%chk=000019104.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000019104

0 1
 O   -2.618100      0.2026000       2.092200    
 O   -7.978600     -0.6751000      -1.088000    
 N    1.314200      0.1797000      0.2248000    
 C    1.822700      -1.124200     -0.2113000    
 C  -0.1235000      0.2908000     -1.2600000E-02
 C    3.294900      -1.274100      0.2018000    
 C    2.038500       1.270400     -0.4457000    
 C    4.134300     -6.8599999E-02 -0.1559000    
 C  -0.6506000       1.614500      0.5450000    
 C    3.534000       1.098900     -0.4544000    
 C   -2.156800       1.779100      0.3240000    
 C    5.609600     -0.2146000     -0.1591000    
 C   -2.991900      0.7331000       1.049000    
 C    6.389300      0.5634000      -1.018300    
 C    6.225600      -1.130600      0.6968000    
 C   -4.317900      0.3586000      0.4801000    
 C    7.777400      0.4259000      -1.021600    
 C    7.613800      -1.267900      0.6934000    
 C    8.389600     -0.4896000     -0.1659000    
 C   -5.022600       1.303300     -0.2318000    
 C   -4.789300     -0.9186000      0.6878000    
 C   -6.263600      0.9527000     -0.7637000    
 C   -6.030100      -1.269300      0.1558000    
 C   -6.767300     -0.3336000     -0.5700000    
 C   -8.433600      -2.006800     -0.8526000    
 H    1.253800      -1.935900      0.2587000    
 H    1.720700      -1.242800      -1.298500    
 H  -0.6325000     -0.5407000      0.4882000    
 H  -0.3565000      0.2135000      -1.082600    
 H    3.343200      -1.435600       1.286500    
 H    3.691200      -2.173100     -0.2864000    
 H    1.861100       2.211200      8.6400002E-02
 H    1.706700       1.396900      -1.484300    
 H  -0.1831000       2.473500      5.2900001E-02
 H  -0.4234000       1.686900       1.616000    
 H    4.102300       1.988500     -0.7095000    
 H   -2.469200       2.764300      0.6886000    
 H   -2.355600       1.729500     -0.7525000    
 H    5.950400       1.270400      -1.716900    
 H    5.654200      -1.745200       1.386700    
 H    8.381600       1.027700      -1.694200    
 H    8.091200      -1.979000       1.361100    
 H    9.470200     -0.5972000     -0.1689000    
 H   -4.661300       2.315200     -0.3824000    
 H   -4.222500      -1.657500       1.246300    
 H   -6.835300       1.686800      -1.324900    
 H   -6.361000      -2.285200      0.3429000    
 H   -8.583700      -2.197800      0.2155000    
 H   -9.411700      -2.104200      -1.335100    
 H   -7.772600      -2.746000      -1.317700    


%chk=000019104-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000019104

0 1
O -2.419208 -0.881563 1.163634
O -8.599552 -0.255680 -0.617346
N 1.533728 0.131509 -0.147120
C 2.202256 -1.109859 -0.599562
C 0.092994 0.174801 -0.481517
C 3.597008 -1.232960 0.040403
C 2.269610 1.334918 -0.588037
C 4.419479 0.035357 -0.169042
C -0.686737 1.216171 0.351223
C 3.770708 1.198934 -0.468824
C -2.187810 1.256027 -0.000352
C 5.901388 -0.041251 -0.020855
C -2.983748 0.039863 0.497887
C 6.772157 0.911632 -0.625906
C 6.497370 -1.090203 0.736025
C -4.448803 -0.028078 0.195317
C 8.169799 0.831912 -0.463161
C 7.897359 -1.171680 0.901030
C 8.743585 -0.209840 0.304965
C -5.137744 0.978323 -0.542624
C -5.190751 -1.142844 0.668563
C -6.513636 0.872917 -0.795450
C -6.570440 -1.265058 0.424617
C -7.236848 -0.249384 -0.312303
C -9.405550 -1.387010 -0.142990
H 1.574555 -1.968282 -0.298584
H 2.305933 -1.145241 -1.715870
H -0.334242 -0.819999 -0.266385
H -0.067818 0.384923 -1.574942
H 3.476661 -1.431820 1.124048
H 4.123473 -2.104824 -0.395421
H 1.944783 2.202464 0.020266
H 2.017908 1.598593 -1.655471
H -0.265629 2.226998 0.189968
H -0.557378 0.965112 1.419265
H 4.334402 2.130999 -0.605008
H -2.654784 2.164396 0.432852
H -2.323343 1.345568 -1.098886
H 6.351981 1.707851 -1.250834
H 5.860660 -1.841539 1.215426
H 8.815308 1.575131 -0.945497
H 8.326628 -1.985721 1.496427
H 9.830441 -0.273744 0.428082
H -4.598663 1.851828 -0.922855
H -4.652006 -1.909997 1.235131
H -7.054288 1.638506 -1.359739
H -7.112806 -2.136286 0.803571
H -9.395760 -1.449453 0.961908
H -10.425665 -1.176998 -0.494999
H -9.048766 -2.341218 -0.575327


