%chk=000179003.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000179003

0 1
 O   -4.877900      -1.650300      0.2945000    
 O    6.092700     -0.6526000      0.8753000    
 N   -4.150100      0.5689000     -2.7700000E-02
 N    5.614600     -0.1851000     -0.1689000    
 C   2.2299999E-02  0.2469000     -9.1300003E-02
 C    1.464700      0.1359000     -0.1121000    
 C   -2.759200      0.4614000     -4.8700001E-02
 C  -0.5837000       1.493900     -0.2445000    
 C  -0.7628000     -0.8930000      8.3300002E-02
 C   -1.974200       1.601200     -0.2230000    
 C   -2.153500     -0.7858000      0.1045000    
 C    2.252300       1.196700      0.3348000    
 C    2.067600      -1.032500     -0.5781000    
 C    3.642900       1.089300      0.3157000    
 C    3.458200      -1.140000     -0.5973000    
 C    4.246000     -7.9000004E-02 -0.1503000    
 C   -5.094500     -0.4535000      0.1348000    
 C   -6.505500      7.7799998E-02  9.8999999E-02
 H  -1.5100000E-02   2.404200     -0.4136000    
 H  -0.3343000      -1.879600      0.2375000    
 H   -2.433500       2.578400     -0.3503000    
 H   -2.694200      -1.710400      0.2509000    
 H    1.827600       2.113200      0.7350000    
 H    1.496300      -1.872200     -0.9644000    
 H    4.241600       1.923900      0.6740000    
 H    3.911700      -2.055800     -0.9703000    
 H   -4.514600       1.511900     -0.1463000    
 H   -6.656600      0.7802000      0.9235000    
 H   -7.215200     -0.7478000      0.2004000    
 H   -6.686800      0.5860000     -0.8523000    


%chk=000179003-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000179003

0 1
O -5.028198 -1.621929 0.193634
O 6.497690 0.584880 0.278077
N -4.231863 0.577235 -0.030656
N 5.782445 -0.403101 -0.140837
C 0.032996 0.160540 -0.049155
C 1.512187 0.039400 -0.062179
C -2.825305 0.387313 -0.030241
C -0.605301 1.428515 -0.167801
C -0.805242 -0.982899 0.081259
C -2.004064 1.541939 -0.163138
C -2.208202 -0.888198 0.095668
C 2.339784 1.110418 0.406094
C 2.148626 -1.144969 -0.539969
C 3.736156 1.010113 0.397903
C 3.548315 -1.257371 -0.549210
C 4.348905 -0.181375 -0.083585
C -5.249890 -0.383853 0.077937
C -6.657402 0.212689 0.046554
H -0.002964 2.333180 -0.303581
H -0.353145 -1.972385 0.210954
H -2.465887 2.531841 -0.273206
H -2.833138 -1.775214 0.209721
H 1.868310 2.012306 0.811583
H 1.540342 -1.964754 -0.935334
H 4.377027 1.820381 0.762898
H 4.051437 -2.156884 -0.920542
H -4.543225 1.547993 -0.120649
H -6.824082 0.888317 0.906195
H -7.386483 -0.608374 0.098129
H -6.833031 0.786445 -0.882422


