%chk=000193019.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000193019

0 1
S 1.604427 2.350832 0.138245
O -0.758924 3.534681 0.399409
N 0.302596 0.068389 0.275817
C -0.778100 1.060507 0.403758
C -1.844547 0.862772 -0.692379
C -2.906664 -0.114760 -0.263549
C -0.206136 2.487108 0.337358
C 1.489143 0.543273 0.145170
C 2.743564 -0.192582 -0.007845
C -2.577467 -1.459039 -0.031332
C -4.232886 0.313685 -0.106963
C -3.569010 -2.365193 0.350690
C -5.221532 -0.598649 0.273852
C 2.807521 -1.274255 -0.902966
C 3.877879 0.179292 0.732511
C -4.892716 -1.937980 0.502455
C 4.007115 -1.972084 -1.061480
C 5.071449 -0.527684 0.568668
C 5.138379 -1.599510 -0.328135
H -1.250633 0.919310 1.421477
H -1.369506 0.504663 -1.632421
H -2.298853 1.845394 -0.947813
H -1.542957 -1.790276 -0.140092
H -4.498276 1.354881 -0.280092
H 1.920073 -1.567593 -1.465680
H 3.831542 1.010379 1.437899
H -3.309672 -3.407196 0.531407
H -6.250330 -0.262766 0.393025
H -5.663593 -2.646249 0.798615
H 4.059075 -2.809477 -1.756470
H 5.952629 -0.241948 1.142300
H 6.072808 -2.145726 -0.454040


%chk=000193019-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000193019

0 1
S 1.705663 2.544666 0.453427
O -0.785928 3.709833 0.880747
N 0.277226 0.219505 0.443264
C -0.764883 1.226793 0.653087
C -1.881955 1.169942 -0.440770
C -2.842405 -0.002966 -0.289062
C -0.156134 2.656493 0.707659
C 1.489932 0.679422 0.326998
C 2.683781 -0.163650 0.109970
C -2.393002 -1.347106 -0.385187
C -4.222831 0.238851 -0.071871
C -3.304967 -2.418628 -0.268390
C -5.137165 -0.833354 0.046697
C 2.535094 -1.579049 0.110123
C 3.970111 0.399837 -0.098263
C -4.680525 -2.166852 -0.052300
C 3.653752 -2.409022 -0.095406
C 5.088292 -0.435766 -0.305044
C 4.934360 -1.841086 -0.304414
H -1.242100 1.046264 1.638103
H -1.381908 1.147283 -1.427641
H -2.443299 2.119246 -0.373113
H -1.326745 -1.541352 -0.540124
H -4.584669 1.271963 0.002703
H 1.539445 -2.001318 0.277745
H 4.097526 1.488478 -0.100842
H -2.944310 -3.450756 -0.346177
H -6.200620 -0.627604 0.212970
H -5.387225 -2.999616 0.036737
H 3.531969 -3.497590 -0.091481
H 6.076432 0.008205 -0.465500
H 5.803486 -2.488869 -0.463245


