%chk=000128454.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000128454

0 1
 O    1.650300      -1.263000      0.6769000    
 O    3.362900     -0.6800000      -1.677800    
 O    4.207200       1.749900     -0.6275000    
 O    4.455000     -0.5627000      0.9417000    
 N   6.8000004E-02  0.2088000     -0.3411000    
 N   -1.435500      -1.658100     -0.2882000    
 N   -2.509000       1.841900      6.2500000E-02
 N   -4.539600      0.9395000      0.2386000    
 N   -3.840800      -1.377600      8.0000004E-03
 C    2.398300      0.2229000      -1.129600    
 C    3.052900       1.124700     -7.9099998E-02
 C    1.252400     -0.6004000     -0.5303000    
 C    3.398900      0.3614000       1.198600    
 C    2.175100     -0.4030000       1.692300    
 C   -1.207400     -0.3159000     -0.2276000    
 C   -2.325800      0.4927000     -4.6100002E-02
 C   -3.600700     -4.5400001E-02  6.6200003E-02
 C   -3.850700       2.060700      0.2317000    
 C   -2.711400      -2.096500     -0.1691000    
 H    2.039300      0.8286000      -1.970500    
 H    2.351600       1.925800      0.1859000    
 H    1.023400      -1.401800      -1.244000    
 H    3.764600       1.049900       1.967100    
 H    2.449800      -1.045400       2.535400    
 H    1.389200      0.2802000       2.033100    
 H   0.1748000       1.212600     -0.2489000    
 H    4.098400     -0.1447000      -2.021700    
 H    3.928300       2.236600      -1.421800    
 H    4.123200      -1.236600      0.3246000    
 H   -1.789400       2.551600      2.5500000E-02
 H   -4.256700       3.056100      0.3432000    
 H   -2.842800      -3.171900     -0.2233000    


%chk=000128454-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000128454

0 1
O 1.695353 -1.097114 1.064268
O 3.264430 -1.050974 -1.488090
O 4.311546 1.493560 -1.032621
O 4.601576 -0.555412 0.964495
N 0.043754 0.223987 -0.166945
N -1.449193 -1.540526 -0.699932
N -2.668531 1.837504 0.435453
N -4.721786 0.867801 0.131007
N -3.894579 -1.352962 -0.610922
C 2.342810 0.014742 -1.079722
C 3.127105 1.073945 -0.260997
C 1.211815 -0.652452 -0.257524
C 3.600437 0.495202 1.095623
C 2.355504 -0.031383 1.845511
C -1.261797 -0.257950 -0.279888
C -2.414835 0.528325 -0.004608
C -3.710282 -0.062813 -0.188931
C -4.062868 1.975209 0.496007
C -2.730793 -2.014447 -0.838191
H 1.888560 0.485713 -1.978821
H 2.472969 1.951217 -0.053027
H 0.885548 -1.580566 -0.749208
H 4.097314 1.289748 1.679298
H 2.663785 -0.520724 2.781569
H 1.641214 0.788575 2.084517
H 0.175193 1.187164 0.140002
H 4.109820 -0.598618 -1.763526
H 4.033917 2.129179 -1.741634
H 4.189745 -1.293231 0.433849
H -1.994070 2.557286 0.689427
H -4.536217 2.902902 0.812077
H -2.813641 -3.051988 -1.173816


