%chk=000020760.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000020760

0 1
 O   0.4201000      -2.138200     -0.2160000    
 O    1.024300       2.461300      0.2438000    
 O   -4.728000      -1.914500     -0.1586000    
 O   -5.760700      0.1042000     -3.0000001E-04
 N    1.230400      9.5299996E-02  8.8999998E-03
 C   -1.017000     -0.3057000     -2.4100000E-02
 C  -0.8379000       1.059300      8.1200004E-02
 C   0.3000000     -0.9342000     -7.8100003E-02
 C   0.5969000       1.328800      0.1102000    
 C    2.651700     -9.0200000E-02 -3.8000001E-03
 C   -2.274000     -0.8757000     -7.1500003E-02
 C   -1.905600       1.932500      0.1499000    
 C   -3.371100     -1.2500000E-02 -4.9000001E-03
 C   -3.188500       1.379900      0.1051000    
 C    3.484000      0.9030000     -0.5258000    
 C    3.210900      -1.264400      0.5062000    
 C    4.867200      0.7231000     -0.5379000    
 C    4.594100      -1.444200      0.4941000    
 C   -4.719000     -0.5576000     -5.0400000E-02
 C    5.422200     -0.4505000     -2.8000001E-02
 H   -2.370100      -1.952100     -0.1575000    
 H   -1.765000       3.003800      0.2354000    
 H   -4.044500       2.048800      0.1572000    
 H    3.085800       1.816700     -0.9563000    
 H    2.599500      -2.046600      0.9457000    
 H    5.512000       1.493900     -0.9500000    
 H    5.027300      -2.355200      0.8967000    
 H    6.499100     -0.5906000     -3.7300002E-02
 H   -5.641000      -2.272100     -0.1891000    


%chk=000020760-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000020760

0 1
O 0.573756 -2.192839 -0.257588
O 1.162601 2.477373 0.297343
O -4.875347 -1.929732 -0.237609
O -5.863265 0.160658 -0.001934
N 1.271208 0.091587 0.017835
C -1.035808 -0.328000 -0.038435
C -0.858636 1.064296 0.123948
C 0.308939 -0.977949 -0.110009
C 0.607015 1.362346 0.162157
C 2.700213 -0.088216 -0.000360
C -2.309777 -0.903818 -0.110003
C -1.952657 1.938231 0.223049
C -3.426943 -0.028131 -0.012010
C -3.247561 1.373525 0.152863
C 3.526381 0.884246 -0.617575
C 3.274545 -1.237557 0.598187
C 4.925381 0.703195 -0.627898
C 4.674269 -1.410873 0.569764
C -4.826653 -0.539938 -0.077177
C 5.505907 -0.443324 -0.038982
H -2.449968 -1.980289 -0.235386
H -1.801008 3.014195 0.348756
H -4.141672 2.001384 0.222978
H 3.083869 1.774066 -1.070706
H 2.636874 -1.990450 1.066617
H 5.560390 1.459442 -1.101574
H 5.113485 -2.303018 1.028750
H 6.592392 -0.580921 -0.054036
H -5.824830 -2.223188 -0.276165


