%chk=000064672.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000064672

0 1
 O    6.894900       1.927500      0.8623000    
 O    5.224900       2.430900     -0.6134000    
 N    6.287300     -0.8615000     -0.1609000    
 C    5.086800     -0.8240000      0.7058000    
 C    3.826800     -0.6191000     -0.1268000    
 C    2.515400     -0.5103000      0.6594000    
 C    1.280800     -0.3609000     -0.2329000    
 C    6.444300      0.4545000     -0.9372000    
 C  -3.1000001E-03 -0.3487000      0.6004000    
 C    6.190800      -2.005800      -1.181000    
 C    7.559100      -1.075200      0.6733000    
 C   -1.277300     -0.2366000     -0.2423000    
 C   -2.596900     -0.2428000      0.5357000    
 C   -3.830200     -6.5399997E-02 -0.3534000    
 C   -5.115800     -7.0900001E-02  0.4780000    
 C   -6.386300      7.7900000E-02 -0.3644000    
 C   -7.675100     -1.2000001E-03  0.4590000    
 C    6.166600       1.726700     -0.1485000    
 C   -8.909800      0.1653000     -0.4308000    
 C   -10.22720      0.1247000      0.3467000    
 C   -11.45590      0.3151000     -0.5291000    
 H    5.200300     -3.7799999E-02   1.459700    
 H    5.030600      -1.779700       1.242100    
 H    3.693000      -1.468300     -0.8061000    
 H    3.886400      0.2694000     -0.7584000    
 H    2.577400      0.3470000       1.341000    
 H    2.405500      -1.405000       1.284700    
 H    1.354800      0.5656000     -0.8143000    
 H    1.242000      -1.190800     -0.9487000    
 H    5.785000      0.4073000      -1.812800    
 H    7.468900      0.4876000      -1.328500    
 H  -5.6400001E-02  -1.266700       1.198700    
 H   3.1099999E-02  0.4885000       1.308300    
 H    5.960100      -2.929600     -0.6424000    
 H    7.160700      -2.093800      -1.681000    
 H    5.426000      -1.781600      -1.928200    
 H    8.431800      -1.009100      1.7200001E-02
 H    7.499700      -2.073100       1.119400    
 H    7.603700     -0.3261000       1.465800    
 H   -1.222600      0.6874000     -0.8320000    
 H   -1.295200      -1.062400     -0.9649000    
 H   -2.571400      0.5609000       1.281900    
 H   -2.678100      -1.186100       1.089700    
 H   -3.867000     -0.8729000      -1.094200    
 H   -3.754600      0.8787000     -0.9058000    
 H   -5.172600      -1.008800       1.044600    
 H   -5.077200      0.7416000       1.214200    
 H   -6.401500     -0.7077000      -1.130100    
 H   -6.351100       1.037100     -0.8957000    
 H   -7.722900     -0.9658000      0.9782000    
 H   -7.667100      0.7811000       1.227300    
 H   -8.842300       1.120200     -0.9671000    
 H   -8.917900     -0.6249000      -1.191800    
 H   -10.30990     -0.8354000      0.8699000    
 H   -10.21850      0.9059000       1.116200    
 H   -11.42590       1.283700      -1.038000    
 H   -11.51850     -0.4703000      -1.288800    
 H   -12.36570      0.2763000      7.7799998E-02


%chk=000064672-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000064672

0 1
O 6.272431 1.843663 1.097601
O 6.538696 2.889833 -0.991954
N 6.424909 -0.773201 -0.123722
C 5.044423 -0.767499 0.583607
C 3.825092 -0.666756 -0.344097
C 2.525726 -0.685062 0.500602
C 1.251694 -0.557448 -0.364365
C 6.623550 0.523901 -0.966037
C -0.047856 -0.573957 0.471508
C 6.567976 -1.985847 -1.022599
C 7.498975 -0.814837 0.962892
C -1.325567 -0.411287 -0.382301
C -2.624029 -0.429325 0.455429
C -3.901765 -0.216645 -0.387217
C -5.198301 -0.235749 0.453586
C -6.474522 0.021670 -0.378836
C -7.769507 0.002788 0.464625
C 6.454365 1.897494 -0.188985
C -9.044429 0.289115 -0.360431
C -10.338562 0.269146 0.485130
C -11.606137 0.568619 -0.344221
H 5.097775 0.112032 1.251431
H 5.009302 -1.701824 1.175960
H 3.786666 -1.501881 -1.071911
H 3.856852 0.279342 -0.915228
H 2.557141 0.147587 1.231191
H 2.475754 -1.624430 1.090368
H 1.299524 0.385279 -0.947205
H 1.221731 -1.383729 -1.105460
H 5.904276 0.488302 -1.799972
H 7.647140 0.469864 -1.378731
H -0.106490 -1.524034 1.043222
H -0.007085 0.240503 1.224253
H 6.407130 -2.902131 -0.430007
H 7.582137 -1.991607 -1.452176
H 5.828086 -1.930491 -1.833919
H 8.489341 -0.827776 0.479378
H 7.357280 -1.723105 1.571023
H 7.367623 0.107589 1.555031
H -1.267980 0.542936 -0.946452
H -1.367661 -1.219849 -1.142061
H -2.566165 0.360033 1.233964
H -2.698035 -1.395313 0.997877
H -3.961400 -1.000428 -1.171383
H -3.827882 0.753068 -0.922721
H -5.287291 -1.215246 0.968861
H -5.124762 0.529995 1.254229
H -6.549758 -0.740169 -1.183034
H -6.385196 1.003509 -0.889440
H -7.868831 -0.984991 0.961986
H -7.685440 0.752700 1.279140
H -8.946939 1.278578 -0.854687
H -9.130686 -0.458040 -1.177274
H -10.439452 -0.722218 0.972596
H -10.247746 1.010358 1.305400
H -11.545957 1.569628 -0.811919
H -11.732190 -0.172390 -1.156367
H -12.517274 0.542336 0.281623


