%chk=000093481.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000093481

0 1
 O    1.408600       2.383000      3.5999999E-03
 O   -6.343900      -1.338700     -2.1199999E-02
 O   -4.948100      -3.174800      2.7700000E-02
 N    2.096400     -0.3247000      3.1000001E-03
 N    2.417300      -1.625300      4.0000002E-03
 N    3.082100      0.5822000     -9.9999997E-05
 C   -1.290700       3.256100      3.4000000E-03
 C  -0.9082000       1.812500      3.5000001E-03
 C   -2.840600       3.428600      4.0000002E-03
 C  -0.7350000       3.986600      -1.257400    
 C  -0.7773000       4.084700       1.226500    
 C   -1.911300      0.8432000      4.1999999E-03
 C   0.4327000       1.428400      2.6000000E-03
 C   -1.562600     -0.4996000      3.5999999E-03
 C   0.7705000      7.5000003E-02  2.4000001E-03
 C  -0.2326000     -0.8943000      2.9000000E-03
 C   -2.645900      -1.546600      7.4000000E-03
 C   -4.039400     -0.9188000      7.7000000E-03
 C    3.760000      -1.593400      1.3000000E-03
 C    4.183900     -0.1858000     -1.2000001E-03
 C   -5.130300      -1.965400      6.3999998E-03
 C    4.684100      -2.654900      8.9999998E-04
 C    5.540600      0.1889000     -4.1000000E-03
 C    6.032100      -2.251600     -2.0000001E-03
 C    6.441700     -0.8916000     -4.4999998E-03
 C   -7.484200      -2.203700     -2.4700001E-02
 H   -3.102800       4.494900     -8.5000005E-03
 H   -3.308900       3.001100     -0.8909000    
 H   -3.307500       3.016000      0.9066000    
 H   -1.020900       3.453100      -2.171800    
 H   -1.141700       5.002500      -1.330600    
 H   0.3538000       4.085900      -1.258700    
 H   -1.156800       5.112800       1.199800    
 H   -1.112100       3.626800       2.164700    
 H   0.3140000       4.146200       1.266100    
 H   -2.947000       1.131200      7.4000000E-03
 H  -9.4999997E-03  -1.958200      3.4000000E-03
 H   -2.527700      -2.181600      0.8944000    
 H   -2.530000      -2.185800     -0.8769000    
 H   -4.197700     -0.3159000      0.9106000    
 H   -4.195900     -0.3158000     -0.8954000    
 H    2.177500       2.065300      0.5024000    
 H    4.393000      -3.697600      2.7999999E-03
 H    5.873500       1.218900     -6.0000001E-03
 H    6.803100      -3.021100     -2.4000001E-03
 H    7.509300     -0.6759000     -6.6000000E-03
 H   -7.474500      -2.839500     -0.9152000    
 H   -8.382800      -1.581400     -4.7600001E-02
 H   -7.501100      -2.811600      0.8848000    


%chk=000093481-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000093481

0 1
O 1.458865 2.456421 0.012481
O -6.507898 -1.566993 -0.021584
O -4.985080 -3.328755 0.030019
N 2.079435 -0.329399 0.013212
N 2.432265 -1.654137 0.014325
N 3.136206 0.576257 0.015552
C -1.282724 3.460519 0.003376
C -0.927684 1.953044 0.005067
C -2.815916 3.700427 -0.002940
C -0.691468 4.140413 -1.270314
C -0.701516 4.140201 1.281776
C -1.927731 0.953116 0.002812
C 0.437835 1.522343 0.009195
C -1.653250 -0.442477 0.003777
C 0.719865 0.115883 0.009555
C -0.308044 -0.850751 0.006811
C -2.744577 -1.511379 0.001631
C -4.186808 -0.976703 0.000511
C 3.818190 -1.607277 0.018077
C 4.256138 -0.228824 0.018796
C -5.213336 -2.098289 0.005152
C 4.758409 -2.673344 0.020912
C 5.635334 0.108530 0.022326
C 6.115990 -2.326992 0.024360
C 6.547818 -0.955519 0.025051
C -7.610107 -2.559986 -0.016233
H -3.006630 4.788979 -0.004369
H -3.300311 3.278373 -0.903584
H -3.307770 3.279528 0.894211
H -1.121449 3.695299 -2.187185
H -0.937520 5.219219 -1.263974
H 0.403544 4.030966 -1.304905
H -0.948125 5.218874 1.274255
H -1.138045 3.694265 2.195160
H 0.393305 4.031348 1.324452
H -2.969936 1.278795 -0.000392
H -0.031612 -1.909198 0.007274
H -2.613073 -2.173032 0.879396
H -2.610603 -2.171429 -0.877079
H -4.382435 -0.337347 0.883120
H -4.384333 -0.340763 -0.883789
H 2.366000 1.945314 0.014456
H 4.426007 -3.715076 0.020296
H 5.965380 1.150941 0.022817
H 6.874035 -3.117399 0.026549
H 7.622018 -0.741631 0.027767
H -7.539629 -3.214439 -0.901320
H -8.529289 -1.958238 -0.039699
H -7.562542 -3.179376 0.895238


