%chk=000090063.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000090063

0 1
 O   -5.838100      0.5696000      0.1746000    
 O    5.913700      0.4816000     -0.2086000    
 O   0.1369000      -1.172000     -0.7292000    
 N  -0.3179000     -7.7500001E-02 -0.2477000    
 N   0.3925000      0.9134000      0.1452000    
 C   -6.654500     -0.5183000     -0.2564000    
 C   -7.948500     -0.5088000      0.5430000    
 C    6.529800     -0.5786000      0.5207000    
 C    7.800500     -0.9990000     -0.2020000    
 C   -4.490200      0.4112000      7.1599998E-02
 C   -1.760100      9.1200002E-02 -0.1371000    
 C    4.559600      0.5879000     -0.1219000    
 C   -3.957400     -0.3956000     -0.9340000    
 C   -3.641400       1.055800      0.9715000    
 C    1.784000      0.8061000      5.6200001E-02
 C   -2.576000     -0.5575000      -1.039500    
 C   -2.260000      0.8940000      0.8657000    
 C   -8.865100      -1.652400      0.1475000    
 C    3.830800       1.109900      -1.190600    
 C    3.900300      0.1748000       1.035900    
 C    8.505400      -2.138600      0.5116000    
 C    2.443100       1.219100      -1.101500    
 C    2.512600      0.2838000       1.125000    
 H   -6.160700      -1.484100     -8.6499996E-02
 H   -6.870200     -0.4016000      -1.324700    
 H   -7.720300     -0.5688000       1.614000    
 H   -8.463100      0.4486000      0.3981000    
 H    5.873800      -1.456500      0.5864000    
 H    6.769300     -0.2255000       1.530400    
 H    8.475700     -0.1392000     -0.2888000    
 H    7.558700      -1.296800      -1.229400    
 H   -4.580800     -0.8911000      -1.672400    
 H   -4.051100       1.683100       1.758600    
 H   -2.177300      -1.177800      -1.836400    
 H   -1.621200       1.396400       1.585800    
 H   -9.134000      -1.591300     -0.9118000    
 H   -9.788300      -1.618800      0.7345000    
 H   -8.385300      -2.620200      0.3252000    
 H    4.338800       1.433100      -2.095200    
 H    4.431600     -0.2112000       1.900800    
 H    8.787400      -1.849700       1.529100    
 H    9.416400      -2.417400     -2.7000001E-02
 H    7.862500      -3.022700      0.5709000    
 H    1.883900       1.627000      -1.939500    
 H    2.007600     -3.5000000E-02   2.033200    


%chk=000090063-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000090063

0 1
O -5.881862 -0.193180 0.983564
O 6.008013 -0.489747 -0.664470
O -0.323898 -0.538146 -2.149277
N -0.513835 -0.422654 -0.839835
N 0.415666 -0.354092 0.102006
C -7.016325 -0.223549 0.036903
C -8.298435 -0.139980 0.867914
C 6.909380 -0.361555 0.499216
C 8.342326 -0.416038 -0.034909
C -4.586497 -0.253060 0.463077
C -1.899722 -0.361261 -0.366279
C 4.629046 -0.455780 -0.440203
C -4.276880 -0.351155 -0.918374
C -3.541409 -0.209344 1.424594
C 1.788456 -0.402792 -0.218063
C -2.929652 -0.405982 -1.328499
C -2.201458 -0.262121 1.015611
C -9.556288 -0.159446 -0.028326
C 3.815750 -0.566665 -1.597213
C 4.024002 -0.320007 0.839170
C 9.377895 -0.264961 1.100863
C 2.416264 -0.540735 -1.502715
C 2.624195 -0.296089 0.935503
H -6.983058 -1.164816 -0.550543
H -6.937713 0.635573 -0.661522
H -8.319892 -0.987534 1.577750
H -8.272391 0.785590 1.472417
H 6.716970 -1.191637 1.210649
H 6.713512 0.602057 1.014397
H 8.473577 0.388033 -0.782662
H 8.490457 -1.375053 -0.565005
H -5.065986 -0.385523 -1.674279
H -3.808138 -0.133341 2.482762
H -2.657001 -0.483262 -2.383821
H -1.383924 -0.228779 1.738169
H -9.564142 0.694568 -0.731364
H -10.472529 -0.097381 0.584523
H -9.613341 -1.089727 -0.624166
H 4.307628 -0.671511 -2.569281
H 4.627656 -0.234530 1.746977
H 9.259941 0.700386 1.628078
H 10.405507 -0.303947 0.698993
H 9.279394 -1.074058 1.848907
H 1.797349 -0.623791 -2.395121
H 2.134789 -0.192376 1.909185


