%chk=000264719.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000264719

0 1
S 1.368400 -0.930104 0.063766
O 8.253177 -0.045290 -1.098261
N 6.338226 -0.447283 0.223508
N 4.524135 -1.862143 0.072952
N 2.670883 1.411439 0.225028
N 5.094646 1.731189 0.296676
C -5.061161 0.390463 0.008081
C -6.351269 -0.437257 -0.067603
C -3.817162 -0.507849 -0.019088
C -7.595792 0.460355 -0.040348
C -2.527979 0.320765 0.056462
C -8.885663 -0.367336 -0.116216
C -1.283513 -0.581507 0.029172
C -10.131669 0.529157 -0.088872
C -0.014774 0.256421 0.104770
C -11.418538 -0.289592 -0.164480
C 2.788448 0.065892 0.151126
C 4.066217 -0.534791 0.144217
C 5.196716 0.366450 0.224894
C 5.857560 -1.796603 0.107599
C 7.739519 0.018933 0.218787
C 3.814499 2.181675 0.293216
H -5.062388 1.005000 0.929058
H -5.025752 1.109037 -0.833500
H -6.387757 -1.155985 0.773752
H -6.351205 -1.051799 -0.988539
H -3.854193 -1.226538 0.822552
H -3.817660 -1.122640 -0.940112
H -7.596675 1.074651 0.880677
H -7.559997 1.179018 -0.881713
H -2.491890 1.038947 -0.785788
H -2.528497 0.935123 0.977891
H -8.886726 -0.982088 -1.036753
H -8.923263 -1.086588 0.724359
H -1.330682 -1.300712 0.873491
H -1.294011 -1.196653 -0.894875
H -10.133304 1.143132 0.832979
H -10.096483 1.248098 -0.930697
H 0.068203 0.969154 -0.738761
H 0.031531 0.865297 1.028635
H -11.467095 -0.881064 -1.085810
H -11.503306 -0.986944 0.676686
H -12.301909 0.358275 -0.143703
H 6.543585 -2.633871 0.059591
H 7.788601 1.057414 0.618819
H 8.388070 -0.686419 0.786046
H 3.662138 3.272388 0.349252
H 7.822857 0.614886 -1.691023


%chk=000264719-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000264719

0 1
S 1.495985 -1.318004 0.096776
O 7.888570 1.253333 -0.790737
N 6.468896 -0.420326 0.212851
N 4.792745 -1.994989 0.210753
N 2.713414 1.155274 0.034362
N 5.114081 1.635922 0.077512
C -5.053686 0.310444 -0.056390
C -6.405815 -0.437947 -0.060897
C -3.832769 -0.636360 -0.031690
C -7.628438 0.507085 -0.076533
C -2.481073 0.113482 -0.028690
C -8.980895 -0.240718 -0.081678
C -1.266567 -0.845724 0.012884
C -10.203422 0.705244 -0.093375
C 0.060685 -0.071277 0.010934
C -11.550652 -0.049267 -0.098802
C 2.907055 -0.198099 0.096439
C 4.234777 -0.702766 0.158383
C 5.268806 0.282308 0.154942
C 6.122202 -1.781384 0.234663
C 7.789670 0.259305 0.244946
C 3.796420 1.992268 0.023953
H -5.012199 0.985581 0.823987
H -4.994064 0.963954 -0.951909
H -6.463147 -1.095850 0.831624
H -6.450221 -1.109224 -0.944083
H -3.892460 -1.287429 0.865362
H -3.875050 -1.312751 -0.910706
H -7.584572 1.177604 0.807416
H -7.571345 1.165997 -0.968423
H -2.415554 0.755540 -0.931367
H -2.442445 0.796119 0.845310
H -9.027923 -0.909344 -0.966867
H -9.038901 -0.901349 0.808886
H -1.332397 -1.479847 0.919390
H -1.307314 -1.528039 -0.859294
H -10.155498 1.372618 0.791459
H -10.144387 1.365285 -0.983036
H 0.200600 0.524748 -0.904765
H 0.159251 0.597823 0.880479
H -11.636381 -0.700385 -0.989349
H -11.648065 -0.692531 0.796248
H -12.407487 0.649497 -0.107468
H 6.873655 -2.567752 0.271262
H 7.915400 0.704557 1.253032
H 8.575110 -0.488763 0.059144
H 3.578987 3.061758 -0.039393
H 7.163511 1.926486 -0.639641


