%chk=000243155.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000243155

0 1
S 1.931612 -0.221584 0.130135
F 7.057820 -0.828109 -2.029194
O -5.040248 -0.883004 0.885126
N -3.058594 -0.156080 0.051247
N -1.131506 -1.415790 0.058011
N -2.009764 2.123479 0.143751
N 0.433157 2.005416 0.179369
C -4.499813 0.178403 0.064862
C -5.095275 0.148069 -1.350550
C -6.624240 0.214744 -1.268823
C -7.159292 -0.899887 -0.361865
C -6.481795 -0.847738 1.007250
C -1.997004 0.752564 0.107766
C -2.468277 -1.462414 0.035190
C -0.791134 -0.053780 0.101094
C 0.428045 0.655059 0.138785
C -0.774360 2.678888 0.180866
C 3.194890 1.090138 0.190987
C 4.492239 0.354877 0.221796
C 5.181674 0.100074 -0.974329
C 5.028042 -0.080637 1.446169
C 6.395577 -0.585454 -0.895965
C 6.245846 -0.765888 1.483301
C 6.953328 -1.028716 0.306485
H -4.655507 1.158459 0.582404
H -4.785082 -0.774514 -1.881391
H -4.694269 0.990722 -1.947394
H -7.058279 0.122081 -2.283316
H -6.946260 1.205549 -0.892397
H -8.256374 -0.815938 -0.247666
H -6.974944 -1.886428 -0.833122
H -6.759375 0.054150 1.580491
H -6.668366 -1.753560 1.614290
H -3.090331 -2.351462 0.022771
H -0.713727 3.779054 0.214937
H 3.042203 1.737791 1.079586
H 3.095348 1.766632 -0.683000
H 4.777596 0.421962 -1.933203
H 4.488586 0.110773 2.373231
H 6.649195 -1.100381 2.439773
H 7.901859 -1.561118 0.329440


%chk=000243155-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000243155

0 1
S 1.921500 -0.583220 0.380361
F 6.978093 -0.293903 -2.346020
O -5.225631 -0.787168 0.903805
N -3.110503 -0.339841 0.010678
N -1.234923 -1.666213 0.079991
N -2.045734 1.885704 0.253336
N 0.393206 1.718415 0.438383
C -4.518022 0.052462 -0.074109
C -5.103901 -0.130381 -1.490451
C -6.614230 0.208544 -1.480555
C -7.346047 -0.628352 -0.404449
C -6.664825 -0.440825 0.963010
C -2.027403 0.528372 0.164610
C -2.575537 -1.637915 -0.029447
C -0.869026 -0.312639 0.198082
C 0.374733 0.356573 0.339181
C -0.792673 2.406311 0.392520
C 3.166382 0.863217 0.598852
C 4.567980 0.341318 0.402290
C 5.121832 0.257315 -0.901347
C 5.352598 -0.064255 1.513486
C 6.432672 -0.220797 -1.046907
C 6.669800 -0.542562 1.331041
C 7.231051 -0.625982 0.036638
H -4.568453 1.121625 0.225573
H -4.952771 -1.180467 -1.806479
H -4.554293 0.519204 -2.196393
H -7.049443 0.028053 -2.479852
H -6.747900 1.288208 -1.262589
H -8.408584 -0.327751 -0.328183
H -7.320953 -1.700138 -0.679744
H -6.769907 0.612005 1.306630
H -7.077245 -1.111694 1.733491
H -3.212279 -2.515072 -0.105967
H -0.720155 3.494032 0.477210
H 3.002046 1.269665 1.607943
H 2.874477 1.625571 -0.138395
H 4.546391 0.553853 -1.783914
H 4.927844 -0.004784 2.521723
H 7.264769 -0.850483 2.197027
H 8.248266 -0.989607 -0.134163


