%chk=000259068.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000259068

0 1
S 0.597586 -3.119937 -1.039778
N -0.226701 -0.675109 -0.628630
N -2.714775 0.932130 -0.581740
C -0.243264 0.697416 -0.055634
C -1.381802 -1.013304 -1.512271
C -1.646294 1.060713 0.465346
C -2.224918 0.238258 -1.804523
C 0.722658 -1.602001 -0.355849
C 1.883960 -1.274001 0.534611
C 3.012595 -0.599551 -0.262152
C 4.182075 -0.213311 0.651650
C -4.001744 0.547918 -0.068273
C 5.310662 0.456999 -0.143600
C 6.481682 0.847621 0.767698
C 7.612058 1.517355 -0.026541
C -4.859402 -0.326389 -0.767129
C -4.464344 1.161438 1.118300
C 8.780576 1.908432 0.875276
C -6.146196 -0.575577 -0.288727
C -5.752524 0.897296 1.582215
C -6.599570 0.028162 0.887195
H 0.083792 1.420255 -0.840035
H 0.491620 0.781234 0.779256
H -1.997284 -1.805500 -1.019056
H -1.005753 -1.459350 -2.466659
H -1.646474 2.127417 0.791542
H -1.878330 0.439208 1.361082
H -3.080011 -0.035429 -2.465636
H -1.633191 0.988312 -2.380944
H 1.579690 -0.639889 1.394031
H 2.270900 -2.214934 0.994981
H 2.630761 0.293240 -0.792001
H 3.365335 -1.293374 -1.055176
H 4.571304 -1.115014 1.165194
H 3.833904 0.463878 1.454499
H 5.666306 -0.226564 -0.939631
H 4.925568 1.353152 -0.666774
H 6.130613 1.528757 1.566236
H 6.871017 -0.048949 1.287905
H 7.967788 0.834506 -0.823112
H 7.226124 2.414834 -0.548256
H -4.530037 -0.810491 -1.684706
H -3.836836 1.860911 1.663181
H 9.212438 1.035422 1.378002
H 8.472026 2.615072 1.653894
H 9.582635 2.384262 0.299786
H -6.800434 -1.252733 -0.838110
H -6.102154 1.377255 2.496332
H -7.600933 -0.173946 1.257132


%chk=000259068-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000259068

0 1
S 1.075219 -3.698054 -1.272991
N -0.119885 -1.406614 -0.444151
N -2.710228 -0.069011 -0.179979
C -0.285889 -0.141212 0.311065
C -1.290093 -1.803163 -1.273202
C -1.706696 -0.031369 0.897118
C -2.276083 -0.637771 -1.467399
C 0.989535 -2.218246 -0.392648
C 2.189984 -1.763679 0.430544
C 3.039381 -0.671770 -0.280063
C 4.312168 -0.316666 0.520011
C -3.988624 0.484081 0.003861
C 5.179041 0.766773 -0.161437
C 6.464354 1.099625 0.629189
C 7.332182 2.189395 -0.041511
C -4.859484 0.735043 -1.102280
C -4.459080 0.816569 1.313124
C 8.617514 2.508078 0.752267
C -6.142214 1.282343 -0.898230
C -5.741461 1.371876 1.497989
C -6.599445 1.609190 0.399558
H -0.095282 0.725329 -0.354058
H 0.444543 -0.098002 1.132037
H -1.792788 -2.666437 -0.795085
H -0.919655 -2.162206 -2.251027
H -1.778038 0.932497 1.439693
H -1.863655 -0.842972 1.641536
H -3.153196 -1.048915 -1.997987
H -1.827649 0.134698 -2.131496
H 1.889233 -1.402234 1.436121
H 2.818080 -2.655008 0.587841
H 2.436088 0.244529 -0.442278
H 3.321121 -1.047715 -1.282905
H 4.918378 -1.235197 0.660904
H 4.028667 0.028303 1.536937
H 5.453579 0.427739 -1.181912
H 4.578996 1.691931 -0.291739
H 6.191898 1.429941 1.653696
H 7.068392 0.176293 0.751436
H 7.600703 1.860891 -1.066341
H 6.730003 3.113581 -0.159490
H -4.529509 0.531225 -2.125631
H -3.838322 0.615232 2.191726
H 9.251871 1.607623 0.856485
H 8.376103 2.867050 1.770706
H 9.219493 3.289264 0.252632
H -6.785267 1.465849 -1.767073
H -6.075630 1.610154 2.514719
H -7.595652 2.037240 0.550115


