%chk=000176815.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000176815

0 1
 O  -0.7552000      0.9626000     -0.1032000    
 O   -2.188900       2.734500      0.2893000    
 O    1.706100      0.1789000       2.320100    
 O    2.148800       1.297400      -2.132300    
 N    1.571000      0.9875000      0.1217000    
 C   -3.164300     -0.6577000      0.3742000    
 C   -4.176500      0.4462000      0.6180000    
 C   -3.070400      0.6393000     -0.3720000    
 C   -3.920300      -1.844600     -0.1915000    
 C   -5.460600     -0.1311000      0.1919000    
 C   -5.363200      -1.395500     -0.2554000    
 C   -1.969300       1.572800     -2.2900000E-02
 C   -6.444000      -2.278200     -0.7565000    
 C   0.3669000       1.788600      0.2161000    
 C    3.300100     -0.3830000      0.6401000    
 C    3.430300     -5.4299999E-02 -0.6477000    
 C    4.237100      -1.255500       1.390800    
 C    4.513700     -0.5376000      -1.539800    
 C    5.538700      -1.475400      0.6015000    
 C    5.280200      -1.704800     -0.8949000    
 C    2.101400      0.2787000       1.171300    
 C    2.318300      0.8312000      -1.018900    
 H   -2.455500     -0.9013000       1.151900    
 H   -4.155100      0.9527000       1.573300    
 H   -3.333300      0.6415000      -1.425100    
 H   -3.819400      -2.709900      0.4718000    
 H   -3.541900      -2.105000      -1.185100    
 H   -6.385800      0.4264000      0.2459000    
 H   -7.416800      -1.776700     -0.7300000    
 H   -6.513200      -3.181800     -0.1431000    
 H   -6.245000      -2.574800      -1.790800    
 H   0.2671000       2.167100       1.239100    
 H   0.4293000       2.612800     -0.5025000    
 H    4.476200     -0.8174000       2.366100    
 H    3.753200      -2.221900       1.575000    
 H    4.105300     -0.8625000      -2.503000    
 H    5.205800      0.2890000      -1.738800    
 H    6.187600     -0.5978000      0.7201000    
 H    6.081600      -2.329500       1.022000    
 H    4.703000      -2.630400      -1.018500    
 H    6.230900      -1.852400      -1.419800    


%chk=000176815-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000176815

0 1
O -0.647740 0.691875 0.224603
O -2.125524 2.120479 1.339821
O 1.957975 -0.256686 2.413738
O 2.105547 1.737239 -1.844273
N 1.701598 0.938189 0.366024
C -4.183029 -0.080952 1.143339
C -4.362462 0.698505 -0.160907
C -2.952694 0.110641 0.219688
C -4.964890 -1.393333 1.000509
C -5.175658 -0.189115 -1.052855
C -5.493951 -1.369006 -0.440070
C -1.926694 1.076210 0.666267
C -6.242507 -2.536440 -1.028683
C 0.464066 1.609537 0.638899
C 3.539408 -0.508508 0.508431
C 3.585280 0.075213 -0.728684
C 4.546062 -1.492755 1.030200
C 4.637212 -0.194964 -1.765582
C 5.809764 -1.484545 0.127525
C 5.443208 -1.465349 -1.380673
C 2.342892 0.013894 1.251729
C 2.419254 1.011689 -0.871129
H -4.143223 0.441462 2.102056
H -4.443087 1.788021 -0.182315
H -2.594413 -0.739687 -0.365319
H -5.804899 -1.429823 1.724299
H -4.340539 -2.287428 1.197330
H -5.442938 0.078772 -2.079221
H -6.591637 -2.323094 -2.053628
H -7.125709 -2.796853 -0.412315
H -5.607653 -3.443802 -1.067920
H 0.364755 1.823434 1.715355
H 0.397806 2.532070 0.039792
H 4.800835 -1.258577 2.081205
H 4.092095 -2.504832 1.052934
H 4.171227 -0.301743 -2.763517
H 5.310581 0.683261 -1.844438
H 6.419250 -0.589738 0.363330
H 6.433420 -2.368669 0.353663
H 4.839697 -2.364016 -1.617113
H 6.361215 -1.522476 -1.993695


