%chk=000032166.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000032166

0 1
 O  -0.4569000       1.300700     -0.9225000    
 O    1.249400     -0.9972000     -0.4505000    
 O    3.984100      -1.385200     -0.5723000    
 O  -0.4463000       1.854700       1.311900    
 N   -4.009200      0.3455000     -0.6889000    
 C   -2.556000      0.1848000     -0.6575000    
 C   -4.663100     -0.9500000     -0.8692000    
 C   -4.478900      0.9889000      0.5376000    
 C   -1.863400       1.498900     -0.9811000    
 C   -4.367600      -1.880800      0.2947000    
 C   -5.979900       1.219700      0.4964000    
 C    1.590900       1.275600      0.2168000    
 C    2.097000      2.8899999E-02 -0.1515000    
 C   0.1272000       1.513500      0.2890000    
 C   0.8519000      -1.841800      0.6267000    
 C    3.475800     -0.1731000     -0.2142000    
 C    2.463500       2.320100      0.5222000    
 C  -6.7800000E-02  -2.926600      8.7399997E-02
 C    4.348300      0.8714000      9.1399997E-02
 C    3.842000       2.118000      0.4596000    
 C  -0.5455000      -3.859600       1.185500    
 C    5.404700      -1.506500     -0.6113000    
 H   -2.226600     -0.5424000      -1.412200    
 H   -2.193500     -0.1966000      0.3056000    
 H   -4.302200      -1.411700      -1.797600    
 H   -5.743200     -0.8495000      -1.019700    
 H   -4.195500      0.4626000       1.456000    
 H   -4.027900       1.984100      0.6206000    
 H   -2.103500       1.807700      -2.005300    
 H   -2.160400       2.327500     -0.3301000    
 H   -4.821100      -1.556300       1.235300    
 H   -3.301900      -2.060800      0.4563000    
 H   -4.807300      -2.861400      7.4600004E-02
 H   -6.293100       1.683000     -0.4456000    
 H   -6.551600      0.2989000      0.6453000    
 H   -6.267900       1.901500       1.304700    
 H   0.3282000      -1.249600       1.386500    
 H    1.737900      -2.295300       1.087000    
 H   0.4576000      -3.500900     -0.6851000    
 H  -0.9275000      -2.468800     -0.4138000    
 H    2.081200       3.296400      0.8088000    
 H    5.429300      0.7882000      6.4400002E-02
 H    4.520600       2.932200      0.6973000    
 H   0.2987000      -4.358900       1.671600    
 H   -1.107200      -3.311100       1.948600    
 H   -1.202300      -4.629900      0.7694000    
 H    5.631900      -2.534000     -0.9143000    
 H    5.849500      -1.361900      0.3792000    
 H    5.845600     -0.8477000      -1.367100    


%chk=000032166-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000032166

0 1
O -0.527002 0.989316 -1.050204
O 1.288737 -0.990029 -0.396621
O 4.074503 -1.320681 -0.277784
O -0.535608 2.452417 0.764963
N -4.203243 0.321053 -0.460031
C -2.743438 0.099256 -0.362058
C -5.004730 -0.907333 -0.676968
C -4.720870 1.261370 0.566212
C -2.001436 1.169167 -1.189525
C -5.073787 -1.900990 0.516221
C -6.087211 1.870388 0.200558
C 1.543304 1.364375 0.122782
C 2.126456 0.081097 -0.084736
C 0.076654 1.643849 0.017370
C 1.501315 -2.310870 0.264389
C 3.552434 -0.046038 0.011717
C 2.360204 2.469665 0.485232
C 0.159110 -3.045330 0.201195
C 4.350404 1.065897 0.358376
C 3.750993 2.322873 0.603288
C 0.262565 -4.463918 0.804206
C 5.529883 -1.478303 -0.245908
H -2.489657 -0.897862 -0.765387
H -2.372278 0.132198 0.687875
H -4.581501 -1.426641 -1.558032
H -6.030481 -0.606808 -0.960849
H -4.784081 0.782836 1.575581
H -3.981929 2.078302 0.663607
H -2.197689 1.041634 -2.264376
H -2.279173 2.186489 -0.863631
H -5.556605 -1.445333 1.399785
H -4.063430 -2.237850 0.814609
H -5.660993 -2.795457 0.235454
H -6.038780 2.344851 -0.795562
H -6.890522 1.111515 0.182551
H -6.372165 2.637663 0.943776
H 1.824596 -2.149250 1.312346
H 2.294202 -2.861131 -0.270202
H -0.160727 -3.102044 -0.856394
H -0.604963 -2.452512 0.738613
H 1.873033 3.430565 0.674634
H 5.436916 0.962718 0.433836
H 4.375762 3.178687 0.877403
H 1.004652 -5.078371 0.260500
H 0.566790 -4.429235 1.867407
H -0.709803 -4.985075 0.750228
H 5.709311 -2.527734 -0.522359
H 5.936673 -1.284034 0.765750
H 6.021604 -0.810149 -0.979237


