%chk=000005897.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000005897

0 1
 O    3.999400      -1.661000     -3.1999999E-03
 N    3.449000      0.6313000      1.0000000E-03
 C  -0.9969000      -1.689700       0.000000    
 C  -2.5000000E-02 -0.5281000     -7.9999998E-04
 C  -0.7228000      0.7006000     -1.0000000E-03
 C   -2.332000     -0.9751000     -9.9999997E-05
 C   -2.143500      0.4253000     -6.9999998E-04
 C    1.358100     -0.5742000     -6.9999998E-04
 C  -3.3000000E-02   1.901400     -1.0000000E-03
 C   -3.597900      -1.534300      1.0000000E-03
 C   -3.232000       1.281700     -1.9999999E-04
 C    2.053100      0.6365000     -5.0000002E-04
 C    1.364700       1.861900     -3.9999999E-04
 C   -4.694800     -0.6708000      1.5000000E-03
 C   -4.513800      0.7230000      7.9999998E-04
 C    4.309400     -0.4741000      1.2000001E-03
 C    5.758000     -5.4499999E-02  3.0000000E-03
 H  -0.8799000      -2.292100      0.9054000    
 H  -0.8802000      -2.293000     -0.9049000    
 H    1.816200      -1.551500      9.9999997E-05
 H  -0.5505000       2.854900     -8.9999998E-04
 H   -3.739100      -2.609300      1.6000000E-03
 H   -3.108200       2.359400     -3.9999999E-04
 H    1.915300       2.800200      9.9999997E-05
 H   -5.701900      -1.079500      2.3000001E-03
 H   -5.383700       1.374700      1.3000000E-03
 H    3.886800       1.550300      2.0999999E-03
 H    5.978200      0.5168000     -0.9031000    
 H    6.400200     -0.9391000      3.0600000E-02
 H    5.965100      0.5610000      0.8829000    


%chk=000005897-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000005897

0 1
O 4.085736 -1.655973 0.004607
N 3.508653 0.622155 0.003245
C -1.056210 -1.719778 0.000273
C -0.051964 -0.572667 0.001065
C -0.743651 0.676341 0.001116
C -2.400132 -0.998833 -0.000166
C -2.194197 0.416073 0.000364
C 1.349227 -0.641921 0.001750
C -0.008981 1.882995 0.001817
C -3.701033 -1.530672 -0.000957
C -3.296748 1.300036 0.000131
C 2.083717 0.577747 0.002479
C 1.398382 1.827479 0.002522
C -4.807284 -0.642912 -0.001196
C -4.604005 0.759857 -0.000653
C 4.422869 -0.435796 0.003093
C 5.884820 0.017328 -0.000929
H -0.934816 -2.372336 0.887076
H -0.933975 -2.371823 -0.886793
H 1.889262 -1.590499 0.001973
H -0.515550 2.854303 0.001845
H -3.864639 -2.614697 -0.001374
H -3.148589 2.386043 0.000550
H 1.977674 2.760407 0.003099
H -5.827461 -1.042968 -0.001791
H -5.470176 1.431405 -0.000830
H 3.913000 1.561887 0.003246
H 6.123972 0.591300 -0.915593
H 6.526426 -0.874687 0.032398
H 6.113972 0.652904 0.874631


