%chk=000169735.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000169735

0 1
 O    2.002500     -0.6621000       1.704700    
 O   0.3893000       2.304900     -0.5763000    
 O    2.959600      -2.561900       2.617400    
 N   -4.050800      0.8108000      0.3457000    
 C   -5.035900     -0.1565000      0.8342000    
 C   -6.353900      0.5526000       1.173100    
 C   -5.266300      -1.254600     -0.2126000    
 C   -7.087400       1.065900     -6.6699997E-02
 C   -5.997200     -0.7453000      -1.455800    
 C    1.604300     -0.1715000      0.3852000    
 C   -7.303400     -4.4599999E-02  -1.091500    
 C   0.1105000      8.5800000E-02  0.4076000    
 C    2.399200       1.084700      8.8299997E-02
 C    1.984300      -1.321900     -0.4903000    
 C   -2.662300      0.5675000      0.3673000    
 C  -0.3989000       1.291500     -8.7499999E-02
 C    1.747800       2.228700     -0.3864000    
 C    2.533300      -2.333400      0.2770000    
 C   -1.777300       1.529700     -0.1126000    
 C  -0.7973000     -0.8744000      0.8884000    
 C   -2.172200     -0.6338000      0.8698000    
 C    2.547500      -1.920300       1.671900    
 C    3.795500       1.130400      0.2478000    
 C    1.860000      -1.477100      -1.862000    
 C    2.470000       3.384200     -0.7034000    
 C    4.515400       2.285600     -6.2100001E-02
 C    2.977800      -3.525500     -0.2641000    
 C    3.852700       3.412000     -0.5395000    
 C    2.301100      -2.672000      -2.438300    
 C    2.856100      -3.689400      -1.644200    
 C    5.996100       2.310300      0.1149000    
 H   -4.688400     -0.6022000       1.773600    
 H   -6.167000       1.392100       1.853900    
 H   -7.009700     -0.1479000       1.706000    
 H   -5.868200      -2.051500      0.2433000    
 H   -4.326900      -1.721100     -0.5269000    
 H   -6.524600       1.885800     -0.5276000    
 H   -8.057300       1.481400      0.2304000    
 H   -6.207600      -1.585600      -2.127300    
 H   -5.351200     -5.2400000E-02  -2.008300    
 H   -8.008400     -0.7804000     -0.6854000    
 H   -7.763300      0.3714000      -1.995000    
 H   -4.366700       1.671700     -8.5699998E-02
 H   -2.153900       2.472000     -0.5049000    
 H  -0.4422000      -1.824900       1.278500    
 H   -2.809400      -1.420500       1.258700    
 H    4.329700      0.2562000      0.6135000    
 H    1.432100     -0.6954000      -2.480400    
 H    1.957600       4.267900      -1.074800    
 H    3.405500      -4.308400      0.3518000    
 H    4.399800       4.318000     -0.7854000    
 H    2.214000      -2.816700      -3.511800    
 H    3.193100      -4.611100      -2.110900    
 H    6.437800       1.344200     -0.1523000    
 H    6.463100       3.064700     -0.5272000    
 H    6.246100       2.537200       1.156100    


%chk=000169735-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000169735

0 1
O 1.979399 -0.431124 1.906928
O 0.303341 2.504471 0.132427
O 2.996482 -2.154849 3.114782
N -4.111894 0.640060 0.489119
C -5.136275 -0.411909 0.636224
C -6.437830 0.210389 1.204774
C -5.430837 -1.148076 -0.705114
C -7.166455 1.119197 0.182834
C -6.147204 -0.234434 -1.726557
C 1.610866 -0.141213 0.395856
C -7.447600 0.362480 -1.137214
C 0.116810 0.042339 0.327913
C 2.360775 1.122256 0.020015
C 2.127003 -1.408570 -0.282342
C -2.740237 0.425596 0.418946
C -0.470390 1.332406 0.258947
C 1.692697 2.366922 -0.049006
C 2.694755 -2.287473 0.660262
C -1.858130 1.535369 0.299828
C -0.777696 -1.053728 0.432248
C -2.168122 -0.888367 0.471418
C 2.608578 -1.690061 2.024169
C 3.762750 1.109073 -0.199078
C 2.089315 -1.751937 -1.646148
C 2.394852 3.562252 -0.317397
C 4.494077 2.283752 -0.469267
C 3.242657 -3.530745 0.285309
C 3.783311 3.516654 -0.523080
C 2.637121 -2.997586 -2.037515
C 3.209030 -3.881110 -1.083053
C 5.997660 2.248471 -0.679179
H -4.759711 -1.151370 1.372725
H -6.208093 0.766674 2.134218
H -7.115989 -0.619199 1.485469
H -6.068940 -2.028528 -0.482748
H -4.486751 -1.532336 -1.134774
H -6.560883 2.024108 -0.038028
H -8.111675 1.486473 0.626123
H -6.371636 -0.806369 -2.647162
H -5.463681 0.587347 -2.022345
H -8.167965 -0.458019 -0.937019
H -7.927548 1.038317 -1.870861
H -4.437978 1.605929 0.457947
H -2.239087 2.560514 0.244228
H -0.363953 -2.066468 0.494140
H -2.809652 -1.768988 0.556059
H 4.292591 0.150999 -0.143422
H 1.647818 -1.074849 -2.384780
H 1.836503 4.501929 -0.361461
H 3.676087 -4.191539 1.043100
H 4.328316 4.445392 -0.730296
H 2.620106 -3.286599 -3.094369
H 3.624940 -4.838679 -1.414601
H 6.377260 1.213048 -0.711201
H 6.286740 2.744208 -1.624652
H 6.528471 2.772302 0.138564


