%chk=000177893.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000177893

1 1
 O    5.074900      -1.720700      6.4999998E-02
 O    5.932800      0.5292000      0.1000000    
 O   -4.225100      -2.128200     -0.1677000    
 O   -6.035100     -7.3299997E-02 -0.1993000    
 N  -0.1592000      -1.358700     -6.3699998E-02
 C   0.3885000     -0.1254000     -4.2500000E-02
 C  -0.4966000      0.9903000     -5.7900000E-02
 C    1.809500      3.5799999E-02 -6.0999999E-03
 C   -1.914700      0.7666000     -9.4499998E-02
 C    2.342900       1.357900      1.4800000E-02
 C   -2.390200     -0.5609000     -0.1142000    
 C   -1.472200      -1.597800     -9.7999997E-02
 C   9.1700003E-02   2.270400     -3.5700001E-02
 C    2.728400      -1.044700      1.0500000E-02
 C    1.475200       2.449800     -3.9999999E-04
 C    3.731600       1.580200      5.0799999E-02
 C    4.085200     -0.7866000      4.6100002E-02
 C    4.573800      0.4915000      6.5399997E-02
 C   -2.895700       1.791100     -0.1125000    
 C   -3.766900     -0.8395000     -0.1495000    
 C   0.5425000      -2.641500     -5.2000001E-02
 C   -4.700200      0.1918000     -0.1658000    
 C   -4.264400       1.508400     -0.1472000    
 C    6.245200     -0.8787000      9.9399999E-02
 C   -6.701900     -0.2069000       1.054800    
 H   -1.799500      -2.629900     -0.1354000    
 H  -0.5168000       3.171100     -4.5499999E-02
 H    2.572700      -2.099900     -1.3000000E-03
 H    1.863200       3.467000      1.5200000E-02
 H    4.142900       2.585700      6.6900000E-02
 H   -2.612100       2.840300     -9.9299997E-02
 H    1.105400      -2.741500     -0.9845000    
 H    1.061600      -2.747700      0.9050000    
 H  -0.1316000      -3.506800     -6.8700001E-02
 H   -4.979600       2.326400     -0.1603000    
 H    6.863800      -1.101000     -0.7776000    
 H    6.819200      -1.111700       1.003600    
 H   -3.671700      -2.676900      0.4115000    
 H   -7.754800     -0.4290000      0.8609000    
 H   -6.639800      0.7267000       1.622800    
 H   -6.271800      -1.029300       1.635200    


%chk=000177893-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000177893

1 1
O 5.143864 -1.683559 0.662538
O 6.053336 0.453904 0.061958
O -4.307977 -1.930251 0.737125
O -6.076849 0.486777 0.594490
N -0.232206 -1.399966 -0.175226
C 0.411927 -0.131812 -0.127169
C -0.443299 1.029714 -0.170321
C 1.857158 0.005925 -0.062814
C -1.876808 0.899312 0.001227
C 2.416300 1.321184 -0.333184
C -2.426440 -0.417961 0.224401
C -1.570175 -1.527117 0.037782
C 0.165310 2.310802 -0.393214
C 2.755868 -1.055135 0.319747
C 1.536314 2.439175 -0.527227
C 3.834437 1.544557 -0.337057
C 4.116611 -0.795613 0.318084
C 4.657492 0.476714 -0.027323
C -2.796227 1.990065 -0.025537
C -3.823254 -0.623778 0.502540
C 0.460563 -2.641158 -0.658892
C -4.712103 0.470898 0.428254
C -4.158053 1.771978 0.169774
C 6.420446 -0.918290 0.519697
C -6.887308 -0.741845 0.788514
H -1.980774 -2.536818 -0.040293
H -0.463448 3.199490 -0.472544
H 2.410431 -2.024414 0.673786
H 1.975908 3.420516 -0.733451
H 4.238070 2.537255 -0.549875
H -2.452488 3.012404 -0.193699
H 1.320033 -2.367754 -1.284042
H 0.794615 -3.266436 0.184373
H -0.250767 -3.214233 -1.272752
H -4.868857 2.603789 0.149841
H 7.042503 -1.400156 -0.250498
H 6.908812 -0.849387 1.504463
H -3.848401 -2.362771 1.500817
H -7.923112 -0.375256 0.765883
H -6.663562 -1.205194 1.762454
H -6.706787 -1.461954 -0.024332


