%chk=000073816.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000073816

0 1
 O  -0.4197000       2.416200     -0.1612000    
 O  -0.3844000      -2.387100     -0.2062000    
 O   0.3600000       1.374600      -2.050500    
 O   0.3673000      -1.324900      -2.100600    
 N    2.703800       1.209400      0.6816000    
 C  -0.3188000      4.1999999E-03 -0.1372000    
 C   0.6324000      3.0300001E-02   1.109600    
 C   -1.822400     -1.9200001E-02  0.2375000    
 C  -6.1200000E-02   1.327200     -0.8986000    
 C  -4.7300000E-02  -1.286400     -0.9493000    
 C    2.121300      9.4999997E-03  0.8245000    
 C   -2.150000     -8.8299997E-02   1.562600    
 C   -2.735200      3.0200001E-02 -0.7786000    
 C    2.754100      -1.207100      0.7342000    
 C   -3.503500     -0.1097000       1.899500    
 C   -4.088500      8.8999998E-03 -0.4415000    
 C   -4.472700     -6.1000001E-02  0.8975000    
 C  -0.2810000       3.684400     -0.8099000    
 C  -0.2256000      -3.650000     -0.8604000    
 C    4.119400      -1.191700      0.4720000    
 C    4.031400       1.184700      0.4274000    
 C    4.777900      2.2800000E-02  0.3143000    
 C  -0.7191000       4.776200      0.1427000    
 C  -0.6382000      -4.753200      9.0499997E-02
 H   0.4335000     -0.8308000       1.763200    
 H   0.4396000      0.9206000       1.725300    
 H   -1.447100     -0.1238000       2.383300    
 H   -2.447300      8.2999997E-02  -1.823300    
 H    2.235100      -2.149300      0.8656000    
 H   -3.803800     -0.1631000       2.942100    
 H   -4.843100      4.6399999E-02  -1.221600    
 H   -5.526400     -7.7500001E-02   1.159900    
 H  -0.9066000       3.704600      -1.709200    
 H   0.7669000       3.837300      -1.091400    
 H   0.8233000      -3.782400      -1.148200    
 H  -0.8558000      -3.678500      -1.756100    
 H    4.669700      -2.124400      0.3921000    
 H    4.497400       2.157800      0.3125000    
 H    5.841700      5.8800001E-02  0.1095000    
 H  -0.6260000       5.761700     -0.3219000    
 H   -1.759900       4.625700      0.4482000    
 H  -0.1142000       4.756400       1.055300    
 H   -1.679700      -4.623000      0.4025000    
 H  -2.8400000E-02  -4.725600      0.9997000    
 H  -0.5294000      -5.735100     -0.3784000    


%chk=000073816-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000073816

0 1
O -0.499674 2.317277 -0.340699
O -0.067564 -2.469345 -0.237124
O 0.752156 1.095011 -1.875000
O -0.806494 -1.394312 -2.157383
N 2.465809 1.159387 0.784633
C -0.512187 -0.075098 -0.069536
C 0.426882 -0.149972 1.189575
C -2.006985 0.062839 0.330033
C -0.027180 1.141255 -0.901505
C -0.455516 -1.340415 -0.960844
C 1.919109 -0.094710 0.902856
C -2.457885 -0.121950 1.658654
C -2.962910 0.345635 -0.681363
C 2.709920 -1.267265 0.803273
C -3.832104 -0.013224 1.973815
C -4.332535 0.454347 -0.367886
C -4.775262 0.276699 0.964302
C 0.104811 3.576234 -0.873693
C -0.130741 -3.763110 -0.988851
C 4.097921 -1.148641 0.573803
C 3.806364 1.258564 0.556855
C 4.662876 0.140206 0.446183
C -0.542628 4.728087 -0.112981
C 0.272106 -4.864952 -0.014820
H 0.192602 -1.077776 1.735911
H 0.175955 0.719739 1.820950
H -1.750946 -0.344938 2.462469
H -2.630112 0.466893 -1.718564
H 2.229470 -2.244777 0.899267
H -4.162096 -0.154859 3.009237
H -5.054555 0.675866 -1.161727
H -5.839852 0.361353 1.209632
H -0.085555 3.621707 -1.961257
H 1.195097 3.510958 -0.707477
H 0.548697 -3.688946 -1.856679
H -1.160836 -3.887506 -1.368451
H 4.726092 -2.042708 0.495902
H 4.201825 2.277029 0.465266
H 5.733780 0.279535 0.267849
H -0.129198 5.689815 -0.468438
H -1.635035 4.739323 -0.268492
H -0.345188 4.642135 0.968992
H -0.408955 -4.894874 0.852821
H 1.302389 -4.716717 0.353355
H 0.227634 -5.845001 -0.523867


