 -0.218505 -0.084068
C -3.582044 1.164036 0.462821
C -4.599011 -0.415001 -1.092101
C -2.184699 -0.589101 -0.596179
C -4.967803 1.427943 1.074935
C -5.969222 -0.133929 -0.454343
C -1.238719 -0.939179 0.558534
C 2.408855 -1.948727 0.013542
C 1.125679 -1.529437 0.780513
C 3.560513 -2.151791 1.011462
C 2.141973 -3.199080 -0.841662
C 2.952475 0.439833 -0.574574
C 4.243820 0.883069 -0.203215
C 1.870925 1.350247 -0.639700
C 4.445517 2.243013 0.123866
C 2.083436 2.708177 -0.312356
C 3.367375 3.157492 0.075795
H -2.813478 1.288187 1.247601
H -3.383077 1.921804 -0.336985
H -4.463815 0.258704 -1.975063
H -4.568692 -1.461289 -1.450329
H -2.290049 -1.481160 -1.239994
H -1.725691 0.214288 -1.224228
H -5.060821 2.473855 1.410754
H -5.129242 0.742555 1.934603
H -6.153846 -0.863486 0.363391
H -6.777261 -0.199381 -1.201454
H -1.633907 -1.778307 1.156732
H -1.037256 -0.089915 1.235246
H 4.476047 -2.424302 0.459218
H 3.311941 -2.962708 1.717260
H 3.744750 -1.241953 1.605345
H 1.331461 -3.000213 -1.559472
H 1.860239 -4.055783 -0.204257
H 3.059349 -3.456725 -1.397791
H 5.075497 0.171439 -0.196170
H 0.892642 0.986395 -0.969220
H 5.445710 2.588524 0.408406
H 1.249356 3.416924 -0.369160
H 3.528982 4.211399 0.327063


