%chk=000022156.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000022156

0 1
 O   -1.916900       2.144000     -0.1121000    
 O   -3.915400      0.3542000     -0.2001000    
 N    1.600800      -2.933000     -0.2568000    
 C    1.446900      -1.522300      0.1847000    
 C   9.1000004E-03  -1.008500      5.3300001E-02
 C    2.386100     -0.5776000     -0.5993000    
 C   -1.062100      -1.920000     -2.4400000E-02
 C   0.5893000      -3.776000      0.4004000    
 C  -0.2363000      0.3883000      7.5599998E-02
 C  -0.8062000      -3.400000     -8.9000002E-02
 C    2.197700      0.8626000     -0.1778000    
 C   0.9061000       1.327600      0.1516000    
 C   -1.570300      0.8259000     -1.0100000E-02
 C   -2.375000      -1.447100     -0.1103000    
 C    2.934200      -3.466200      4.2199999E-02
 C   -2.627100     -8.0899999E-02 -9.9799998E-02
 C    3.299300       1.732000     -0.1580000    
 C   0.7752000       2.672700      0.5413000    
 C    3.139200       3.061100      0.2207000    
 C    1.879400       3.529300      0.5756000    
 C   -2.026300       2.680800      -1.426700    
 C   -4.627700      0.5530000       1.018800    
 H    1.693000      -1.456400       1.256100    
 H    2.199500     -0.6478000      -1.679200    
 H    3.431700     -0.8531000     -0.4242000    
 H   0.6511000      -3.679800       1.493000    
 H   0.7521000      -4.834300      0.1605000    
 H   -1.547700      -3.933800      0.5175000    
 H  -0.9311000      -3.724100      -1.130200    
 H   -3.201600      -2.149000     -0.1934000    
 H    3.188100      -3.373800       1.104200    
 H    3.707000      -2.967900     -0.5501000    
 H    2.995800      -4.526000     -0.2319000    
 H    4.288300       1.374000     -0.4321000    
 H  -0.1601000       3.095200      0.8902000    
 H    3.995600       3.728100      0.2445000    
 H    1.753600       4.561400      0.8904000    
 H   -1.122300       2.482800      -2.011800    
 H   -2.155900       3.763400      -1.343900    
 H   -2.899100       2.265900      -1.940100    
 H   -4.714100     -0.3887000       1.570100    
 H   -5.632400      0.9087000      0.7745000    
 H   -4.130700       1.306600       1.637900    


%chk=000022156-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000022156

0 1
O -1.906927 2.152160 -0.061113
O -3.993881 0.227447 -0.266191
N 1.678900 -2.964878 -0.191860
C 1.494603 -1.530998 0.159034
C 0.032723 -1.075850 0.045500
C 2.348358 -0.600984 -0.735083
C -1.021796 -2.009663 -0.093755
C 0.645923 -3.818645 0.445158
C -0.233248 0.335351 0.078040
C -0.728337 -3.498947 -0.156088
C 2.202665 0.829091 -0.246949
C 0.916037 1.281707 0.184247
C -1.586196 0.769580 -0.039908
C -2.357349 -1.551759 -0.169456
C 3.040572 -3.449832 0.120007
C -2.643731 -0.178102 -0.133553
C 3.314501 1.697338 -0.182944
C 0.799733 2.600272 0.706399
C 3.181867 3.013338 0.314223
C 1.919524 3.456456 0.769755
C -2.369181 2.637064 -1.383743
C -4.546720 0.955423 0.898526
H 1.820058 -1.357625 1.223940
H 1.993808 -0.713587 -1.779701
H 3.412361 -0.891949 -0.713735
H 0.619202 -3.676239 1.556945
H 0.905459 -4.876012 0.254344
H -1.517919 -4.066073 0.373339
H -0.736401 -3.833586 -1.211927
H -3.191356 -2.256609 -0.255509
H 3.311008 -3.331143 1.200518
H 3.795812 -2.917364 -0.481126
H 3.109776 -4.521592 -0.135834
H 4.294154 1.334565 -0.517627
H -0.174012 2.949400 1.053669
H 4.053069 3.676604 0.359941
H 1.805686 4.467196 1.177730
H -1.562884 2.523579 -2.132171
H -2.602300 3.703786 -1.242318
H -3.270043 2.082563 -1.702927
H -4.549581 0.299301 1.790111
H -5.580575 1.210900 0.619359
H -3.962560 1.869618 1.104533


