%chk=000091894.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000091894

0 1
 O   0.6242000       2.120100     -4.4700000E-02
 O   -3.330900      -1.469600      8.6700000E-02
 O    7.075600       1.756000     -2.9100001E-02
 N    2.477400      0.2831000      8.9999998E-04
 N   -1.679900      -3.490200      0.1350000    
 C   4.6100002E-02 -0.1772000      2.8100001E-02
 C  -0.9876000      -1.115500      6.1799999E-02
 C    1.378800     -0.6062000      3.3000000E-02
 C  -0.6887000      -2.482700      0.1000000    
 C   -1.665600       1.707100     -1.7100001E-02
 C  -0.2551000       1.268400     -1.2900000E-02
 C   -2.699300      0.7688000      1.7100001E-02
 C   -2.398100     -0.6767000      5.7999998E-02
 C    1.672300      -1.969600      7.1199998E-02
 C    3.834200     -0.1635000      6.2000002E-03
 C   0.6407000      -2.905900      0.1045000    
 C    4.796700       1.018000     -2.1900000E-02
 C   -1.964500       3.074400     -5.5300001E-02
 C   -4.032000       1.197800      1.2900000E-02
 C   -3.294000       3.497500     -5.9099998E-02
 C   -4.325400       2.561200     -2.5200000E-02
 C    6.260000      0.5917000     -1.9300001E-02
 C   -1.484600      -4.787100     -0.4307000    
 H    2.285500       1.276600     -2.9100001E-02
 H    2.684400      -2.361700      7.8900002E-02
 H    4.035800     -0.7907000     -0.8708000    
 H    4.042400     -0.7506000      0.9091000    
 H   0.9153000      -3.955900      0.1461000    
 H    4.604000       1.640700     -0.9056000    
 H    4.610600       1.675500      0.8377000    
 H   -1.180300       3.826100     -8.2300000E-02
 H   -4.856100      0.4899000      3.8899999E-02
 H   -2.633400      -3.197100      0.3109000    
 H   -3.525300       4.558400     -8.8699996E-02
 H   -5.359600       2.893400     -2.8300000E-02
 H    6.494700      9.3000000E-03  0.8773000    
 H    6.493400     -6.3999998E-03 -0.9058000    
 H  -0.8147000      -5.399100      0.1815000    
 H   -1.094200      -4.729800      -1.452300    
 H   -2.443400      -5.314200     -0.4773000    
 H    8.000500       1.455800     -2.7300000E-02


%chk=000091894-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000091894

0 1
O 0.768073 2.116140 0.023428
O -3.426858 -1.511541 -0.078578
O 7.004454 2.007895 0.029780
N 2.485044 0.205305 -0.012883
N -1.782432 -3.484291 -0.127470
C 0.066508 -0.204208 -0.034504
C -1.028144 -1.151205 -0.063666
C 1.431716 -0.676702 -0.039698
C -0.755773 -2.569960 -0.098360
C -1.601156 1.705337 0.003950
C -0.194599 1.237473 0.000517
C -2.678592 0.772667 -0.022668
C -2.417468 -0.685960 -0.057284
C 1.665180 -2.098166 -0.073426
C 3.898862 -0.179455 -0.017472
C 0.616967 -3.005530 -0.101235
C 4.787316 1.080206 0.007389
C -1.877437 3.097534 0.035219
C -4.017166 1.245342 -0.017614
C -3.207033 3.556741 0.040094
C -4.281556 2.626594 0.013507
C 6.278020 0.729544 0.005139
C -1.603422 -4.932842 -0.163592
H 2.185477 1.208286 0.008834
H 2.693314 -2.471604 -0.076656
H 4.132771 -0.783370 -0.921908
H 4.129818 -0.816808 0.864481
H 0.837434 -4.076917 -0.125379
H 4.568199 1.713230 -0.872681
H 4.563889 1.681459 0.908473
H -1.028886 3.788060 0.055421
H -4.822254 0.504695 -0.038767
H -2.728792 -3.037661 -0.117573
H -3.415641 4.632040 0.064390
H -5.316201 2.987021 0.017149
H 6.528313 0.112982 0.897086
H 6.533332 0.144958 -0.906687
H -1.072882 -5.312653 0.733079
H -1.041180 -5.262891 -1.060538
H -2.597002 -5.408166 -0.194880
H 7.979685 1.836522 0.028581


