%chk=000037102.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000037102

0 1
 O   -2.276000       2.625400      0.5992000    
 N    5.003500     -1.7300000E-02 -0.1849000    
 N  -0.5348000     -0.2330000      0.6030000    
 N   -1.113900     -0.4141000     -0.4931000    
 C    3.608800     -7.1800001E-02  1.5300000E-02
 C    2.849400       1.096600     -4.6799999E-02
 C    2.988200      -1.293900      0.2736000    
 C   -3.274500      0.6901000     -0.3567000    
 C   0.8559000     -0.1790000      0.4066000    
 C   -2.499400     -0.4680000     -0.2971000    
 C    1.469500       1.042900      0.1494000    
 C    1.608200      -1.347700      0.4697000    
 C    5.751800       1.169400      0.1796000    
 C    5.709800      -1.152700     -0.7448000    
 C   -4.653300      0.6174000     -0.1589000    
 C   -2.651100       2.019500     -0.6308000    
 C   -3.103100      -1.698800     -3.9700001E-02
 C   -5.257100     -0.6135000      9.8399997E-02
 C   -4.482000      -1.771600      0.1580000    
 H    3.299400       2.062400     -0.2580000    
 H    3.551200      -2.220500      0.3406000    
 H   0.8848000       1.957500      9.7199999E-02
 H    1.132600      -2.303300      0.6734000    
 H    5.647100       1.944800     -0.5865000    
 H    6.820400      0.9481000      0.2794000    
 H    5.422200       1.570900       1.144600    
 H    6.686000     -0.8534000      -1.142700    
 H    5.155000      -1.599900      -1.577500    
 H    5.886300      -1.915900      2.0400001E-02
 H   -5.269400       1.511800     -0.2003000    
 H   -1.769900       1.937100      -1.275800    
 H   -3.358800       2.681500      -1.143000    
 H   -2.508400      -2.607600      8.0000004E-03
 H   -6.330700     -0.6702000      0.2529000    
 H   -4.952200      -2.729900      0.3583000    
 H   -1.876500       3.485200      0.3834000    


%chk=000037102-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000037102

0 1
O -4.089127 1.021746 -3.025317
N 5.231518 -0.015659 -0.048920
N -0.362521 -0.159890 0.923999
N -1.188157 0.120982 -0.060604
C 3.854202 -0.041322 0.165618
C 3.307673 -0.367275 1.451139
C 2.933117 0.257277 -0.898701
C -3.485780 0.365819 -0.769580
C 1.014854 -0.097830 0.594130
C -2.575610 0.049309 0.285325
C 1.920909 -0.392855 1.650138
C 1.551748 0.229170 -0.687667
C 6.154248 -0.320140 1.054038
C 5.770578 0.315467 -1.376052
C -4.874345 0.317532 -0.518272
C -2.947769 0.747243 -2.137363
C -3.069768 -0.309709 1.571637
C -5.360528 -0.039513 0.759866
C -4.455804 -0.353327 1.805209
H 3.968153 -0.600426 2.290280
H 3.311407 0.511286 -1.893012
H 1.500791 -0.642317 2.630491
H 0.854972 0.456339 -1.500783
H 6.035176 0.391594 1.895450
H 7.192249 -0.249199 0.694096
H 5.998506 -1.344722 1.447442
H 6.870456 0.278310 -1.343404
H 5.473722 1.333707 -1.698174
H 5.428287 -0.402130 -2.148352
H -5.555946 0.562590 -1.336484
H -2.292896 1.637913 -2.042035
H -2.323727 -0.080777 -2.532829
H -2.345231 -0.546480 2.356543
H -6.440929 -0.073358 0.941269
H -4.837135 -0.630199 2.794824
H -3.748294 1.269344 -3.919546


