%chk=000030297.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000030297

0 1
 O    1.493600     -0.6756000      0.9989000    
 O   -2.784700      -2.641300      0.2686000    
 O   -4.453000      -1.090500      -1.064900    
 N    4.771000      0.3930000     -0.3004000    
 C    3.785200     -0.4729000      0.3290000    
 C    4.911000       1.646400      0.4446000    
 C    6.066800     -0.2834000     -0.3996000    
 C    2.430100      0.2134000      0.3920000    
 C    5.887100       2.587000     -0.2417000    
 C    5.947800      -1.587900      -1.169100    
 C   0.1905000     -0.5516000      0.6261000    
 C   -2.445400     -0.3011000     -0.1291000    
 C   -4.558200       1.192500     -0.2988000    
 C   -3.871100     -0.1428000     -0.5418000    
 C   -6.057800       1.033500     -4.8099998E-02
 C   -1.982300      -1.539800      0.2530000    
 C  -0.6469000      -1.667000      0.6356000    
 C  -0.3073000      0.6911000      0.2341000    
 C   -1.642600      0.8181000     -0.1486000    
 C   -6.733800       2.378800      0.1601000    
 H    4.092300     -0.7817000       1.337400    
 H    3.626700      -1.396000     -0.2394000    
 H    3.971200       2.204100      0.4650000    
 H    5.221700       1.476400       1.483000    
 H    6.778600      0.3284000     -0.9632000    
 H    6.503900     -0.4776000      0.5881000    
 H    2.129000      0.4831000     -0.6292000    
 H    2.442600       1.103800       1.025600    
 H    6.928900       2.280600     -0.1067000    
 H    5.678400       2.678800      -1.313200    
 H    5.799600       3.588900      0.1940000    
 H    6.948400      -1.946900      -1.436400    
 H    5.388700      -1.461300      -2.102600    
 H    5.482600      -2.382700     -0.5778000    
 H   -4.386200       1.824500      -1.177300    
 H   -4.115800       1.680300      0.5771000    
 H   -6.529400      0.5249000     -0.8973000    
 H   -6.222100      0.3991000      0.8309000    
 H  -0.2579000      -2.635200      0.9410000    
 H   0.3031000       1.589200      0.2345000    
 H   -1.999200       1.793800     -0.4623000    
 H   -6.311400       2.900400       1.024900    
 H   -7.805200       2.241400      0.3367000    
 H   -6.613700       3.018700     -0.7200000    
 H   -3.705300      -2.396600      8.4700003E-02


%chk=000030297-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000030297

0 1
O 1.563763 -1.007039 0.652235
O -2.879249 -2.454170 1.564105
O -4.840853 -1.020067 0.880534
N 4.973303 0.329042 -0.081687
C 3.931257 -0.635569 0.349218
C 5.368723 1.266150 1.006136
C 6.131483 -0.312885 -0.759976
C 2.539577 -0.038283 0.104311
C 5.916701 2.606750 0.481279
C 5.799676 -0.788694 -2.186769
C 0.205141 -0.717187 0.548006
C -2.608778 -0.291636 0.424707
C -4.682073 1.130933 -0.253350
C -4.062963 -0.112359 0.379351
C -6.222687 1.155595 -0.202463
C -2.059533 -1.489086 1.031615
C -0.664701 -1.686935 1.086256
C -0.308140 0.473456 -0.056465
C -1.693912 0.662974 -0.106621
C -6.799949 2.427898 -0.857247
H 4.025667 -0.918009 1.422865
H 4.019141 -1.568707 -0.233611
H 4.468901 1.469933 1.617079
H 6.113957 0.795150 1.696072
H 6.941514 0.436085 -0.819958
H 6.533455 -1.166831 -0.158503
H 2.370528 0.105480 -0.979771
H 2.427499 0.935942 0.620791
H 6.835824 2.472622 -0.117199
H 5.164919 3.101498 -0.158142
H 6.163914 3.278324 1.324524
H 6.691440 -1.239635 -2.660696
H 5.463311 0.063421 -2.802695
H 4.999262 -1.551121 -2.192232
H -4.338703 1.201381 -1.306626
H -4.273706 2.029604 0.254099
H -6.617832 0.253282 -0.704035
H -6.553557 1.082133 0.849818
H -0.263848 -2.593133 1.545839
H 0.361562 1.227835 -0.476044
H -2.083000 1.575450 -0.570267
H -6.441862 3.342334 -0.346628
H -7.904034 2.429980 -0.812554
H -6.507308 2.501293 -1.922148
H -3.854327 -2.124897 1.424244


