%chk=000160653.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000160653

0 1
 O  -0.2256000       2.297100      2.2800000E-02
 O   0.9417000      -3.165700       2.738200    
 O  -0.3813000      -1.375200       2.280200    
 N   -5.000000       2.110000      3.6200002E-02
 N    4.510200       2.726700      4.4000000E-02
 C   5.0799999E-02 -0.5276000     -0.3677000    
 C   -1.275200      0.1344000     -0.2657000    
 C    1.157500      0.2583000     -0.2684000    
 C   -1.343900       1.514400     -7.5700000E-02
 C    1.028300       1.710300     -6.7699999E-02
 C   0.2017000      -1.973700     -0.5671000    
 C   -2.481100     -0.5808000     -0.3537000    
 C   -2.573300       2.173400      2.4800001E-02
 C    2.518000     -0.2898000     -0.3547000    
 C   -3.758700       1.450500     -6.4599998E-02
 C    2.107200       2.500300      3.2400001E-02
 C   -3.712600      7.2999999E-02 -0.2538000    
 C   0.2868000      -2.843600      0.5135000    
 C    3.481800       1.946100     -5.4900002E-02
 C   0.2588000      -2.453400      -1.870700    
 C    3.608400      0.4808000     -0.2576000    
 C   0.4313000      -4.212400      0.2878000    
 C   0.4034000      -3.822300      -2.096400    
 C   -6.253600       1.425400     -4.7200002E-02
 C   0.4898000      -4.701800      -1.017100    
 C   0.2311000      -2.372700       1.892400    
 C   -7.397100       2.407600      0.1196000    
 C    5.790600       2.045200     -6.0300000E-02
 C    6.904800       3.065400      5.1500000E-02
 H   -2.489300      -1.658000     -0.5008000    
 H   -2.597000       3.250700      0.1729000    
 H    2.672000      -1.353500     -0.5006000    
 H    2.009100       3.571000      0.1803000    
 H   -4.609800     -0.5342000     -0.3302000    
 H   0.1924000      -1.781800      -2.723100    
 H    4.569100     -1.1800000E-02 -0.3309000    
 H   -4.982800       3.115100      0.1704000    
 H   0.4873000      -4.926600       1.105100    
 H   0.4479000      -4.203600      -3.112300    
 H   -6.359900      0.9295000      -1.019000    
 H   -6.334100      0.6663000      0.7395000    
 H   0.5991000      -5.767900      -1.193400    
 H   -7.372700       3.176700     -0.6599000    
 H   -7.343600       2.913300       1.089800    
 H   -8.358900       1.889100      5.7500001E-02
 H    5.930200       1.322600      0.7532000    
 H    5.907400       1.550200      -1.032200    
 H    7.882100       2.578800     -2.4100000E-02
 H    6.831500       3.814300     -0.7442000    
 H    6.857400       3.593600       1.009800    
 H   0.8993000      -2.842800       3.663600    


%chk=000160653-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000160653

0 1
O -0.126218 2.257365 0.014522
O -0.293520 -3.691311 2.825896
O -0.144783 -1.422642 2.381990
N -4.929011 2.085377 0.076287
N 4.615109 2.844707 -0.076631
C 0.111314 -0.587142 -0.300482
C -1.193874 0.040437 -0.220328
C 1.264044 0.209673 -0.256925
C -1.276728 1.461784 -0.054189
C 1.157113 1.656457 -0.096529
C 0.205736 -2.069947 -0.509738
C -2.430290 -0.662600 -0.294869
C -2.496059 2.138258 0.043310
C 2.616105 -0.313543 -0.337085
C -3.720351 1.410616 -0.024586
C 2.245759 2.492362 -0.040111
C -3.666747 -0.010800 -0.202117
C 0.061470 -3.035028 0.536322
C 3.606538 1.968727 -0.134491
C 0.427701 -2.540204 -1.829704
C 3.723726 0.503793 -0.282042
C 0.135412 -4.423248 0.239207
C 0.501619 -3.920342 -2.118042
C -6.248382 1.443043 0.028019
C 0.351222 -4.867805 -1.079336
C -0.129151 -2.598046 1.949732
C -7.362951 2.492906 0.171147
C 6.007853 2.346606 -0.164070
C 6.980892 3.534792 -0.081724
H -2.409930 -1.749203 -0.431304
H -2.486572 3.225562 0.172388
H 2.739242 -1.397563 -0.440975
H 2.120389 3.571081 0.080984
H -4.590586 -0.591993 -0.263946
H 0.538780 -1.804807 -2.633435
H 4.723022 0.059392 -0.344820
H -4.904326 3.096323 0.210525
H 0.026736 -5.137389 1.059276
H 0.674377 -4.252122 -3.147719
H -6.370684 0.897984 -0.931555
H -6.336319 0.691374 0.840835
H 0.406488 -5.939958 -1.294911
H -7.318108 3.235100 -0.647042
H -7.284711 3.028154 1.135442
H -8.353225 2.007925 0.133732
H 6.232082 1.628199 0.658227
H 6.180479 1.792221 -1.115733
H 8.033252 3.198340 -0.142929
H 6.786580 4.243937 -0.905498
H 6.837057 4.078669 0.868359
H -0.401070 -3.334569 3.748165


