%chk=000108112.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000108112

0 1
 O    1.356400       2.230600      0.3302000    
 O    5.189000      -1.713300     -5.8600001E-02
 O   -2.426900      -2.007100      0.3167000    
 O   -4.404100      -1.967500       1.427700    
 N   -5.626200      -1.072600     -0.8606000    
 C   -2.595000       1.138700     -0.2002000    
 C   -4.039400      0.7383000     -0.3942000    
 C    2.456800      -2.462400     -0.4244000    
 C   5.2800000E-02   1.869900      0.1552000    
 C  -0.5141000       1.899100      -1.119100    
 C  -0.7139000       1.472300       1.250500    
 C    2.883600      -1.061200     -0.1358000    
 C   -4.210100     -0.7619000     -0.6797000    
 C   -1.847500       1.531000      -1.298000    
 C   -2.047400       1.104100       1.071500    
 C    2.314800       1.237700      0.2320000    
 C    1.917200     -6.0300000E-02 -3.6200002E-02
 C    1.761000      -2.594500      -1.791800    
 C    1.553900      -3.040900      0.6807000    
 C    4.232200     -0.7478000      3.4499999E-02
 C   0.2906000       2.321800      -2.303800    
 C  -0.1252000       1.434800       2.622600    
 C    3.647600       1.567200      0.4039000    
 C    4.614100      0.5664000      0.3043000    
 C   -3.720300      -1.622200      0.4726000    
 H   -4.606700       1.025000      0.5027000    
 H   -4.469100       1.329600      -1.214300    
 H    3.334200      -3.119200     -0.4696000    
 H   -3.674300      -1.057400      -1.589200    
 H   -2.293500       1.547200      -2.289000    
 H   -2.648400      0.7955000       1.922900    
 H   0.8831000     -0.3518000     -0.1758000    
 H   0.8105000      -2.051100      -1.824800    
 H    1.549200      -3.646100      -2.014100    
 H    2.399000      -2.203900      -2.592400    
 H    2.044800      -2.974900       1.658000    
 H    1.336200      -4.096500      0.4849000    
 H   0.5971000      -2.512600      0.7500000    
 H   0.8839000       3.214300      -2.078200    
 H   0.9595000       1.514500      -2.617900    
 H  -0.3512000       2.577600      -3.154000    
 H   0.5070000      0.5493000       2.741800    
 H   0.4705000       2.332300       2.819700    
 H  -0.9040000       1.398900       3.392300    
 H    3.946200       2.589800      0.6138000    
 H    5.661000      0.8249000      0.4394000    
 H   -5.994400     -0.5360000      -1.645400    
 H   -6.155900     -0.7675000     -4.4199999E-02
 H    6.061900      -1.310300      8.7899998E-02
 H   -2.120600      -2.570900       1.058600    


%chk=000108112-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000108112

0 1
O 1.343527 2.270341 0.241235
O 5.198504 -1.845482 0.046007
O -2.449304 -2.005946 -0.071738
O -4.082372 -1.795417 1.565312
N -5.778644 -1.100361 -0.659706
C -2.783792 1.324233 -0.030631
C -4.229243 0.874173 -0.141900
C 2.512766 -2.642724 -0.288180
C -0.044172 1.936361 0.150223
C -0.664830 1.979513 -1.123167
C -0.750501 1.636999 1.341400
C 2.877686 -1.175766 -0.050689
C -4.387786 -0.635615 -0.589713
C -2.043832 1.670781 -1.188428
C -2.127431 1.331028 1.225029
C 2.282564 1.203132 0.185027
C 1.907658 -0.147255 -0.004740
C 2.794838 -3.028619 -1.769437
C 1.056614 -2.994772 0.095406
C 4.241795 -0.802178 0.097708
C 0.138256 2.331344 -2.359179
C -0.041985 1.637360 2.680928
C 3.638078 1.560794 0.331797
C 4.618000 0.547588 0.286500
C -3.663662 -1.527783 0.416095
H -4.755376 0.985578 0.824864
H -4.775153 1.476376 -0.893887
H 3.194457 -3.250781 0.338079
H -3.905709 -0.764172 -1.573619
H -2.544475 1.691509 -2.165172
H -2.694917 1.083106 2.130978
H 0.848852 -0.398972 -0.113532
H 2.149581 -2.445130 -2.452636
H 2.590207 -4.102972 -1.934513
H 3.849070 -2.834290 -2.030412
H 0.835142 -2.704014 1.139972
H 0.901138 -4.085046 -0.001670
H 0.328753 -2.496209 -0.573050
H 0.658392 3.297749 -2.233342
H 0.922361 1.576216 -2.556274
H -0.510767 2.392708 -3.249062
H 0.726102 0.842498 2.729983
H 0.485525 2.593169 2.850213
H -0.756072 1.476594 3.505893
H 3.907567 2.610009 0.480465
H 5.676992 0.814271 0.401328
H -6.361603 -0.611552 -1.342933
H -6.222275 -1.216569 0.256595
H 6.106436 -1.488539 0.206883
H -1.991060 -2.542369 0.632786


