%chk=000150236.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000150236

0 1
 O    1.033900      0.1193000       1.582900    
 O    7.927300      -2.307200      -1.191700    
 N   -1.225300     -0.5577000      0.4379000    
 N    2.160800       1.768200      0.4048000    
 N    5.435200      2.7999999E-03  0.2214000    
 N   -4.864200      0.9306000      -1.015300    
 C   -2.548000       1.293600     -0.3445000    
 C   -1.347500      0.7514000      0.1448000    
 C   -3.630200      0.4259000     -0.5224000    
 C  -0.2663000       1.610100      0.3238000    
 C   -3.508800     -0.9341000     -0.2197000    
 C   -2.270900      -1.389100      0.2648000    
 C    3.494300       1.373900      0.7986000    
 C   -2.641800       2.664600     -0.6406000    
 C    4.081400      0.3651000     -0.1777000    
 C    1.005900       1.105400      0.8294000    
 C  -0.3561000       2.973100      3.0700000E-02
 C   -1.546200       3.501900     -0.4527000    
 C   -4.580000      -1.828600     -0.3889000    
 C   -2.143800      -2.742100      0.5679000    
 C    6.013900     -0.9549000     -0.7108000    
 C   -4.426900      -3.176600     -7.8500003E-02
 C   -3.206100      -3.633900      0.4009000    
 C    7.409400      -1.361800     -0.2651000    
 H    4.101800       2.285400      0.8275000    
 H    3.456700      0.9578000       1.811900    
 H    3.441500     -0.5257000     -0.2126000    
 H    4.087800      0.8013000      -1.184500    
 H   -3.545000       3.132100      -1.017900    
 H   0.4655000       3.663100      0.1993000    
 H    2.098100       2.521400     -0.2719000    
 H   -1.623800       4.562000     -0.6741000    
 H   -5.554300      -1.528100     -0.7590000    
 H   -1.197000      -3.124700      0.9451000    
 H    5.422300     -0.3939000       1.160700    
 H    6.069700     -0.5242000      -1.718300    
 H    5.388200      -1.853200     -0.7884000    
 H   -4.984400       1.904800      -1.245400    
 H   -5.664000      0.3327000      -1.154200    
 H   -5.255300      -3.866100     -0.2099000    
 H   -3.076000      -4.683900      0.6462000    
 H    7.389600      -1.833900      0.7224000    
 H    8.089300     -0.5042000     -0.2247000    
 H    7.976000      -1.871700      -2.059800    


%chk=000150236-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000150236

0 1
O 2.091030 2.864979 0.277351
O 8.249029 -2.154946 1.162941
N -0.928933 -0.028132 -0.643316
N 1.607648 0.775187 -0.643158
N 5.180071 -0.393882 -0.191271
N -5.004901 0.791414 0.272847
C -2.655072 1.488790 0.285990
C -1.273700 1.162753 -0.049889
C -3.683198 0.526072 -0.020746
C -0.233073 2.134279 0.255124
C -3.314024 -0.719962 -0.639423
C -1.909285 -0.941662 -0.928972
C 3.003341 0.486035 -0.978400
C -2.948347 2.747598 0.906891
C 3.766538 -0.182694 0.190772
C 1.250032 1.951557 -0.032785
C -0.582672 3.344400 0.862284
C -1.933302 3.658733 1.190918
C -4.259351 -1.745854 -0.980906
C -1.517550 -2.179712 -1.547248
C 5.988064 -1.154558 0.784732
C -3.848379 -2.935944 -1.579098
C -2.460075 -3.153520 -1.865176
C 7.382331 -1.455372 0.200876
H 3.042209 -0.173894 -1.863067
H 3.502077 1.441394 -1.230924
H 3.640643 0.449389 1.100933
H 3.315654 -1.170372 0.409035
H -3.977128 3.019126 1.173400
H 0.233376 4.043792 1.074398
H 0.812990 0.116158 -0.830596
H -2.168597 4.616447 1.666180
H -5.329259 -1.615127 -0.776326
H -0.452860 -2.323036 -1.756684
H 5.631099 0.501768 -0.429187
H 5.462157 -2.111109 0.987194
H 6.114493 -0.640738 1.768336
H -5.284709 1.665732 0.705758
H -5.734960 0.119615 0.058061
H -4.583227 -3.707275 -1.832105
H -2.145183 -4.091117 -2.336006
H 7.923121 -0.517516 -0.016977
H 7.273017 -2.023820 -0.745352
H 7.845565 -3.034073 1.375990


