%chk=000003423.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000003423

0 1
 O  -0.4876000       1.073600       2.926000    
 O  -0.6166000      0.6549000      -2.042800    
 O   -1.035400       2.856100      -1.515800    
 N    2.795000       1.686000      0.3819000    
 C   0.7159000       1.274900      0.9042000    
 C    1.975500       1.280800       1.403100    
 C   0.7277000       1.674800     -0.4294000    
 C    2.045500       1.929100     -0.7393000    
 C   -1.628500      0.2829000       1.066100    
 C   -1.732900      -1.101600      0.9311000    
 C  -0.4674000      0.8925000       1.700000    
 C  -0.6568000      -2.009400       1.431400    
 C    2.526100      0.9522000       2.732600    
 C   0.4175000      -2.308200      0.4067000    
 C   -2.646700       1.108700      0.5896000    
 C    2.680400       2.381500      -1.992700    
 C   -2.855400      -1.660000      0.3195000    
 C  -0.3680000       1.814500      -1.346800    
 C   -3.769100      0.5502000     -2.2000000E-02
 C   -3.873500     -0.8341000     -0.1571000    
 C   4.5400001E-02  -2.625300     -0.8878000    
 C    1.746500      -2.256900      0.7879000    
 C    1.034800      -2.900200      -1.831800    
 C    2.735800      -2.531700     -0.1563000    
 C    2.379900      -2.853400      -1.466100    
 C   -1.688100      0.6683000      -2.992200    
 H    3.798700       1.789400      0.4464000    
 H   -1.096600      -2.968400       1.740400    
 H  -0.2159000      -1.609000       2.352700    
 H    2.381800       1.790700       3.421400    
 H    2.036300      7.1500003E-02   3.159000    
 H    3.598800      0.7371000       2.682300    
 H   -2.586800       2.188200      0.7022000    
 H    3.741900       2.611700      -1.854200    
 H    2.601300       1.605200      -2.760700    
 H    2.189800       3.285400      -2.368200    
 H   -2.959700      -2.736900      0.2154000    
 H   -4.563000       1.193100     -0.3904000    
 H   -4.748500      -1.268800     -0.6311000    
 H  -0.9868000      -2.693900      -1.208500    
 H    2.035200      -2.019000       1.806700    
 H   0.7579000      -3.154800      -2.850800    
 H    3.783200      -2.496700      0.1289000    
 H    3.150200      -3.068200      -2.200900    
 H   -2.531200       1.276800      -2.654000    
 H   -2.033300     -0.3602000      -3.127500    
 H   -1.312800       1.043400      -3.948200    


%chk=000003423-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000003423

0 1
O 0.925421 -0.237753 2.282999
O 0.320592 0.072856 -1.686888
O 0.290105 2.020519 -2.966108
N 2.316178 3.434731 0.617369
C 1.073274 1.556878 0.718142
C 1.873959 2.430826 1.482008
C 1.070423 2.065072 -0.653275
C 1.848931 3.237872 -0.683201
C -1.065257 0.107877 0.938880
C -1.651593 -1.194638 1.063634
C 0.359279 0.408145 1.335703
C -0.870101 -2.447263 1.478277
C 2.238342 2.436407 2.937239
C -0.125027 -3.115191 0.317894
C -1.877077 1.197999 0.519649
C 2.231119 4.152250 -1.809752
C -3.026638 -1.340303 0.751968
C 0.521336 1.440888 -1.868577
C -3.243332 1.030998 0.218806
C -3.823249 -0.251254 0.334440
C -0.818141 -3.931491 -0.614160
C 1.274021 -2.942967 0.156596
C -0.135104 -4.560941 -1.679605
C 1.960124 -3.567562 -0.910091
C 1.259989 -4.379328 -1.832469
C -0.261735 -0.658518 -2.834230
H 2.906578 4.216309 0.902148
H -1.595034 -3.170216 1.897593
H -0.154650 -2.184582 2.271682
H 1.571170 1.762520 3.495320
H 3.265950 2.056140 3.094982
H 2.177906 3.452355 3.372039
H -1.428151 2.193916 0.445771
H 1.893219 5.190043 -1.622551
H 3.326871 4.177422 -1.965874
H 1.748604 3.803968 -2.735323
H -3.483273 -2.332946 0.849896
H -3.846465 1.889547 -0.095618
H -4.885136 -0.402482 0.109551
H -1.899400 -4.081009 -0.500802
H 1.820140 -2.315028 0.869063
H -0.686160 -5.196446 -2.382751
H 3.041147 -3.422699 -1.018810
H 1.793736 -4.868978 -2.655037
H -1.264268 -0.260615 -3.067330
H -0.314764 -1.702536 -2.497755
H 0.386642 -0.553991 -3.720542


