%chk=000103144.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000103144

0 1
 O    5.668000     -0.9525000      -2.813600    
 O    5.836100       1.405700       2.507400    
 O    1.977600      -2.503100     -0.7907000    
 O   -7.473900       2.655600     -4.3000001E-02
 O   -7.515700      0.4632000      5.9599999E-02
 N    4.809500       1.389000     -0.1158000    
 N   0.6346000      -1.023700      0.4395000    
 N  -0.7597000       1.452700      0.4794000    
 N   -1.307900       1.411300     -0.6460000    
 N   -6.890100       1.544900     -5.5300001E-02
 C    3.407100       1.399000      3.5599999E-02
 C    5.470500      0.2682000     -0.7545000    
 C    5.608900       2.492600      0.3776000    
 C    2.710700      0.1972000      0.1633000    
 C    1.323700      0.2072000      0.3113000    
 C    2.716800       2.610900      5.6499999E-02
 C    4.986700      0.1274000      -2.187600    
 C    5.444400       2.621500       1.882300    
 C   0.6333000       1.419200      0.3320000    
 C    1.330000       2.621000      0.2045000    
 C   0.9755000      -2.274500     -9.4099998E-02
 C   4.9100000E-02  -3.359200      0.1887000    
 C  -4.9899999E-02  -4.438600     -0.6894000    
 C  -0.7402000      -3.320700       1.338200    
 C   -2.705200       1.444700     -0.4986000    
 C  -0.9382000      -5.479200     -0.4182000    
 C   -1.628500      -4.361500       1.609400    
 C   -1.727400      -5.440800      0.7312000    
 C   -3.375700       2.667800     -0.4810000    
 C   -3.421400      0.2547000     -0.3690000    
 C   -5.478500       1.511100     -0.2040000    
 C   -4.762300       2.701000     -0.3338000    
 C   -4.808100      0.2879000     -0.2218000    
 H    5.334300     -0.6646000     -0.1946000    
 H    6.559500      0.4061000     -0.7729000    
 H    5.361900       3.431400     -0.1297000    
 H    6.670200       2.313900      0.1650000    
 H    3.248000     -0.7431000      0.2063000    
 H    3.216200       3.567700     -5.7900000E-02
 H    3.915300     -7.8199998E-02  -2.256700    
 H    5.195300       1.040300      -2.756500    
 H    6.093300       3.420500       2.256100    
 H    4.420100       2.852400       2.186600    
 H   0.8010000       3.570500      0.2161000    
 H  -0.3187000     -0.9132000      0.7778000    
 H    5.345400      -1.001300      -3.729600    
 H    5.737300       1.533100       3.466400    
 H   0.5517000      -4.486600      -1.593300    
 H  -0.6731000      -2.514800       2.063500    
 H   -1.016200      -6.319200      -1.102300    
 H   -2.238500      -4.335300       2.507700    
 H   -2.418100      -6.251700      0.9431000    
 H   -2.825900       3.599900     -0.5819000    
 H   -2.907100     -0.7030000     -0.3817000    
 H   -5.250900       3.671900     -0.3248000    
 H   -5.333100     -0.6589000     -0.1235000    


%chk=000103144-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000103144

0 1
O 6.795152 -1.663434 -0.975792
O 6.753968 2.750768 1.456186
O 2.276834 -2.787849 0.126173
O -7.804414 0.322198 -0.386697
O -8.003936 2.572770 -0.047650
N 4.755782 1.394327 -0.309674
N 0.577187 -1.174261 0.155534
N -0.874803 1.025738 -0.086262
N -1.626819 2.114960 -0.141150
N -7.295362 1.500853 -0.210696
C 3.369649 1.335865 -0.249463
C 5.597945 0.198349 -0.072804
C 5.470517 2.658544 -0.574280
C 2.706923 0.079238 -0.072050
C 1.306173 0.015013 -0.016284
C 2.564920 2.532547 -0.364395
C 5.789130 -0.657661 -1.341238
C 5.747613 3.494920 0.686422
C 0.504551 1.215618 -0.139481
C 1.176265 2.462340 -0.309243
C 1.047523 -2.482472 0.254623
C -0.006033 -3.528185 0.510737
C 0.347440 -4.879562 0.261832
C -1.304379 -3.231541 1.007521
C -3.024251 1.865034 -0.155796
C -0.583292 -5.914630 0.483337
C -2.233697 -4.269819 1.233554
C -1.878851 -5.612527 0.966122
C -3.636658 0.588606 -0.358722
C -3.849706 3.015972 0.010795
C -5.827798 1.628267 -0.192393
C -5.032509 0.469329 -0.376841
C -5.248159 2.905304 -0.000130
H 5.169962 -0.423486 0.731404
H 6.583807 0.541241 0.279136
H 4.914257 3.268030 -1.307938
H 6.445030 2.413329 -1.032699
H 3.256297 -0.857548 0.007237
H 3.036315 3.510799 -0.486291
H 4.832464 -1.126945 -1.645668
H 6.155663 -0.022927 -2.176347
H 6.137820 4.489845 0.380745
H 4.814266 3.635920 1.268760
H 0.561553 3.363586 -0.392876
H -0.437130 -0.989902 0.164293
H 6.718414 -2.448837 -1.571039
H 6.875673 3.158848 2.348624
H 1.359889 -5.089245 -0.098113
H -1.594962 -2.204777 1.261975
H -0.301679 -6.953977 0.282844
H -3.228434 -4.033289 1.626301
H -2.602824 -6.415923 1.140970
H -3.000584 -0.286689 -0.517013
H -3.358683 3.983788 0.150829
H -5.527973 -0.492265 -0.535981
H -5.898348 3.773606 0.132352


