%chk=000037217.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000037217

0 1
 O   -1.677800      0.3890000      0.1765000    
 O   0.7982000     -0.1587000      8.2800001E-02
 O    6.255400      0.1474000     -0.1144000    
 O    5.045900      -2.420000     -9.3699999E-02
 O   -1.302200       2.660100      0.1834000    
 N   -5.248500     -0.5654000      0.3295000    
 C   -5.909100      -1.870700      0.4696000    
 C   -5.754100      0.1628000     -0.8427000    
 C   -7.423500      -1.710400      0.6130000    
 C   -7.263300      0.3896000     -0.7424000    
 C   -8.010700     -0.9258000     -0.5548000    
 C   -3.798100     -0.7329000      0.2410000    
 C   -3.082000      0.6053000      0.2278000    
 C    2.713700       1.038600      2.3300000E-02
 C    1.614800       1.937300      7.1599998E-02
 C   0.5386000       1.146700      0.1039000    
 C    2.158100     -0.2380000      3.2099999E-02
 C  -0.9008000       1.507000      0.1591000    
 C    4.113600       1.168200     -2.6799999E-02
 C    2.898600      -1.419300     -5.7000001E-03
 C    4.884800       0.000000     -6.5700002E-02
 C    1.679300       3.411900      8.1500001E-02
 C    4.286200      -1.268500     -5.5300001E-02
 C    6.975800      -1.023700     -0.1518000    
 C    6.407200      -2.230400     -0.1419000    
 H   -5.535200      -2.382700       1.364700    
 H   -5.687400      -2.515200     -0.3914000    
 H   -5.521000     -0.3746000      -1.771200    
 H   -5.319200       1.162800     -0.9202000    
 H   -7.650700      -1.191500       1.553000    
 H   -7.896500      -2.697200      0.6703000    
 H   -7.623900      0.8923000      -1.647100    
 H   -7.480300       1.056300      0.1020000    
 H   -9.075000     -0.7327000     -0.3813000    
 H   -7.936100      -1.523300      -1.471700    
 H   -3.432900      -1.302800       1.105600    
 H   -3.510500      -1.316400     -0.6441000    
 H   -3.339400       1.198100     -0.6542000    
 H   -3.327900       1.177300       1.131000    
 H    4.587500       2.145100     -3.5200000E-02
 H    2.421500      -2.392200      3.0000000E-03
 H    1.153600       3.826700     -0.7849000    
 H    2.710300       3.777100      4.7800001E-02
 H    1.216900       3.812100      0.9899000    
 H    8.039200     -0.8436000     -0.1892000    
 H    6.945300      -3.165500     -0.1703000    


%chk=000037217-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000037217

0 1
O -1.715733 0.330195 0.131590
O 0.902154 -0.319432 -0.004353
O 6.455131 0.253401 -0.047043
O 5.310210 -2.423293 -0.298235
O -1.265624 2.618407 0.354012
N -5.359768 -0.522898 0.108168
C -6.067994 -1.721435 0.628580
C -5.950676 -0.057402 -1.173879
C -7.562946 -1.421001 0.858756
C -7.442941 0.292749 -1.003319
C -8.226574 -0.916465 -0.442822
C -3.891601 -0.708006 0.030082
C -3.173700 0.631902 0.232693
C 2.818963 0.983331 0.089416
C 1.680462 1.874535 0.203979
C 0.547630 1.057682 0.144292
C 2.299775 -0.338027 -0.035125
C -0.864974 1.428453 0.220024
C 4.228057 1.170877 0.083108
C 3.099504 -1.484318 -0.166077
C 5.042403 0.043490 -0.045168
C 1.717352 3.369432 0.358964
C 4.485289 -1.273922 -0.169087
C 7.236059 -0.924124 -0.171517
C 6.709064 -2.164664 -0.288263
H -5.591014 -2.020192 1.580505
H -5.974768 -2.588256 -0.079129
H -5.847075 -0.846040 -1.966934
H -5.393382 0.830919 -1.523582
H -7.651177 -0.645496 1.644024
H -8.068622 -2.334049 1.227956
H -7.858981 0.610405 -1.978858
H -7.531054 1.147459 -0.305268
H -9.282943 -0.643289 -0.259775
H -8.228409 -1.733585 -1.194170
H -3.572964 -1.396519 0.833397
H -3.564064 -1.162166 -0.935838
H -3.436590 1.383307 -0.533028
H -3.391267 1.056150 1.228036
H 4.691840 2.156574 0.175786
H 2.687662 -2.490892 -0.259996
H 1.168924 3.868792 -0.459047
H 2.755826 3.740733 0.367886
H 1.219782 3.684973 1.293010
H 8.303355 -0.711028 -0.162438
H 7.293800 -3.077071 -0.384911


