%chk=000248983.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000248983

0 1
O -0.939344 -0.199454 1.481736
O 0.937485 -0.228875 -1.480857
N -7.978071 0.360644 1.008792
N 7.976974 0.331578 -1.018243
N -8.185891 -0.816466 -0.995851
N 8.183216 -0.808603 1.007792
N -1.684698 -0.251090 -0.720182
N 1.682799 -0.239461 0.721655
C -9.459374 0.238865 0.785925
C 9.458111 0.211947 -0.793131
C -7.356436 -0.251475 -0.155551
C 7.354518 -0.258098 0.157192
C -9.578493 -0.585617 -0.530990
C 9.576124 -0.588261 0.538772
C -5.889533 -0.249935 -0.273375
C 5.887620 -0.252398 0.274946
C -5.297823 -0.253869 -1.549855
C 5.295923 -0.232089 1.551278
C -5.077372 -0.267777 0.871339
C 5.075417 -0.290157 -0.869253
C -3.105498 -0.255450 -0.524912
C 3.103587 -0.249462 0.526514
C -3.912164 -0.251989 -1.682738
C 3.910271 -0.225868 1.684092
C -3.687825 -0.266249 0.752949
C 3.685874 -0.284546 -0.750925
C -0.729161 -0.226320 0.284553
C 0.727282 -0.232654 -0.283382
H -9.964116 1.217727 0.718294
H -9.888294 -0.308531 1.649825
H 9.886301 -0.351859 -1.646776
H 9.964162 1.191216 -0.743548
H -10.071317 -1.564585 -0.362302
H -10.149590 -0.060227 -1.320675
H 10.147944 -0.049169 1.318639
H 10.067615 -1.570843 0.388180
H -7.659220 1.299936 1.237489
H 7.659384 1.266910 -1.264263
H -5.934102 -0.267096 -2.440034
H 5.932198 -0.229852 2.441557
H -5.533931 -0.294010 1.864727
H 5.531918 -0.335265 -1.861989
H -3.466689 -0.254355 -2.676051
H 3.464810 -0.209410 2.677277
H -3.061663 -0.278948 1.652039
H 3.059683 -0.312950 -1.649635
H -1.354054 -0.270251 -1.699338
H 1.352144 -0.239511 1.700993


%chk=000248983-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000248983

0 1
O -0.830226 -0.168992 1.599598
O 0.828313 -0.198120 -1.597685
N -8.084970 0.028584 1.050874
N 8.082883 -0.001616 -1.054931
N -8.183726 -0.482810 -1.195824
N 8.182045 -0.470257 1.200992
N -1.688891 -0.195333 -0.617573
N 1.687175 -0.186468 0.619515
C -9.542129 0.101071 0.783155
C 9.540276 0.073537 -0.789601
C -7.407386 -0.220826 -0.155161
C 7.405541 -0.227353 0.155830
C -9.598781 -0.427639 -0.699491
C 9.596992 -0.425963 0.703183
C -5.929849 -0.216880 -0.228228
C 5.928030 -0.220349 0.229390
C -5.303977 -0.225858 -1.503965
C 5.302568 -0.205627 1.505276
C -5.112339 -0.210392 0.931631
C 5.110103 -0.233775 -0.930116
C -3.095515 -0.202552 -0.443046
C 3.093759 -0.198642 0.444819
C -3.905968 -0.217694 -1.612669
C 3.904594 -0.193782 1.614263
C -3.706687 -0.202172 0.838486
C 3.704510 -0.222145 -0.836695
C -0.698782 -0.182641 0.332066
C 0.696958 -0.189175 -0.330090
H -9.914633 1.142319 0.866512
H -10.116690 -0.533908 1.480204
H 10.113263 -0.576148 -1.474312
H 9.914681 1.112216 -0.893876
H -10.029041 -1.446084 -0.745512
H -10.204016 0.219903 -1.357710
H 10.202885 0.233972 1.348367
H 10.026507 -1.443616 0.769139
H -7.658649 0.513404 1.838824
H 7.656741 0.467854 -1.852195
H -5.943162 -0.243261 -2.391680
H 5.942024 -0.207786 2.392966
H -5.566393 -0.244224 1.928475
H 5.563691 -0.286160 -1.926369
H -3.434168 -0.223478 -2.602991
H 3.433139 -0.181122 2.604686
H -3.080969 -0.202339 1.733343
H 3.078500 -0.237764 -1.731205
H -1.315068 -0.205125 -1.579423
H 1.313538 -0.178986 1.581450


