%chk=000103577.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000103577

0 1
 O   0.7843000      0.3893000      0.1692000    
 O   -1.226100     -0.6589000     -0.3101000    
 O    2.928000       3.672300     -0.5671000    
 O    1.200200       2.915600      0.7524000    
 N   -5.832000      0.4083000     -0.9812000    
 C  -3.5999998E-02 -0.7505000      0.5124000    
 C   0.5959000      -2.096200      0.1813000    
 C    2.757900      -1.020000     -0.1196000    
 C    2.132300      0.2249000      1.8999999E-02
 C  -0.2769000     -0.6467000       2.005300    
 C    1.898300      -2.205100     -0.1181000    
 C   -2.415200     -0.3119000      0.2656000    
 C    4.176400      -1.086800     -0.2805000    
 C   -2.592900     -0.1685000       1.642600    
 C   -1.470600     -0.3798000       2.539400    
 C    2.873700       1.403200     -2.0300001E-02
 C    4.915100      0.1265000     -0.3088000    
 C  -0.2848000      -3.318300      0.2179000    
 C   -4.746800      0.2169000     -0.1011000    
 C   -3.491900     -0.1229000     -0.6048000    
 C    4.253100       1.353300     -0.1809000    
 C   -3.855300      0.1710000       2.143500    
 C   -4.928400      0.3643000       1.272200    
 C    4.916000      -2.289300     -0.4130000    
 C   -7.141000      0.7589000     -0.4671000    
 C   -5.649400      0.2708000      -2.412600    
 C    6.311300      0.1070000     -0.4665000    
 C    2.235500       2.707900      0.1100000    
 C    6.304800      -2.292300     -0.5685000    
 C    7.002200      -1.094300     -0.5961000    
 C   -7.855900     -0.4823000      3.1599998E-02
 C   -5.881100      -1.168000      -2.832700    
 C    2.399400       5.001700     -0.5135000    
 H   0.5727000     -0.7806000       2.671100    
 H    2.319800      -3.174100     -0.3524000    
 H   -1.608600     -0.3034000       3.611200    
 H  -0.7650000      -3.419800       1.196200    
 H   0.2811000      -4.238400      3.5900000E-02
 H   -1.063400      -3.256900     -0.5489000    
 H   -3.295900     -0.2743000      -1.660800    
 H    4.842300       2.269100     -0.1917000    
 H   -4.015500      0.2875000       3.212900    
 H   -5.875900      0.6270000       1.729200    
 H    4.424600      -3.258400     -0.3933000    
 H   -7.096300       1.539700      0.3005000    
 H   -7.754100       1.200000      -1.263500    
 H   -6.385500      0.8925000      -2.939100    
 H   -4.689400      0.6542000      -2.772800    
 H    6.879000       1.035600     -0.4897000    
 H    6.836700      -3.234300     -0.6666000    
 H    8.081100      -1.092400     -0.7167000    
 H   -7.295700      -1.019600      0.8018000    
 H   -8.052900      -1.187200     -0.7807000    
 H   -8.824500     -0.2041000      0.4603000    
 H   -5.233100      -1.864700      -2.291900    
 H   -6.917500      -1.474500      -2.667300    
 H   -5.676700      -1.281200      -3.902500    
 H    3.055300       5.652600      -1.097400    
 H    2.378800       5.357700      0.5207000    
 H    1.397000       5.026800     -0.9511000    


%chk=000103577-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000103577

0 1
O 0.842537 -0.075148 1.622545
O -0.957757 -1.329105 0.628633
O 1.967666 3.661540 0.055362
O 1.181282 2.674402 2.012218
N -4.874399 0.658384 -1.443264
C 0.034861 -1.345575 1.743792
C 0.887197 -2.571533 1.479199
C 2.463914 -1.172255 0.162657
C 1.867356 -0.000204 0.683496
C -0.610663 -1.246806 3.097783
C 1.997295 -2.450677 0.688928
C -2.172660 -0.633043 0.798097
C 3.525593 -1.059343 -0.812258
C -2.659041 -0.323205 2.099296
C -1.860861 -0.713926 3.247653
C 2.318376 1.312492 0.297319
C 3.962864 0.259281 -1.222420
C 0.386126 -3.888249 2.019895
C -4.162310 0.313360 -0.286181
C -2.892481 -0.340980 -0.368261
C 3.345082 1.411822 -0.651751
C -3.926296 0.311057 2.172710
C -4.667010 0.624161 1.024553
C 4.166864 -2.194962 -1.409816
C -6.196829 1.310742 -1.355173
C -4.376414 0.277529 -2.781456
C 5.011596 0.393455 -2.191427
C 1.751779 2.552339 0.906041
C 5.187785 -2.035925 -2.351831
C 5.619236 -0.731592 -2.749474
C -7.374987 0.349923 -1.058174
C -4.635411 -1.199369 -3.169143
C 1.492985 4.954209 0.594070
H 0.011977 -1.522003 3.953501
H 2.569419 -3.354830 0.456719
H -2.282648 -0.576658 4.250606
H 0.295111 -3.871387 3.122821
H 1.061261 -4.715399 1.740303
H -0.623338 -4.111973 1.624902
H -2.443644 -0.625178 -1.322135
H 3.676738 2.407770 -0.958826
H -4.335971 0.562403 3.158864
H -5.638220 1.110004 1.144189
H 3.850880 -3.206803 -1.138487
H -6.159268 2.105742 -0.585964
H -6.379557 1.823446 -2.317628
H -4.866170 0.939207 -3.519555
H -3.293035 0.496586 -2.842854
H 5.327001 1.401285 -2.486483
H 5.661122 -2.919449 -2.794695
H 6.419598 -0.623336 -3.489029
H -7.207760 -0.205185 -0.118906
H -7.501776 -0.387325 -1.870495
H -8.318474 0.919213 -0.960549
H -4.180018 -1.888327 -2.437129
H -5.717695 -1.414209 -3.211543
H -4.201018 -1.415963 -4.162993
H 1.717603 5.686921 -0.194331
H 2.023161 5.201540 1.530006
H 0.409946 4.910010 0.799373


