%chk=000037107.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000037107

0 1
 O    2.026200       1.046600     -6.9999998E-04
 O    1.368200      -1.174400      6.9999998E-04
 O   -6.144600      0.1580000      2.4999999E-03
 O   -4.978700       2.018100      3.0000001E-04
 N  -0.1953000      0.5742000     -1.0000000E-03
 N   -5.046500      0.7652000      6.0000003E-04
 C   -1.429000     -7.7600002E-02 -1.0000000E-03
 C   -2.610700      0.6636000     -1.3000000E-03
 C   -3.843300      1.1000000E-02 -1.0000000E-03
 C   -1.480200      -1.471600     -3.0000001E-04
 C   -3.894400      -1.383000     -3.9999999E-04
 C   -2.712800      -2.124300      9.9999997E-05
 C    3.351600      0.5996000     -1.9999999E-04
 C    1.081600      1.7300000E-02 -5.0000002E-04
 C    3.977100      0.3880000      -1.207800    
 C    3.976100      0.3884000       1.208000    
 C    5.298600     -5.8800001E-02  -1.207300    
 C    5.297500     -5.8300000E-02   1.208600    
 C    5.958600     -0.2820000      8.9999998E-04
 H   -2.547300       1.749700     -1.4000000E-03
 H  -0.6091000      -2.112000     -9.9999997E-05
 H   -4.836400      -1.925400      1.9999999E-04
 H  -0.2304000       1.590900     -1.5000000E-03
 H   -2.753500      -3.209800      7.9999998E-04
 H    3.463100      0.5622000      -2.147800    
 H    3.461400      0.5629000       2.147500    
 H    5.813300     -0.2329000      -2.147800    
 H    5.811600     -0.2320000       2.149500    
 H    6.987500     -0.6299000      1.4000000E-03


%chk=000037107-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000037107

0 1
O 2.006815 0.852940 -0.002836
O 1.309385 -1.414528 -0.001460
O -6.243943 0.370048 0.002474
O -4.877728 2.195197 -0.000011
N -0.200370 0.417559 -0.002817
N -5.076193 0.918343 0.001057
C -1.468580 -0.214536 -0.001245
C -2.611770 0.621639 -0.000814
C -3.887453 0.026979 0.000646
C -1.628404 -1.629049 -0.000191
C -4.077068 -1.371244 0.001725
C -2.925419 -2.184658 0.001270
C 3.396440 0.490288 -0.001176
C 1.045045 -0.194523 -0.003429
C 4.065857 0.356596 -1.232208
C 4.062760 0.355421 1.231414
C 5.451644 0.079179 -1.223938
C 5.448556 0.077986 1.226372
C 6.143560 -0.060505 0.002023
H -2.535900 1.713797 -0.001604
H -0.743905 -2.269589 -0.000541
H -5.088297 -1.783939 0.002849
H -0.177075 1.440145 -0.003492
H -3.034596 -3.273806 0.002059
H 3.512884 0.469713 -2.169866
H 3.507435 0.467637 2.167790
H 5.987325 -0.027685 -2.173175
H 5.981844 -0.029801 2.176852
H 7.217352 -0.275905 0.003271


