%chk=000261232.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000261232

0 1
S -2.476980 -2.138420 -0.534490
O 1.959885 -1.368987 0.360521
O -0.682456 2.267941 0.320819
N 0.554434 0.460184 0.376369
N 2.961300 0.718668 0.140173
N 0.412224 1.802375 0.264839
C -0.603673 -0.484870 0.556661
C -1.049740 -1.040839 -0.788406
C -3.796463 -1.016026 -0.221136
C -5.970965 0.656466 0.287680
C -4.313513 -0.936632 1.073057
C -4.351817 -0.274342 -1.267065
C 1.883229 -0.159194 0.291946
C -5.404718 -0.100545 1.325985
C -5.437347 0.564580 -1.010645
C 4.335799 0.309835 0.039879
C -7.131000 1.559882 0.549088
C 5.287636 1.339239 -0.118229
C 4.736730 -1.033874 0.093672
C 6.638083 1.006096 -0.221186
C 6.095141 -1.342130 -0.011822
C 7.047347 -0.331104 -0.168843
H -0.287751 -1.307239 1.243272
H -1.428740 0.074154 1.059663
H -1.291865 -0.239709 -1.510225
H -0.254278 -1.665513 -1.249792
H -3.878205 -1.522680 1.883854
H -3.948010 -0.349031 -2.277350
H -5.813236 -0.037344 2.332494
H -5.873720 1.148307 -1.818694
H 2.789036 1.730551 0.094143
H -7.978728 1.327065 -0.111609
H -6.861446 2.611830 0.371987
H -7.500982 1.492976 1.580538
H 4.983659 2.382371 -0.160485
H 4.001896 -1.836154 0.216852
H 7.378771 1.796605 -0.343440
H 6.410196 -2.385535 0.029632
H 8.102668 -0.581854 -0.250007


%chk=000261232-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000261232

0 1
S -2.661172 -2.391803 -0.610703
O 2.014218 -1.638576 0.512722
O -0.672221 1.999346 -0.366624
N 0.571160 0.172722 0.109619
N 2.909819 0.492947 -0.010360
N 0.507656 1.523417 -0.249444
C -0.631410 -0.658158 0.348660
C -1.143585 -1.311502 -0.951492
C -3.912716 -1.093784 -0.202277
C -5.931160 0.818982 0.437234
C -4.542732 -1.122796 1.062323
C -4.292193 -0.115865 -1.152358
C 1.904179 -0.416758 0.224929
C -5.549414 -0.177598 1.370016
C -5.282819 0.833791 -0.827364
C 4.315237 0.266531 0.021484
C -6.998588 1.845801 0.772391
C 5.150706 1.381243 -0.259032
C 4.893318 -0.996226 0.317029
C 6.552051 1.236007 -0.244135
C 6.299222 -1.123218 0.327412
C 7.136264 -0.018543 0.049583
H -0.354445 -1.434801 1.077686
H -1.407516 0.003950 0.770314
H -1.411375 -0.555188 -1.706257
H -0.395467 -2.004967 -1.369959
H -4.246977 -1.877057 1.798957
H -3.825117 -0.102910 -2.143377
H -6.035341 -0.212713 2.352416
H -5.564056 1.591264 -1.569213
H 2.581513 1.442144 -0.233496
H -7.809231 1.843274 0.020067
H -6.577453 2.868835 0.791884
H -7.452670 1.651132 1.758947
H 4.702816 2.356859 -0.486573
H 4.248691 -1.850351 0.532508
H 7.186236 2.102309 -0.461450
H 6.741629 -2.099142 0.556163
H 8.225342 -0.131497 0.061470


