%chk=000210221.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000210221

1 1
S -1.553701 -2.044875 0.827758
N -1.904105 0.131554 -0.452865
N 4.669941 0.281183 0.160767
C -3.208840 -0.448846 -0.306037
C -4.416735 0.207441 -0.882095
C -0.898059 -0.612893 0.096594
C -4.860854 1.452137 -0.093925
C 0.503946 -0.357018 0.104324
C -3.165135 -1.618661 0.392988
C -1.699075 1.441256 -1.100974
C 1.266722 -0.597882 1.281633
C 1.192587 0.089369 -1.056431
C 3.321428 0.070014 0.141090
C -5.294008 1.127221 1.328863
C 2.623900 -0.386400 1.311693
C 2.550686 0.297431 -1.050927
C 5.478622 0.039325 1.376680
C 5.403868 0.745643 -1.037649
H -4.249341 0.473016 -1.949529
H -5.257893 -0.526463 -0.906714
H -4.043666 2.206665 -0.082595
H -5.703104 1.933082 -0.637754
H -4.012017 -2.240600 0.664921
H -0.740084 1.901636 -0.788767
H -1.703280 1.349252 -2.203165
H -2.509037 2.149473 -0.806672
H 0.759899 -0.938868 2.189535
H 0.632046 0.242830 -1.982010
H -6.143754 0.432435 1.350928
H -4.488245 0.678850 1.920319
H -5.618066 2.033607 1.860188
H 3.171561 -0.568397 2.235128
H 3.045191 0.625160 -1.963592
H 5.140281 0.677807 2.214339
H 6.544528 0.271159 1.200792
H 5.422454 -1.020233 1.690018
H 6.482079 0.862465 -0.825671
H 5.030430 1.729596 -1.377761
H 5.311926 0.021231 -1.868725


%chk=000210221-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000210221

1 1
S -1.550406 -1.866579 1.181054
N -1.882879 0.149773 -0.447653
N 4.793803 0.247664 0.130843
C -3.200131 -0.362629 -0.235113
C -4.416132 0.258635 -0.878767
C -0.867260 -0.518543 0.202247
C -5.039964 1.449496 -0.082125
C 0.553278 -0.274534 0.159680
C -3.199315 -1.431937 0.625975
C -1.656322 1.380723 -1.245395
C 1.361714 -0.615865 1.296106
C 1.238816 0.225313 -0.998665
C 3.427644 0.072482 0.137409
C -5.634562 1.038604 1.280070
C 2.743298 -0.444993 1.295700
C 2.623115 0.390491 -1.014313
C 5.602721 -0.121698 1.311947
C 5.474350 0.796289 -1.060921
H -4.173800 0.580076 -1.909481
H -5.183557 -0.529911 -0.976503
H -4.289845 2.251342 0.069082
H -5.835092 1.884134 -0.716485
H -4.054494 -2.004703 0.973779
H -0.767946 1.903709 -0.861963
H -1.511549 1.140202 -2.312031
H -2.527120 2.042294 -1.142160
H 0.881885 -0.989936 2.208429
H 0.691079 0.424710 -1.923996
H -6.429768 0.280268 1.155858
H -4.866576 0.622738 1.957366
H -6.084310 1.911374 1.784490
H 3.302616 -0.699922 2.198483
H 3.095716 0.744177 -1.933408
H 5.314320 0.471639 2.200066
H 6.663567 0.075642 1.102303
H 5.496847 -1.195989 1.552733
H 6.547977 0.902265 -0.850221
H 5.079267 1.795176 -1.324074
H 5.362111 0.127723 -1.935647


