%chk=000093786.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000093786

0 1
 O    1.308600      -2.338300     -0.4947000    
 O   -1.308500      -2.338300      0.4949000    
 O    2.614800      0.1145000     -0.3960000    
 O   -2.614500      0.1146000      0.3961000    
 N    2.829100       2.616900       2.260200    
 N   -2.830400       2.616200      -2.260100    
 C   0.7510000      -3.496500      0.1105000    
 C  -0.7493000      -3.497300     -0.1112000    
 C    2.715900      -2.274000     -0.2987000    
 C   -2.714300      -2.275200      0.2989000    
 C    3.251600      -1.021200     -0.9646000    
 C   -3.251000      -1.023000      0.9650000    
 C    3.096300       1.323700     -0.9695000    
 C   -3.096700       1.322000      0.9692000    
 C    2.387400       2.510000     -0.3311000    
 C   -2.388800       2.509000      0.3312000    
 C    2.635000       2.568900       1.117200    
 C   -2.636300       2.568100      -1.117100    
 H    1.193800      -4.396700     -0.3297000    
 H   0.9648000      -3.474900       1.185500    
 H   -1.191600      -4.397500      0.3292000    
 H  -0.9634000      -3.475300      -1.186100    
 H    2.921900      -2.235700      0.7774000    
 H    3.195100      -3.160300     -0.7288000    
 H   -2.920700      -2.236700     -0.7770000    
 H   -3.193300      -3.161800      0.7285000    
 H    3.030100      -1.050100      -2.037800    
 H    4.335600     -0.9570000     -0.8196000    
 H   -3.029400      -1.051400       2.038100    
 H   -4.335100     -0.9592000      0.8196000    
 H    4.179100       1.398900     -0.8100000    
 H    2.899800       1.320800      -2.048000    
 H   -4.179500       1.396800      0.8099000    
 H   -2.900500       1.319500       2.047700    
 H    1.307400       2.422800     -0.4982000    
 H    2.722900       3.438600     -0.8048000    
 H   -1.308700       2.422900      0.4985000    
 H   -2.725200       3.437200      0.8050000    


%chk=000093786-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000093786

0 1
O 1.461363 -2.673315 -0.504286
O -1.457611 -2.671898 0.502924
O 2.407928 0.154059 -0.532051
O -2.406455 0.155232 0.533734
N 1.604410 3.260774 1.310618
N -1.609553 3.262176 -1.310034
C 0.720833 -3.690075 0.251439
C -0.718076 -3.689319 -0.252920
C 2.613362 -2.137171 0.220046
C -2.609675 -2.135485 -0.221118
C 3.245907 -1.044033 -0.629295
C -3.243310 -1.043823 0.629297
C 2.901011 1.260849 -1.342524
C -2.902459 1.261168 1.343631
C 1.882430 2.406728 -1.199235
C -1.886625 2.409489 1.200434
C 1.743907 2.878378 0.189102
C -1.748402 2.880644 -0.188133
H 1.192988 -4.686355 0.101464
H 0.715558 -3.458253 1.337293
H -1.191263 -4.685129 -0.103047
H -0.712560 -3.457388 -1.338751
H 2.295336 -1.710951 1.195106
H 3.365912 -2.937316 0.407472
H -2.291579 -1.707927 -1.195572
H -3.361681 -2.935862 -0.409748
H 3.319124 -1.385993 -1.684547
H 4.270231 -0.822834 -0.252676
H -3.316586 -1.387054 1.684127
H -4.267696 -0.823038 0.252587
H 3.911231 1.581770 -1.003447
H 2.965025 0.970770 -2.414632
H -3.913282 1.579572 1.003968
H -2.966298 0.971286 2.415802
H 0.891131 2.064322 -1.546845
H 2.180875 3.257367 -1.840383
H -0.894664 2.069921 1.548945
H -2.187788 3.259717 1.840859


