%chk=000117199.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000117199

0 1
 O  -0.7087000     -0.2612000      3.8699999E-02
 O    2.408000       1.325800      0.2823000    
 O   -2.168200      0.1993000       1.751500    
 O    3.183300       2.483600      -1.550300    
 O   -4.689900       1.013000      0.7631000    
 N   -2.803500      0.4133000     -0.4782000    
 N    3.078800       3.467300      0.5254000    
 C    1.618800      -1.009100      0.2924000    
 C    1.407600      -2.219000     -0.6657000    
 C   0.2997000     -0.5890000      0.9844000    
 C    2.191300      0.1784000     -0.5274000    
 C    2.649800      -1.353500       1.385700    
 C   0.8490000      -3.489800     -1.4400000E-02
 C   0.6315000      -4.587100      -1.047100    
 C   -1.920000      0.1252000      0.5526000    
 C    2.913100       2.427000     -0.3552000    
 C   -4.120700      0.8351000     -0.3103000    
 C   -4.819700       1.040800      -1.627400    
 H   0.7347000      -1.916900      -1.479200    
 H    2.365700      -2.465600      -1.143100    
 H   0.4763000      0.2835000       1.626800    
 H  -6.3800000E-02  -1.394700       1.633300    
 H    3.143800     -0.1169000     -0.9868000    
 H    1.495000      0.4402000      -1.334300    
 H    3.598100      -1.680900      0.9448000    
 H    2.861500     -0.4929000       2.030000    
 H    2.291300      -2.155100       2.039800    
 H  -0.1096000      -3.285400      0.4724000    
 H    1.536600      -3.862200      0.7515000    
 H    1.571400      -4.851900      -1.541700    
 H  -8.3300002E-02  -4.269400      -1.812900    
 H   0.2357000      -5.487000     -0.5658000    
 H   -2.450500      0.3007000      -1.425000    
 H    3.444600       4.363400      0.2220000    
 H    2.840300       3.371500       1.506800    
 H   -4.967400      7.5000003E-02  -2.118400    
 H   -4.223300       1.691600      -2.273200    
 H   -5.792900       1.510300      -1.458900    


%chk=000117199-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000117199

0 1
O -0.738564 -0.600879 0.277397
O 2.020099 1.194177 0.112749
O -1.367811 1.117389 1.768940
O 0.373327 2.160233 -1.290265
O -3.592006 2.613345 0.538944
N -2.400872 0.786837 -0.354563
N 1.316660 3.316587 0.519578
C 1.647010 -1.269663 0.289137
C 1.420783 -2.505542 -0.639998
C 0.403471 -0.969075 1.155717
C 1.942985 -0.074258 -0.652540
C 2.840777 -1.485080 1.256616
C 1.268388 -3.873359 0.064601
C 1.017744 -5.012771 -0.948161
C -1.502825 0.516615 0.687545
C 1.155696 2.232494 -0.306983
C -3.337329 1.849897 -0.420819
C -3.985155 1.967424 -1.798583
H 0.515952 -2.319539 -1.253132
H 2.274876 -2.570698 -1.347445
H 0.592913 -0.132842 1.850780
H 0.097513 -1.858203 1.733990
H 2.928730 -0.206840 -1.133975
H 1.161009 0.032687 -1.424428
H 3.725404 -1.851744 0.703503
H 3.113746 -0.535347 1.749848
H 2.605622 -2.225259 2.042651
H 0.426287 -3.839051 0.783687
H 2.178084 -4.102193 0.652466
H 1.855408 -5.096958 -1.666090
H 0.094687 -4.830023 -1.529776
H 0.909625 -5.987912 -0.439209
H -2.238555 0.238594 -1.202886
H 0.693942 4.111270 0.401634
H 1.916387 3.251547 1.338595
H -4.387143 0.998809 -2.148156
H -3.239294 2.316878 -2.536769
H -4.803170 2.699853 -1.746400


