%chk=000244836.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000244836

0 1
O -2.645431 -1.204980 1.987780
O -2.618540 -2.510456 -0.474851
O -3.543802 -0.003985 -0.572252
O -0.246687 -2.579527 -1.990837
O -4.066133 2.232822 0.593612
O -1.195756 3.055911 0.636659
N 1.905310 -1.247486 -1.216286
N 0.734239 0.508410 -0.313903
C -1.803442 -0.700860 0.955535
C -1.443547 -1.854095 -0.006567
C -2.468053 0.494953 0.238224
C -0.636960 -1.406763 -1.254165
C -3.004691 1.531936 1.251843
C 0.643631 -0.702944 -0.913410
C -1.909923 2.495274 1.738703
C 2.860899 -0.310801 -0.784412
C 2.112669 0.782188 -0.218980
C 4.268113 -0.301763 -0.822326
C 2.790568 1.898906 0.313297
C 4.901219 0.807209 -0.291272
C 4.171983 1.893154 0.268610
H -0.899429 -0.351553 1.516985
H -0.908673 -2.668191 0.542943
H -1.760923 0.972528 -0.486350
H -1.264106 -0.773929 -1.935173
H -3.524464 1.031208 2.107023
H -2.361291 3.383062 2.228105
H -1.214520 2.001268 2.439744
H 2.068003 -2.125534 -1.684136
H -3.387391 -1.731790 1.591267
H -3.273601 -1.843185 -0.846242
H -4.375344 0.527191 -0.408873
H -1.009193 -3.217785 -2.009311
H -3.688401 2.911507 -0.023137
H 4.821839 -1.131251 -1.251587
H 2.226539 2.727925 0.737057
H -0.533728 2.403970 0.281732
H 5.990097 0.863852 -0.296570
H 4.731516 2.738803 0.668921


%chk=000244836-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000244836

0 1
O -2.661029 -1.401371 2.074858
O -2.669576 -2.558579 -0.627570
O -3.900914 -0.186632 -0.220133
O -0.232707 -2.499331 -2.065697
O -3.814309 2.462935 0.462742
O -0.919499 2.745381 0.446040
N 1.843201 -1.157876 -1.095447
N 0.674860 0.654919 -0.387379
C -1.889920 -0.809587 0.982738
C -1.490004 -1.882138 -0.055868
C -2.635685 0.361755 0.321177
C -0.657132 -1.345509 -1.262329
C -2.929731 1.558830 1.240479
C 0.593917 -0.591785 -0.901422
C -1.639136 2.303173 1.642107
C 2.811611 -0.226485 -0.690970
C 2.061330 0.912119 -0.240629
C 4.221092 -0.250356 -0.672607
C 2.721389 2.063247 0.243953
C 4.866939 0.905809 -0.185281
C 4.130790 2.041971 0.264907
H -0.975335 -0.427908 1.463084
H -0.915674 -2.679522 0.448301
H -2.034466 0.753373 -0.522678
H -1.313654 -0.688467 -1.869005
H -3.513099 1.249649 2.123850
H -1.911355 3.213486 2.203252
H -1.009017 1.665447 2.295571
H 1.959907 -2.075897 -1.526925
H -3.461633 -1.830667 1.674331
H -3.368536 -1.849252 -0.783511
H -4.493434 0.599461 -0.377512
H -1.030668 -3.089732 -2.135112
H -3.201315 3.020268 -0.093304
H 4.794074 -1.116914 -1.017161
H 2.149001 2.932491 0.582366
H -0.355866 1.969355 0.077459
H 5.961408 0.932543 -0.152312
H 4.676773 2.916996 0.633041


