%chk=000028922.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000028922

0 1
 O    1.355700       1.673500     -0.5802000    
 O   -2.200800      0.5470000       1.940400    
 O  -0.7798000       2.485300     -0.5484000    
 N   -2.674900     -0.4932000     -8.8200003E-02
 C   -4.086800     -0.7437000      0.1916000    
 C   -2.199200     -0.9513000      -1.387100    
 C   -1.835300      0.1444000      0.8301000    
 C  -0.4369000      0.3586000      0.4383000    
 C    1.828700     -0.4988000      0.4037000    
 C   0.4211000     -0.6198000      0.7503000    
 C    2.263600      0.6471000     -0.2544000    
 C   -4.952100      0.4172000     -0.2685000    
 C   -1.685200      -2.379000      -1.311100    
 C   3.3000000E-03   1.586200     -0.2617000    
 C    2.759300      -1.494900      0.7093000    
 C    3.598100      0.8250000     -0.6139000    
 C    4.101500      -1.330700      0.3549000    
 C    4.519700     -0.1730000     -0.3051000    
 H   -4.398100      -1.678700     -0.2859000    
 H   -4.209900     -0.8684000       1.273200    
 H   -3.020400     -0.8879000      -2.110300    
 H   -1.408800     -0.2985000      -1.767000    
 H   0.1043000      -1.513200       1.279900    
 H   -4.656500       1.348600      0.2258000    
 H   -4.866200      0.5721000      -1.348700    
 H   -6.003300      0.2242000     -3.3799998E-02
 H  -0.8597000      -2.501600     -0.6099000    
 H   -2.480500      -3.064000     -0.9984000    
 H   -1.336300      -2.702800      -2.297100    
 H    2.454500      -2.403600       1.222400    
 H    3.921400       1.725400      -1.127100    
 H    4.822500      -2.107200      0.5941000    
 H    5.564000     -5.1700000E-02 -0.5776000    


%chk=000028922-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000028922

0 1
O 1.403684 1.224582 -1.032137
O -2.015816 -0.136708 1.916960
O -0.804139 1.742810 -1.397944
N -2.740125 -0.591879 -0.248280
C -4.136645 -0.706791 0.247232
C -2.500381 -0.929444 -1.670247
C -1.765690 -0.251311 0.668522
C -0.334323 -0.040999 0.205467
C 2.070077 -0.477710 0.605104
C 0.672367 -0.711300 0.877113
C 2.404273 0.508114 -0.370051
C -4.880589 0.643745 0.187121
C -2.342762 -2.449101 -1.899954
C -0.011902 1.009935 -0.773216
C 3.130492 -1.169126 1.259349
C 3.743488 0.804260 -0.698009
C 4.467953 -0.883427 0.941440
C 4.771547 0.102909 -0.038377
H -4.652530 -1.467470 -0.366894
H -4.098556 -1.066075 1.289707
H -3.355866 -0.541914 -2.254508
H -1.615918 -0.390262 -2.037196
H 0.391016 -1.429114 1.656209
H -4.378749 1.381581 0.835187
H -4.905474 1.045155 -0.841964
H -5.921975 0.522807 0.538032
H -1.459528 -2.837390 -1.362047
H -3.230318 -3.005907 -1.548714
H -2.211940 -2.659792 -2.977247
H 2.885911 -1.924516 2.014870
H 3.953879 1.569526 -1.450318
H 5.279479 -1.415998 1.446966
H 5.816061 0.323412 -0.282578


