%chk=000149254.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000149254

0 1
 O   -6.814600      1.9999999E-04  0.5337000    
 O   -4.950100     -5.0000002E-04   1.858000    
 N   0.6990000     -2.2000000E-03  -1.495600    
 N    4.034200      3.0000000E-03   1.043300    
 N   -4.804000     -1.3000000E-03 -0.4829000    
 C    1.830000     -5.0000002E-04 -0.6345000    
 C    2.383100      -1.214300     -0.2141000    
 C    2.380000       1.215000     -0.2153000    
 C    3.500400      -1.165000      0.6365000    
 C    3.497600       1.169300      0.6353000    
 C  -0.6789000     -2.9000000E-03  -1.242300    
 C    1.850900      -2.450500     -0.6200000    
 C    1.844800       2.449500     -0.6224000    
 C    4.055600      -2.370100       1.058500    
 C    4.049800       2.376200       1.056200    
 C    2.424600      -3.641000     -0.1840000    
 C    2.415500       3.642000     -0.1874000    
 C    3.529300      -3.600400      0.6570000    
 C    3.520300       3.604700      0.6537000    
 C   -1.592700     -3.5000001E-03  -2.302200    
 C   -1.155300     -1.7000000E-03  7.3799998E-02
 C   -3.431800     -2.0000001E-03 -0.7354000    
 C   -2.964400     -2.9000000E-03  -2.049700    
 C   -2.527200     -1.4000000E-03  0.3265000    
 C   -5.461500     -1.9999999E-04  0.7449000    
 C   -7.634400      3.9999999E-04   1.708300    
 H   0.9547000     -6.0999999E-03  -2.478600    
 H   0.9907000      -2.518500      -1.281000    
 H   0.9845000       2.514900      -1.283400    
 H    4.921800      -2.364700       1.717800    
 H    4.916000       2.373500       1.715500    
 H    2.012400      -4.594400     -0.4998000    
 H    2.000900       4.594100     -0.5040000    
 H    3.984800      -4.523600       1.002900    
 H    3.973500       4.529400      0.9988000    
 H   -1.243500     -4.1000000E-03  -3.331900    
 H  -0.4728000     -1.0000000E-03  0.9200000    
 H   -3.658100     -3.3000000E-03  -2.886700    
 H   -2.814300     -3.9999999E-04   1.368900    
 H   -5.405600     -1.4000000E-03  -1.303100    
 H   -7.446200      0.9007000       2.300800    
 H   -7.446800     -0.9002000       2.300600    
 H   -8.680800      7.9999998E-04   1.391800    


%chk=000149254-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000149254

0 1
O -6.950764 0.762301 0.373532
O -5.106133 0.832566 1.840652
N 0.622268 -0.732009 -1.346053
N 4.194368 0.078907 0.922794
N -4.910247 0.280944 -0.461165
C 1.759270 -0.442234 -0.563249
C 2.739468 -1.475572 -0.372355
C 2.015737 0.862556 -0.022225
C 3.959448 -1.146556 0.356001
C 3.243519 1.051796 0.747396
C -0.742701 -0.435257 -1.080350
C 2.566846 -2.824040 -0.843700
C 1.171264 2.004659 -0.251863
C 4.970096 -2.159228 0.514447
C 3.510623 2.343613 1.325225
C 3.563916 -3.781728 -0.665500
C 1.477017 3.245550 0.301458
C 4.785735 -3.441855 0.007588
C 2.647910 3.414165 1.116056
C -1.682264 -0.544223 -2.140831
C -1.216246 -0.086798 0.212649
C -3.515874 0.050074 -0.621218
C -3.050208 -0.312983 -1.912294
C -2.582049 0.162012 0.442939
C -5.581217 0.639519 0.694081
C -7.816369 1.141449 1.508558
H 0.775170 -1.397384 -2.106494
H 1.624020 -3.123449 -1.316546
H 0.279881 1.898635 -0.874996
H 5.877720 -1.871419 1.053763
H 4.427298 2.440223 1.914933
H 3.409663 -4.805542 -1.023364
H 0.822766 4.102996 0.110013
H 5.562578 -4.203564 0.136001
H 2.865642 4.393575 1.556141
H -1.338657 -0.802813 -3.149594
H -0.514324 -0.016751 1.048791
H -3.758132 -0.405650 -2.745426
H -2.933208 0.430489 1.441510
H -5.503314 0.175326 -1.287021
H -7.510558 2.119454 1.917135
H -7.759599 0.382579 2.307212
H -8.828956 1.191267 1.083868


