%chk=000070818.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000070818

0 1
 O    1.630700      0.7690000     -0.1774000    
 O    1.556800      -1.636300     -0.4604000    
 O   -3.052800      -2.063000     -0.8433000    
 N   -1.764000       2.016300      6.3299999E-02
 C    2.296300     -0.4963000     -2.4000001E-03
 C  -0.4450000     -0.4567000      0.1124000    
 C   0.2782000      -1.763900      0.1537000    
 C   0.2744000      0.7254000     -4.0600002E-02
 C   -1.829700     -0.3933000      0.2620000    
 C    2.732400     -0.6486000       1.460100    
 C    3.545900     -0.4363000     -0.8857000    
 C  -0.4222000       1.923200     -6.6500001E-02
 C   -2.433800      0.8539000      0.2274000    
 C   -2.669500      -1.610100      0.4498000    
 C   0.3022000       3.216500     -0.2524000    
 H   0.3929000      -2.119600       1.183000    
 H  -0.2550000      -2.529400     -0.4181000    
 H    3.406300      0.1625000       1.756800    
 H    1.876300     -0.6005000       2.141500    
 H    3.229100      -1.610000       1.627400    
 H    4.133000      -1.358000     -0.8117000    
 H    3.262200     -0.3177000      -1.938300    
 H    4.181400      0.4173000     -0.6261000    
 H   -3.508800      0.9652000      0.3317000    
 H   -2.146500      -2.414300      0.9751000    
 H   -3.574200      -1.390600       1.027600    
 H   0.8311000       3.225000      -1.210900    
 H  -0.3947000       4.061400     -0.2480000    
 H    1.021200       3.372900      0.5582000    
 H   -3.528000      -1.341000      -1.289200    


%chk=000070818-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000070818

0 1
O 1.636099 0.782896 -0.291745
O 1.562356 -1.620236 -0.615995
O -2.768219 -2.439365 -0.672520
N -1.754129 2.105375 0.203566
C 2.354545 -0.527749 -0.064383
C -0.474963 -0.439710 0.122096
C 0.239066 -1.773737 0.021295
C 0.253387 0.760917 -0.056883
C -1.876463 -0.341931 0.354932
C 2.607981 -0.670751 1.447364
C 3.618485 -0.444395 -0.908829
C -0.413379 2.025673 -0.026073
C -2.453991 0.946246 0.394377
C -2.741011 -1.574991 0.532971
C 0.355388 3.305064 -0.248048
H 0.346167 -2.252877 1.018265
H -0.320594 -2.465272 -0.628068
H 3.295542 0.123351 1.782597
H 1.676532 -0.580182 2.031588
H 3.067986 -1.651945 1.657696
H 4.247219 -1.333748 -0.736630
H 3.344686 -0.401470 -1.974842
H 4.189252 0.461406 -0.646999
H -3.528490 1.065044 0.581997
H -2.346884 -2.245885 1.315704
H -3.769336 -1.275396 0.819810
H 0.850399 3.305048 -1.236777
H -0.336458 4.158435 -0.182701
H 1.159127 3.422687 0.502339
H -3.094100 -1.899500 -1.437106


