%chk=000093693.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000093693

0 1
 O  -0.1672000      -2.420500      8.7300003E-02
 O   -1.841200      -3.055900      -1.379200    
 N   -4.669400       1.418500     -0.2762000    
 N    5.053600       1.061000     -0.5140000    
 C   0.1058000      -1.313800      0.9940000    
 C   -1.077100     -0.4429000      0.7919000    
 C   -1.932400      -1.025100     -0.1236000    
 C    1.398500     -0.6932000      0.6003000    
 C   -1.402900      0.7668000       1.380500    
 C   -1.359600      -2.283700     -0.5742000    
 C   -3.127400     -0.4436000     -0.5055000    
 C   -3.460900      0.7796000      7.6899998E-02
 C   -2.604700       1.380800       1.014800    
 C    2.470500     -0.6757000       1.495900    
 C    1.546400     -0.1250000     -0.6673000    
 C    3.827100      0.4732000     -0.1401000    
 C    3.682900     -9.3300000E-02   1.126300    
 C    2.758900      0.4572000      -1.037000    
 C   -5.359100       2.260600      0.6797000    
 C   -5.226300       1.250500      -1.602900    
 C    6.300900      0.5696000      3.6899999E-02
 C    5.083600       2.154800      -1.464500    
 H   0.1195000      -1.720600       2.011400    
 H  -0.7453000       1.233800       2.106000    
 H   -3.769500     -0.9432000      -1.222300    
 H   -2.844500       2.337800       1.470600    
 H    2.372000      -1.110800       2.487000    
 H   0.7341000     -0.1316000      -1.389100    
 H    4.490700     -8.7099999E-02   1.852600    
 H    2.842100      0.8772000      -2.035400    
 H   -6.409300       2.398000      0.3986000    
 H   -5.357900       1.816300       1.681600    
 H   -4.898800       3.253100      0.7263000    
 H   -5.750600      0.2927000      -1.685600    
 H   -5.948900       2.042000      -1.831600    
 H   -4.449000       1.301600      -2.373800    
 H    6.460700      0.9623000       1.046600    
 H    7.154000      0.8816000     -0.5760000    
 H    6.321200     -0.5256000      7.0000000E-02
 H    6.026300       2.709500      -1.398400    
 H    4.280800       2.875700      -1.272600    
 H    4.993000       1.780700      -2.489700    


%chk=000093693-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000093693

0 1
O -0.166094 -2.435814 -0.176223
O -1.913030 -3.096933 -1.584877
N -4.879235 1.392060 -0.219426
N 5.263884 1.077927 -0.403354
C 0.114998 -1.281520 0.791547
C -1.123447 -0.413337 0.650116
C -2.030625 -1.008345 -0.248448
C 1.447450 -0.641072 0.483924
C -1.467182 0.806508 1.260448
C -1.447019 -2.273005 -0.774038
C -3.277534 -0.447523 -0.564567
C -3.647912 0.789070 0.053482
C -2.713044 1.397129 0.964339
C 2.588331 -0.949447 1.263770
C 1.611540 0.257060 -0.601349
C 4.017348 0.516014 -0.111128
C 3.847433 -0.388115 0.986046
C 2.860311 0.824840 -0.899847
C -5.242669 2.657969 0.427305
C -5.815276 0.747757 -1.149728
C 6.434790 0.729368 0.410168
C 5.412541 1.986184 -1.547066
H 0.158988 -1.769810 1.784524
H -0.779122 1.305716 1.951404
H -3.929681 -0.965965 -1.271920
H -2.966558 2.346008 1.444997
H 2.492463 -1.648867 2.104479
H 0.746403 0.513468 -1.224284
H 4.698195 -0.656753 1.618171
H 2.939898 1.507553 -1.750258
H -6.243757 2.967087 0.088228
H -5.273280 2.565216 1.532602
H -4.532767 3.471833 0.172935
H -6.114193 -0.261276 -0.799640
H -6.726308 1.360348 -1.237089
H -5.378929 0.639303 -2.163652
H 6.297372 1.016135 1.472860
H 7.319112 1.263270 0.028098
H 6.652862 -0.357980 0.376719
H 6.459061 2.323097 -1.613296
H 4.772715 2.886413 -1.444231
H 5.152566 1.491727 -2.505541


