%chk=000283896.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000283896

0 1
O -1.367324 -4.149525 -1.367496
O 1.367188 -4.149273 1.367803
O -5.214705 3.651434 0.893635
O 5.214037 3.651474 -0.894306
O -6.436890 1.919383 0.458284
O 6.436309 1.919617 -0.458428
N -5.361903 2.484620 0.568729
N 5.361291 2.484750 -0.569099
C -0.586112 -0.588018 -0.541160
C 0.585621 -0.587953 0.541140
C -0.701579 -2.134463 -0.323043
C 0.701138 -2.134415 0.323143
C -0.112466 -0.216138 -1.958607
C 0.111968 -0.215961 1.958558
C -1.834604 0.201642 -0.225906
C 1.834086 0.201718 0.225805
C -0.899198 -3.045655 -1.521634
C 0.898823 -3.045488 1.521814
C -0.838408 -1.033453 -3.030998
C 0.837853 -1.033223 3.031027
C -0.523349 -2.521598 -2.885836
C 0.522767 -2.521372 2.885936
C -1.740536 1.558465 0.133544
C 1.739953 1.558447 -0.133979
C -3.103611 -0.389872 -0.342416
C 3.103126 -0.389681 0.342555
C -2.883610 2.308503 0.395318
C 2.882996 2.308503 -0.395843
C -4.258318 0.348987 -0.084786
C 4.257802 0.349196 0.084842
C -4.142238 1.695784 0.288642
C 4.141658 1.695897 -0.288919
H -1.488891 -2.389039 0.425512
H 1.488452 -2.389022 -0.425402
H 0.980166 -0.381994 -2.058085
H -0.260058 0.865741 -2.145189
H -0.980672 -0.381767 2.058035
H 0.259600 0.865926 2.145069
H -0.537049 -0.683833 -4.039026
H -1.932792 -0.865666 -2.971812
H 0.536460 -0.683539 4.039022
H 1.932243 -0.865462 2.971874
H 0.555968 -2.718027 -3.061403
H -1.048463 -3.112552 -3.667522
H -0.556580 -2.717754 3.061354
H 1.047754 -3.112288 3.667734
H -0.756058 2.035766 0.203372
H 0.755447 2.035662 -0.204004
H -3.202447 -1.435253 -0.643182
H 3.202012 -1.434984 0.643580
H -2.815712 3.364907 0.680112
H 2.815046 3.364832 -0.680900
H -5.251124 -0.109043 -0.171682
H 5.250633 -0.108743 0.171927


%chk=000283896-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000283896

0 1
O -1.864045 -4.047180 -1.118472
O 1.863684 -4.046971 1.118798
O -5.398819 3.749420 0.786352
O 5.398164 3.749541 -0.786742
O -6.638318 1.923207 0.207205
O 6.637718 1.923424 -0.207398
N -5.511356 2.518659 0.411393
N 5.510741 2.518782 -0.411781
C -0.623758 -0.534801 -0.517264
C 0.623236 -0.534725 0.517205
C -0.754441 -2.087583 -0.233430
C 0.753972 -2.087534 0.233536
C -0.168064 -0.277518 -1.993550
C 0.167537 -0.277299 1.993465
C -1.886699 0.265460 -0.209191
C 1.886152 0.265543 0.209046
C -1.160132 -3.028757 -1.359023
C 1.159699 -3.028570 1.359233
C -0.943343 -1.129222 -3.022100
C 0.942840 -1.128872 3.022105
C -0.723481 -2.645511 -2.767123
C 0.723021 -2.645194 2.767288
C -1.844128 1.624206 0.208679
C 1.843540 1.624245 -0.208963
C -3.163838 -0.332931 -0.399646
C 3.163309 -0.332791 0.399559
C -3.019951 2.367062 0.417171
C 3.019341 2.367115 -0.417533
C -4.354208 0.392871 -0.202949
C 4.353657 0.393025 0.202785
C -4.265548 1.740623 0.201206
C 4.264956 1.740733 -0.201508
H -1.414892 -2.284247 0.629301
H 1.414431 -2.284269 -0.629172
H 0.910780 -0.505777 -2.092649
H -0.281360 0.797170 -2.227485
H -0.911301 -0.505576 2.092591
H 0.280804 0.797417 2.227284
H -0.597187 -0.876791 -4.041297
H -2.024622 -0.894448 -2.987114
H 0.596677 -0.876342 4.041276
H 2.024113 -0.894072 2.987094
H 0.355826 -2.876981 -2.884206
H -1.274350 -3.273073 -3.487995
H -0.356281 -2.876681 2.884387
H 1.273903 -3.272663 3.488231
H -0.883776 2.112100 0.394176
H 0.883173 2.112093 -0.394505
H -3.237405 -1.383741 -0.697725
H 3.236908 -1.383569 0.697743
H -2.993509 3.410487 0.742213
H 2.992868 3.410505 -0.742682
H -5.336900 -0.062001 -0.352666
H 5.336363 -0.061802 0.352546


