%chk=000005573.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000005573

0 1
 O   0.6433000     -0.9973000     -0.2318000    
 O  -0.3780000      -2.408400      -1.736800    
 O   -5.244700      -1.549200     -0.2262000    
 O   -2.775700       2.457100      0.6621000    
 O   -5.187300       1.097000      0.5890000    
 N    4.285000      -1.616200     -1.3400000E-02
 C    3.031800     -0.9043000      0.3093000    
 C    2.729700      -1.145100       1.818100    
 C    1.910900      -1.576300     -0.5282000    
 C    3.101500      0.6024000      5.7000001E-03
 C    2.637800      -2.612000       2.234700    
 C    4.557200      -1.519800      -1.442000    
 C    5.385100      -1.063800      0.7669000    
 C    2.739300       1.077500      -1.254700    
 C    3.526300       1.493600      0.9911000    
 C    2.802000       2.443500      -1.529900    
 C    3.589000       2.859700      0.7162000    
 C    3.226900       3.334500     -0.5443000    
 C  -0.4184000      -1.510200     -0.9103000    
 C   -1.673900     -0.8239000     -0.5139000    
 C   -1.641100      0.5093000     -0.1049000    
 C   -2.886700      -1.511700     -0.5530000    
 C   -4.066800     -0.8663000     -0.1832000    
 C   -2.821100       1.154700      0.2650000    
 C   -4.033900      0.4669000      0.2257000    
 C   -5.632800      -2.247200      0.9555000    
 C   -1.496100       3.086800      0.6737000    
 C   -5.909200       1.768900     -0.4404000    
 H    1.771800     -0.6700000       2.074800    
 H    3.448400     -0.6853000       2.500800    
 H    2.039900      -1.492000      -1.609900    
 H    1.861900      -2.653100     -0.3220000    
 H    1.776700      -3.113000       1.784500    
 H    2.502400      -2.673300       3.320500    
 H    3.542400      -3.175000       1.989200    
 H    4.698600     -0.5050000      -1.822700    
 H    5.509100      -2.031500      -1.642900    
 H    3.852900      -2.067600      -2.072500    
 H    6.292100      -1.639900      0.5381000    
 H    5.635700     -2.5500000E-02  0.5291000    
 H    5.278700      -1.179600       1.847700    
 H    2.415700      0.4364000      -2.065700    
 H    3.840200       1.187900       1.981300    
 H    2.523300       2.813800      -2.512100    
 H    3.924200       3.553900       1.481400    
 H    3.277300       4.398000     -0.7590000    
 H  -0.6800000       1.010900     -0.1060000    
 H   -2.921300      -2.551600     -0.8690000    
 H   -4.894700      -3.015700       1.206500    
 H   -6.593500      -2.733600      0.7661000    
 H   -5.751400      -1.552100       1.792500    
 H  -0.8161000       2.609700       1.388000    
 H   -1.067900       3.151300     -0.3325000    
 H   -1.646900       4.114800       1.019400    
 H   -5.299400       2.561900     -0.8845000    
 H   -6.226000       1.061700      -1.213500    
 H   -6.799600       2.221000      4.9999999E-03


%chk=000005573-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000005573

0 1
O 0.713348 -1.092227 -0.131017
O -0.275899 -2.869262 -1.270739
O -5.275776 -1.746149 -0.876041
O -3.030202 2.041783 1.235000
O -5.403139 0.762710 0.442628
N 4.437532 -1.488074 0.012930
C 3.109171 -0.803080 0.278484
C 2.784569 -0.823153 1.809817
C 2.042577 -1.679008 -0.427643
C 3.113890 0.659703 -0.254495
C 2.763021 -2.221107 2.465195
C 4.848573 -1.559076 -1.411737
C 5.579598 -1.045032 0.842789
C 2.582264 0.996307 -1.528964
C 3.742174 1.702430 0.482938
C 2.666479 2.309270 -2.042723
C 3.832191 3.017034 -0.026183
C 3.293697 3.330566 -1.294400
C -0.393049 -1.790894 -0.636333
C -1.671468 -1.096625 -0.325657
C -1.686098 0.167546 0.317560
C -2.881994 -1.729750 -0.683924
C -4.115258 -1.098216 -0.421444
C -2.915667 0.801110 0.584600
C -4.149350 0.187825 0.194924
C -6.332140 -2.018156 0.124108
C -1.788095 2.682689 1.682021
C -5.642269 2.131293 -0.071792
H 1.797199 -0.341893 1.930093
H 3.502983 -0.184921 2.352712
H 2.155241 -1.727193 -1.522994
H 2.091189 -2.710192 -0.043619
H 1.890881 -2.815376 2.139951
H 2.698054 -2.124180 3.564684
H 3.672524 -2.796480 2.219040
H 5.073143 -0.563713 -1.861792
H 5.761348 -2.177887 -1.478518
H 4.078945 -2.051100 -2.027347
H 6.429834 -1.724691 0.650341
H 5.922100 -0.006017 0.620785
H 5.340765 -1.114163 1.915944
H 2.075776 0.236989 -2.132628
H 4.161855 1.500754 1.473716
H 2.238457 2.533331 -3.026617
H 4.322352 3.795445 0.570067
H 3.360641 4.349844 -1.690914
H -0.734556 0.626460 0.591820
H -2.870331 -2.704141 -1.179553
H -5.945588 -2.696232 0.909511
H -7.133610 -2.519102 -0.439735
H -6.697797 -1.081179 0.574787
H -1.250288 2.043045 2.407354
H -1.123704 2.915255 0.828046
H -2.108243 3.613928 2.171867
H -4.972989 2.853612 0.421670
H -5.495813 2.154540 -1.167779
H -6.694448 2.342500 0.171807


