%chk=000028892.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000028892

0 1
 O   -2.262600       1.019200     -0.2207000    
 O   0.4967000       1.095300      0.2688000    
 O    2.395000       1.903200     -0.7553000    
 N   -5.565300     -0.5821000      2.2700001E-02
 C    2.430000     -0.2578000      0.3902000    
 C   -4.195000     -0.3751000     -0.4215000    
 C    2.267000     -0.3649000       1.919900    
 C   -6.400400      0.5725000     -0.3172000    
 C   -6.123200      -1.800800     -0.5688000    
 C   -3.602300      0.8659000      0.2267000    
 C    3.866700     -0.4055000     -8.6599998E-02
 C    1.810000       1.043500     -0.1094000    
 C   -1.649800       2.167800      0.3525000    
 C    2.743000      -1.700600       2.477900    
 C   -7.817200      0.3971000      0.2026000    
 C   -5.273600      -3.013900     -0.2302000    
 C  -0.2195000       2.264300     -0.1421000    
 C    4.109700      -1.037100      -1.289700    
 C    4.885800      9.6000001E-02  0.6978000    
 C    5.427400      -1.173100      -1.726800    
 C    6.203400     -3.9700001E-02  0.2607000    
 C    6.474100     -0.6743000     -0.9516000    
 H    1.844100      -1.069500     -6.5099999E-02
 H   -3.539700      -1.204400     -0.1332000    
 H   -4.124400     -0.2930000      -1.514600    
 H    2.754900      0.4630000       2.446600    
 H    1.203600     -0.2740000       2.177100    
 H   -6.045800       1.480200      0.1775000    
 H   -6.418400      0.7650000      -1.397100    
 H   -7.115300      -2.010200     -0.1558000    
 H   -6.227000      -1.716900      -1.658000    
 H   -3.617600      0.7744000       1.319600    
 H   -4.127400       1.778600     -6.5700002E-02
 H   -1.656300       2.066900       1.444000    
 H   -2.203500       3.068900      6.6900000E-02
 H    2.246600      -2.534800       1.971700    
 H    2.499900      -1.765100       3.543800    
 H    3.823600      -1.834000       2.382000    
 H   -8.350300       1.353200      0.1458000    
 H   -7.829500      7.9700001E-02   1.251100    
 H   -8.396200     -0.3158000     -0.3924000    
 H   -5.829300      -3.927600     -0.4709000    
 H   -5.028300      -3.055300      0.8366000    
 H   -4.347800      -3.053300     -0.8126000    
 H   0.2614000       3.155700      0.2755000    
 H  -0.2079000       2.314100      -1.237000    
 H    3.301200      -1.426300      -1.901200    
 H    4.713400      0.6173000       1.632300    
 H    5.638300      -1.666300      -2.671200    
 H    7.018500      0.3537000      0.8611000    
 H    7.500000     -0.7786000      -1.292600    


%chk=000028892-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000028892

0 1
O -2.247584 1.253267 0.221423
O 0.497963 1.193051 1.446097
O 2.384714 2.517647 1.118401
N -5.318650 -0.584079 -0.877062
C 2.640241 0.094323 1.592853
C -3.939855 -0.034293 -0.925177
C 3.768652 0.343373 2.641646
C -6.344424 0.406872 -1.302227
C -5.453350 -1.897115 -1.561938
C -3.597464 0.695627 0.381130
C 3.183465 -0.444737 0.261889
C 1.875173 1.396565 1.356633
C -1.799880 1.983977 1.405241
C 4.513697 -0.947808 3.034412
C -7.730751 0.141574 -0.684215
C -4.841794 -3.057968 -0.754578
C -0.352895 2.393340 1.197028
C 2.835098 -1.746780 -0.174250
C 4.056340 0.336679 -0.539334
C 3.353904 -2.266470 -1.382466
C 4.573430 -0.180464 -1.747206
C 4.226869 -1.484638 -2.172677
H 1.922640 -0.639377 2.001680
H -3.216031 -0.857394 -1.055667
H -3.787896 0.663358 -1.781927
H 4.475598 1.087396 2.230374
H 3.317792 0.802718 3.543478
H -6.000280 1.406973 -0.977781
H -6.429255 0.452521 -2.418100
H -6.531898 -2.095813 -1.699102
H -5.003572 -1.870899 -2.587044
H -3.628650 -0.017845 1.231630
H -4.328402 1.510396 0.585434
H -1.891158 1.356664 2.318666
H -2.420943 2.898163 1.547410
H 3.823728 -1.689705 3.479391
H 5.300932 -0.731044 3.779143
H 4.994196 -1.416330 2.157216
H -8.450512 0.920629 -0.998409
H -7.660662 0.144163 0.417518
H -8.140692 -0.836249 -0.995520
H -4.976804 -4.016025 -1.290874
H -5.329326 -3.131620 0.233131
H -3.758130 -2.917137 -0.589407
H -0.049827 3.190746 1.899794
H -0.185094 2.744595 0.164079
H 2.153578 -2.354874 0.433057
H 4.311025 1.355175 -0.224160
H 3.075725 -3.276068 -1.705736
H 5.242852 0.434791 -2.359247
H 4.628870 -1.884353 -3.110547


