%chk=000270471.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000270471

0 1
O 2.885986 -1.126040 0.806727
O -1.935819 0.402829 -2.453151
O 2.544701 1.072435 1.273408
O -3.903369 -2.416709 1.460108
O 1.378384 0.716629 -1.752904
O -0.087139 2.187060 -1.117377
N 0.426935 1.089821 -1.098197
C 6.132569 0.094548 -0.791252
C 4.689007 -0.428590 -0.666160
C 6.436386 1.249102 0.188852
C 7.174498 -1.030019 -0.603568
C 4.344714 -0.926807 0.729405
C 5.462282 2.416076 0.061630
C 7.124562 -2.072468 -1.717346
C -1.499709 -0.286010 -0.217754
C -2.028638 -1.144427 0.762744
C 0.668230 -0.421466 0.888843
C -0.154746 0.096086 -0.126379
C -3.850541 0.166935 -1.068536
C -4.384598 -0.643873 -0.049271
C -2.387826 0.143110 -1.363369
C 2.112652 -0.022689 1.008943
C -3.491103 -1.504130 0.779182
C -1.209690 -1.666690 1.769646
C 0.142403 -1.315430 1.826350
C -4.693128 0.973254 -1.837063
C -5.761385 -0.647436 0.189050
C -6.072679 0.979143 -1.582438
C -6.604060 0.171360 -0.576866
H 6.238383 0.495560 -1.832406
H 3.982611 0.381293 -0.956617
H 4.516638 -1.232741 -1.409682
H 7.467673 1.611963 0.005142
H 6.433383 0.877288 1.231580
H 7.034687 -1.521134 0.377315
H 8.189350 -0.584582 -0.569715
H 4.700688 -1.950813 0.936738
H 4.648134 -0.228441 1.529317
H 4.452712 2.144695 0.408682
H 5.786874 3.270996 0.664742
H 5.368061 2.761035 -0.973767
H 7.290065 -1.619720 -2.702073
H 6.155232 -2.583668 -1.752897
H 7.894623 -2.839221 -1.576276
H -1.638039 -2.356583 2.508183
H 0.790238 -1.738776 2.600229
H -4.272633 1.591495 -2.636439
H -6.173281 -1.292677 0.970957
H -6.728439 1.615391 -2.179412
H -7.678137 0.170736 -0.384261


%chk=000270471-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000270471

0 1
O 2.914482 -0.879998 0.650521
O -2.633301 2.169297 -1.132873
O 2.445039 1.367485 0.240555
O -3.701397 -2.904672 0.723919
O 0.320293 2.104515 -1.762045
O -0.182723 2.893176 0.326791
N -0.077228 1.968684 -0.551577
C 6.504874 -0.174474 -0.701986
C 4.987923 -0.524811 -0.687278
C 6.806221 1.257644 -0.170401
C 7.384995 -1.217814 0.045099
C 4.376684 -0.545884 0.720205
C 6.025849 2.390683 -0.873453
C 7.255365 -2.667649 -0.471459
C -1.771142 0.136155 -0.147590
C -2.065128 -1.187904 0.297494
C 0.628725 -0.276209 0.331918
C -0.418909 0.574580 -0.109773
C -4.272430 0.490722 -0.607651
C -4.562617 -0.822839 -0.139269
C -2.875290 1.018343 -0.659249
C 2.058721 0.185333 0.388990
C -3.470711 -1.722519 0.318520
C -1.028297 -2.041239 0.738345
C 0.300306 -1.593353 0.747434
C -5.329199 1.326879 -1.045427
C -5.902191 -1.284588 -0.113410
C -6.659233 0.862609 -1.014489
C -6.947115 -0.445708 -0.547371
H 6.806868 -0.195667 -1.772239
H 4.442793 0.216978 -1.297770
H 4.828935 -1.511405 -1.160996
H 7.894306 1.436756 -0.288412
H 6.612474 1.300528 0.921794
H 7.158060 -1.188785 1.131148
H 8.442250 -0.897157 -0.047553
H 4.788288 -1.350414 1.349242
H 4.478804 0.429569 1.225863
H 4.942413 2.342967 -0.662306
H 6.383730 3.379989 -0.534098
H 6.161446 2.344652 -1.971008
H 7.459905 -2.721387 -1.557631
H 6.243715 -3.079943 -0.301103
H 7.974148 -3.334391 0.039300
H -1.295566 -3.049522 1.066880
H 1.112651 -2.243490 1.078714
H -5.081428 2.330936 -1.403269
H -6.094114 -2.299304 0.248940
H -7.472648 1.513279 -1.351936
H -7.981890 -0.802938 -0.525456


