%chk=000278725.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000278725

0 1
O 2.185371 -2.171430 0.595305
O 4.723065 -0.678703 -1.347597
O 5.620517 -0.713067 0.706632
O 1.412418 2.350650 0.333452
N 0.476286 -0.616475 0.708901
N 2.867664 1.079298 -0.873827
C -1.865747 -0.797078 0.031822
C -4.204533 -0.750347 -0.571188
C -2.961273 -1.595882 -0.417650
C -2.341754 0.585055 0.181808
C -3.728642 0.625208 -0.173853
C -0.618662 -1.406658 0.243227
C -2.827677 -2.952676 -0.659076
C -1.700086 1.749688 0.578886
C -4.445975 1.807177 -0.127631
C -0.484013 -2.792348 -0.006197
C -1.569056 -3.541719 -0.447095
C 2.736913 0.021688 1.412678
C 3.622579 0.659347 0.327431
C -2.432335 2.949557 0.624783
C 1.806130 -1.049789 0.865281
C -3.781815 2.980080 0.278565
C 4.754559 -0.310192 -0.026622
C 1.766080 1.937319 -0.763010
C 1.088862 2.277688 -2.053102
H -5.024997 -1.107240 0.081095
H -4.592913 -0.772309 -1.607031
H -3.666392 -3.551169 -1.000472
H -0.640409 1.760609 0.852854
H -5.498704 1.838228 -0.395401
H 0.485010 -3.280581 0.149674
H 0.255252 0.374636 0.926890
H -1.441713 -4.609447 -0.631127
H 3.376256 -0.442445 2.200781
H 2.178974 0.838395 1.931672
H 4.107544 1.580549 0.777535
H -1.928781 3.863466 0.938607
H -4.333796 3.917189 0.322027
H 3.091363 0.602900 -1.751376
H 0.304066 3.035781 -1.879576
H 1.775113 2.690219 -2.805006
H 0.585349 1.406162 -2.499698
H 5.421805 -1.354332 -1.575175


%chk=000278725-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000278725

0 1
O 2.277557 -2.053733 0.255357
O 4.958835 -0.585165 -1.227939
O 5.492127 -0.817711 1.024173
O 1.521417 2.559936 0.154088
N 0.405749 -0.676235 0.662896
N 3.018487 1.109347 -0.869025
C -1.960069 -0.855347 0.020725
C -4.346653 -0.840187 -0.377386
C -3.071605 -1.668678 -0.358929
C -2.441140 0.538243 0.210179
C -3.858557 0.549531 -0.004005
C -0.674876 -1.458222 0.161947
C -2.920374 -3.033552 -0.652567
C -1.776847 1.758550 0.501967
C -4.604072 1.733924 0.110242
C -0.517026 -2.834998 -0.154624
C -1.627826 -3.604137 -0.562813
C 2.622902 0.067803 1.408455
C 3.640809 0.673233 0.390295
C -2.534265 2.948607 0.615017
C 1.757481 -0.996003 0.728623
C -3.937083 2.942030 0.432463
C 4.774546 -0.322313 0.135352
C 1.999850 2.037211 -0.908599
C 1.474734 2.396643 -2.291791
H -5.093062 -1.227455 0.344193
H -4.834872 -0.850299 -1.371647
H -3.781230 -3.643796 -0.946916
H -0.689186 1.853299 0.599251
H -5.687986 1.727336 -0.054175
H 0.474657 -3.283430 -0.076401
H 0.157220 0.247811 1.021477
H -1.479365 -4.663472 -0.799300
H 3.202206 -0.411672 2.217162
H 2.028263 0.894007 1.826998
H 4.099203 1.547152 0.896697
H -2.016184 3.887942 0.836507
H -4.504652 3.874482 0.526266
H 3.367699 0.672700 -1.725687
H 1.620698 3.477442 -2.462328
H 1.962635 1.836257 -3.107019
H 0.388139 2.205641 -2.324836
H 5.663618 -1.275718 -1.346147


