%chk=000103567.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000103567

0 1
 O   0.4549000      -1.392700     -0.8908000    
 O    4.331700     -0.5319000     -0.6896000    
 N   -1.261400     -9.8999999E-03 -0.1527000    
 N    2.233900      0.5070000     -0.7323000    
 C    1.096800      0.6306000      0.1352000    
 C    1.646300      0.2779000       1.504200    
 C    2.823700     -0.6515000       1.210900    
 C   7.7399999E-02 -0.3499000     -0.3499000    
 C   -2.355700     -0.8739000     -0.5767000    
 C   -1.663900       1.236900      0.4931000    
 C    3.268400     -0.2322000     -0.1690000    
 C   -2.731800      -1.841000      0.5430000    
 C   -1.831600       2.342100     -0.5466000    
 C   -3.858700      -2.769600      0.1177000    
 C   -2.230200       3.658100      0.1034000    
 H   0.7785000       1.669800      7.1599998E-02
 H   0.9128000     -0.1854000       2.171500    
 H    2.020700       1.184700       1.996000    
 H    2.509700      -1.699200       1.178500    
 H    3.630300     -0.5249000       1.937100    
 H    2.269100      0.8828000      -1.674900    
 H   -3.212100     -0.2639000     -0.8844000    
 H   -2.026500      -1.444700      -1.452900    
 H   -2.610700       1.070300       1.021300    
 H  -0.9433000       1.527300       1.262900    
 H   -1.859500      -2.440100      0.8313000    
 H   -3.040800      -1.286200       1.436600    
 H  -0.9099000       2.488200      -1.120100    
 H   -2.602300       2.058300      -1.273300    
 H   -4.113400      -3.454300      0.9326000    
 H   -4.757400      -2.201400     -0.1424000    
 H   -3.566600      -3.368600     -0.7507000    
 H   -3.175700       3.557400      0.6459000    
 H   -1.462700       3.994900      0.8077000    
 H   -2.356500       4.434100     -0.6580000    


%chk=000103567-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000103567

0 1
O 0.333214 -1.435029 -1.076535
O 4.465025 -0.883094 -0.519246
N -1.229640 0.048505 -0.197462
N 2.458353 0.333406 -0.773762
C 1.217231 0.623492 -0.054487
C 1.641031 0.386314 1.442780
C 2.808734 -0.625010 1.351535
C 0.071487 -0.336251 -0.492453
C -2.331280 -0.867500 -0.587320
C -1.608872 1.312476 0.474368
C 3.380468 -0.435747 -0.065171
C -2.673790 -1.895685 0.515763
C -1.946784 2.460830 -0.508357
C -3.853965 -2.801382 0.105188
C -2.418573 3.731462 0.230052
H 0.913628 1.673196 -0.218408
H 0.800202 0.019614 2.054540
H 1.993599 1.340213 1.873462
H 2.461320 -1.670865 1.432056
H 3.594967 -0.468137 2.106690
H 2.525664 0.402694 -1.790168
H -3.221410 -0.254453 -0.829326
H -2.019454 -1.403666 -1.500611
H -2.493471 1.104598 1.108101
H -0.808377 1.632689 1.164123
H -1.774431 -2.508958 0.709683
H -2.916927 -1.364324 1.458198
H -1.055348 2.688983 -1.125206
H -2.731706 2.117769 -1.209969
H -4.080810 -3.540600 0.894063
H -4.771728 -2.210262 -0.077249
H -3.621218 -3.359197 -0.820862
H -3.330071 3.534013 0.825093
H -1.640880 4.108264 0.921028
H -2.652690 4.540740 -0.483930


