%chk=000242605.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000242605

0 1
S 0.688539 1.388175 -0.679523
O -4.558488 1.663700 0.642385
N 0.836653 -1.002849 0.381403
C -0.040875 -0.133705 -0.036030
C 2.283262 0.770771 -0.333003
C 2.169309 -0.528987 0.233604
C -1.497968 -0.261830 -0.058119
C -2.298337 0.824300 0.332923
C 3.523150 1.366547 -0.539720
C 3.321977 -1.241427 0.600899
C -2.080788 -1.465466 -0.478040
C -3.688031 0.664370 0.281838
C 4.661775 0.647837 -0.171312
C 4.560243 -0.639037 0.391670
C -3.477186 -1.590294 -0.518515
C -4.297576 -0.531190 -0.143345
H -1.854537 1.754376 0.676518
H 3.605350 2.361000 -0.974765
H 3.232392 -2.236266 1.036277
H -1.447231 -2.305963 -0.763469
H 5.647885 1.087020 -0.320384
H 5.471048 -1.170998 0.667893
H -3.922962 -2.530670 -0.846869
H -5.383061 -0.603345 -0.166429
H -4.087544 2.480929 0.940612


%chk=000242605-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000242605

0 1
S 0.709814 1.691113 0.028827
O -4.707699 1.755186 0.032791
N 0.842775 -1.005968 -0.007205
C -0.045310 -0.029792 0.005836
C 2.324961 0.880753 0.018468
C 2.168929 -0.546827 -0.000951
C -1.502974 -0.204200 0.003867
C -2.386102 0.908658 0.019953
C 3.598819 1.480640 0.027063
C 3.316380 -1.376650 -0.011901
C -2.037391 -1.522794 -0.014555
C -3.782086 0.698438 0.017309
C 4.732037 0.635921 0.015861
C 4.591029 -0.778738 -0.003456
C -3.434636 -1.711630 -0.016881
C -4.317254 -0.611009 -0.001127
H -1.985349 1.931244 0.034310
H 3.716934 2.568210 0.041779
H 3.188337 -2.462849 -0.026585
H -1.345548 -2.369114 -0.026724
H 5.732521 1.081568 0.022186
H 5.486053 -1.409654 -0.011812
H -3.844647 -2.726984 -0.031276
H -5.403284 -0.740456 -0.002735
H -4.249314 2.631932 0.043458


