%chk=000097138.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000097138

0 1
 O    2.699400      -2.679100     -3.5300002E-02
 O    4.387700       1.700400      9.4300002E-02
 N   3.1000001E-03  -1.403900     -0.1350000    
 N  -0.3012000      0.8045000     -0.1185000    
 N    2.081000       1.413200     -8.5000005E-03
 N    3.572700     -0.4946000      3.0099999E-02
 C   -3.269400      0.4746000     -0.8762000    
 C   -4.246700      0.1771000       1.106200    
 C   -2.392800     -0.6269000     -0.2250000    
 C   -3.680300       1.350700      0.3128000    
 C   -3.025800     -0.7578000       1.181600    
 C   -4.627500     -0.1575000      -1.246500    
 C   -5.276900     -0.4047000      0.1237000    
 C  -0.8966000     -0.3697000     -0.1594000    
 C    1.248400     -0.8471000     -7.4900001E-02
 C    1.033500      0.5040000     -6.5899998E-02
 C    2.535100      -1.462600     -2.7600000E-02
 C    3.415600      0.9385000      4.1999999E-02
 C    1.801500       2.843900     -8.9999998E-04
 C    4.939200      -1.003000      8.2999997E-02
 H   -2.794300       1.003800      -1.705200    
 H   -4.664700      0.4264000       2.083500    
 H   -2.527600      -1.568200     -0.7758000    
 H   -4.433300       2.103200      5.5300001E-02
 H   -2.832700       1.837000      0.8063000    
 H   -3.313000      -1.791800       1.400400    
 H   -2.341200     -0.4227000       1.970300    
 H   -4.524300      -1.079400      -1.827300    
 H   -5.234300      0.5445000      -1.829900    
 H   -6.229100      0.1335000      0.1904000    
 H   -5.471100      -1.467100      0.3016000    
 H  -0.2149000      -2.391600     -0.1557000    
 H    2.721200       3.432300      4.7100000E-02
 H    1.184600       3.081000      0.8714000    
 H    1.262100       3.105700     -0.9164000    
 H    4.986000      -2.094200      6.8700001E-02
 H    5.414300     -0.6329000      0.9971000    
 H    5.492900     -0.6064000     -0.7741000    


%chk=000097138-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000097138

0 1
O 2.760739 -2.455958 -1.169103
O 4.382125 1.645378 0.525124
N -0.044736 -1.406090 -0.332453
N -0.329757 0.624956 0.641846
N 2.066716 1.274454 0.638050
N 3.553923 -0.382004 -0.312758
C -3.176268 -0.222098 -1.062461
C -4.270365 0.826996 0.641675
C -2.438027 -0.765318 0.225049
C -3.504390 1.239371 -0.648281
C -3.183947 -0.002646 1.386958
C -4.592403 -0.872345 -1.096549
C -5.349489 -0.146879 0.079863
C -0.959544 -0.505479 0.201724
C 1.228179 -0.835038 -0.236490
C 1.015457 0.411553 0.368084
C 2.518026 -1.334873 -0.623471
C 3.389973 0.895144 0.299444
C 1.822459 2.579886 1.280140
C 4.948061 -0.745832 -0.654698
H -2.595757 -0.354068 -1.990726
H -4.680849 1.651739 1.246640
H -2.593139 -1.859952 0.297525
H -4.140952 1.758085 -1.387443
H -2.605897 1.846109 -0.442487
H -3.617323 -0.699285 2.126118
H -2.474310 0.663111 1.906492
H -4.550227 -1.969163 -0.963617
H -5.080934 -0.675823 -2.068040
H -6.227878 0.409295 -0.294924
H -5.706763 -0.851644 0.852251
H -0.241171 -2.326920 -0.724508
H 2.795119 3.079282 1.397014
H 1.347846 2.434344 2.265055
H 1.152962 3.191932 0.652712
H 4.921533 -1.746894 -1.109660
H 5.572325 -0.749288 0.253650
H 5.369284 -0.010943 -1.360046


