%chk=000158686.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000158686

0 1
 O   -1.521200       3.249700      0.2777000    
 O   0.6373000       4.179600     -0.2503000    
 O   -1.980900      0.4567000      0.6303000    
 O    1.189800      -3.372900      0.3396000    
 O    3.965900      0.2484000     -0.5612000    
 N   0.1330000      -1.238100      0.3591000    
 C    1.618900      0.6345000     -0.1180000    
 C   0.3449000      7.4800000E-02  0.1941000    
 C  -0.7399000      0.9362000      0.3351000    
 C  -0.5566000       2.295600      0.1707000    
 C   0.6703000       2.825600     -0.1293000    
 C    2.717700     -0.2248000     -0.2622000    
 C    1.777500       2.022200     -0.2799000    
 C    2.509200      -1.598400     -9.2299998E-02
 C    1.218800      -2.014800      0.2094000    
 C  -0.7566000       4.443100      1.0100000E-02
 C    3.302200      -2.771700     -0.1458000    
 C   -2.821900      0.1156000     -0.4697000    
 C    2.453800      -3.820000      0.1230000    
 C   -4.144200     -0.3620000      4.2900000E-02
 C   -4.743600      -1.547100     -0.1795000    
 C    4.998600     -2.3200000E-02  0.3804000    
 C   -6.090900      -1.842600      0.4257000    
 C   -4.182200      -2.666200      -1.010000    
 H    2.738000       2.469200     -0.5178000    
 H  -0.8322000       5.110200      0.8764000    
 H   -1.187500       4.947900     -0.8621000    
 H    4.357000      -2.858000     -0.3616000    
 H   -2.994400       1.009000      -1.082500    
 H   -2.316400     -0.6227000      -1.096800    
 H    2.587900      -4.889700      0.1911000    
 H   -4.666800      0.3645000      0.6643000    
 H    5.566400     -0.9039000      6.9300003E-02
 H    4.611000     -0.1581000       1.396400    
 H    5.680800      0.8320000      0.3883000    
 H   -6.823200      -2.048100     -0.3622000    
 H   -6.028500      -2.718500       1.079800    
 H   -6.472900      -1.008700       1.024000    
 H   -4.856700      -2.888600      -1.843700    
 H   -3.200000      -2.452700      -1.434800    
 H   -4.081100      -3.570400     -0.4002000    


%chk=000158686-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000158686

0 1
O -1.565440 3.632187 0.136532
O 0.680765 4.444112 0.265242
O -2.300696 0.805164 0.043197
O 0.798060 -3.284669 -0.180564
O 3.883021 0.435691 0.065730
N -0.119986 -1.084138 -0.090710
C 1.526841 0.786992 0.038431
C 0.160329 0.273495 -0.023651
C -0.965775 1.195746 0.009930
C -0.656224 2.549132 0.123737
C 0.683807 3.027883 0.198073
C 2.622359 -0.151084 0.009033
C 1.783906 2.196874 0.150168
C 2.340291 -1.533227 -0.067659
C 0.938849 -1.875071 -0.107744
C -0.740270 4.816354 0.482444
C 3.062223 -2.801622 -0.119396
C -2.803629 -0.075797 -1.090670
C 2.115192 -3.798093 -0.184194
C -4.214090 -0.468874 -0.768220
C -4.591546 -1.651043 -0.196868
C 5.082513 -0.409812 0.056960
C -6.057269 -1.945622 0.073559
C -3.626797 -2.745526 0.221548
H 2.806226 2.571571 0.197930
H -0.890276 5.061387 1.551251
H -1.001486 5.644044 -0.193202
H 4.134354 -2.975439 -0.110992
H -2.758228 0.540005 -2.010042
H -2.122847 -0.935414 -1.178588
H 2.185258 -4.881160 -0.235964
H -4.988967 0.276574 -0.993664
H 5.149144 -0.991705 -0.880118
H 5.097477 -1.083912 0.932372
H 5.924090 0.295271 0.116652
H -6.368521 -2.888274 -0.419118
H -6.233942 -2.083537 1.158733
H -6.715475 -1.134572 -0.282676
H -3.782469 -3.658133 -0.388320
H -2.569288 -2.448563 0.145060
H -3.820181 -3.033595 1.273578


