%chk=000154157.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000154157

0 1
 O    3.050600      -3.003900      0.5015000    
 O   -3.050500      -3.004400     -0.5011000    
 O    5.225900      -1.346400      4.0000002E-03
 O   -5.225900      -1.346400     -4.6999999E-03
 N    2.399400       2.395100     -0.2210000    
 N   -2.399400       2.395000      0.2210000    
 C    0.000000      0.8643000      9.9999997E-05
 C    0.000000       2.271800      9.9999997E-05
 C    1.325300      0.2408000      3.9799999E-02
 C   -1.325300      0.2408000     -3.9400000E-02
 C    2.470500       1.067200     -0.1190000    
 C   -2.470500       1.067000      0.1190000    
 C    1.191400       2.969900     -0.1203000    
 C   -1.191500       2.969800      0.1203000    
 C    1.589500      -1.132600      0.2840000    
 C   -1.589400      -1.132800     -0.2834000    
 C    3.746300      0.5112000     -0.1462000    
 C   -3.746300      0.5112000      0.1459000    
 C    2.877100      -1.674000      0.2670000    
 C   -2.877000      -1.674200     -0.2668000    
 C    1.304300       4.458700     -0.1882000    
 C   -1.304400       4.458800      0.1881000    
 C    3.959500     -0.8505000      3.0600000E-02
 C   -3.959400     -0.8506000     -3.0999999E-02
 C    3.228900      -3.405700       1.858700    
 C   -3.228100      -3.406200      -1.858200    
 C    5.721200      -1.797200      -1.256200    
 C   -5.721900      -1.796800       1.255400    
 H   0.7928000      -1.814400      0.5570000    
 H  -0.7926000      -1.814700     -0.5561000    
 H    4.609700       1.160500     -0.2910000    
 H   -4.609800       1.160400      0.2904000    
 H   0.8329000       4.882700      -1.075700    
 H    1.067900       4.957000      0.7521000    
 H    2.363600       4.721200     -0.3355000    
 H   -2.363800       4.721200      0.3354000    
 H  -0.8330000       4.882700       1.075700    
 H   -1.068000       4.957000     -0.7521000    
 H    3.362800      -4.490700       1.879900    
 H    2.346100      -3.150100       2.453400    
 H    4.119600      -2.934700       2.286200    
 H   -3.362100      -4.491200      -1.879300    
 H   -2.345100      -3.150800      -2.452600    
 H   -4.118800      -2.935200      -2.286100    
 H    5.106800      -2.617900      -1.639500    
 H    6.742000      -2.161400      -1.112500    
 H    5.740700     -0.9733000      -1.976700    
 H   -6.742700      -2.161000       1.111300    
 H   -5.741700     -0.9727000       1.975600    
 H   -5.107600      -2.617500       1.639300    


%chk=000154157-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000154157

0 1
O 2.855747 -2.927498 0.846297
O -2.855842 -2.927615 -0.845648
O 5.200596 -1.368167 0.044243
O -5.200413 -1.368171 -0.044626
N 2.417193 2.525760 -0.471047
N -2.416986 2.525818 0.470922
C 0.000084 1.054675 -0.000072
C 0.000099 2.498202 -0.000088
C 1.285876 0.369063 0.036556
C -1.285722 0.369090 -0.036675
C 2.466748 1.158150 -0.218516
C -2.466575 1.158199 0.218449
C 1.255995 3.183889 -0.326950
C -1.255781 3.183922 0.326771
C 1.477587 -0.997509 0.413289
C -1.477465 -0.997508 -0.413326
C 3.753247 0.544612 -0.239022
C -3.753090 0.544684 0.239013
C 2.749764 -1.575744 0.446571
C -2.749653 -1.575730 -0.446449
C 1.361695 4.666904 -0.643079
C -1.361439 4.666942 0.642891
C 3.905274 -0.811481 0.054322
C -3.905135 -0.811406 -0.054347
C 3.651724 -3.150213 2.078361
C -3.652822 -3.150633 -2.076989
C 5.387935 -2.504709 -0.890335
C -5.387430 -2.505470 0.889068
H 0.650194 -1.612536 0.772591
H -0.650084 -1.612614 -0.772521
H 4.623521 1.156900 -0.487585
H -4.623362 1.157005 0.487501
H 0.620428 4.985143 -1.397091
H 1.226028 5.303087 0.248527
H 2.373149 4.842142 -1.039741
H -2.372876 4.842205 1.039583
H -0.620140 4.985173 1.396876
H -1.225788 5.303113 -0.248725
H 3.678439 -4.241846 2.214388
H 3.149471 -2.674869 2.941801
H 4.674072 -2.746364 1.968822
H -3.679621 -4.242297 -2.212748
H -3.151333 -2.675446 -2.940965
H -4.675095 -2.746804 -1.966609
H 4.664290 -3.313164 -0.683743
H 6.418022 -2.852652 -0.721384
H 5.274799 -2.154280 -1.933313
H -6.417497 -2.853425 0.720023
H -5.274124 -2.155883 1.932314
H -4.663705 -3.313644 0.681614


