%chk=000297075.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000297075

0 1
O 1.524164 3.455894 0.850277
N 3.167201 0.277766 0.502342
N -0.986552 1.038496 -0.308525
N 3.640491 2.569416 0.819948
C 1.873888 1.034078 0.312749
C 1.350359 1.024530 -1.135907
C 0.822108 0.482074 1.291604
C -0.017439 1.719661 -1.230052
C -0.530083 1.188533 1.113900
C 2.249373 2.496957 0.699414
C 4.302980 1.252689 0.661192
C -2.370477 1.596003 -0.477304
C 3.424042 -0.935115 -0.206071
C -3.021179 1.024996 -1.749300
C 4.702241 -1.231815 -0.722962
C 2.403970 -1.910983 -0.286490
C -3.394751 -0.460532 -1.593102
C 4.946502 -2.480500 -1.300094
C 2.666474 -3.146685 -0.870103
C 3.936933 -3.440957 -1.380900
C -4.571577 -0.650604 -0.783324
C -5.558197 -0.810399 -0.106353
C -6.735478 -1.007876 0.701413
C -6.504208 -0.641419 2.180773
C -5.589674 -1.637015 2.888358
H 1.245496 -0.022308 -1.492264
H 2.070875 1.509208 -1.819408
H 1.171970 0.577186 2.336361
H 0.697779 -0.611125 1.107850
H 0.094190 2.806909 -1.009372
H -0.404886 1.631899 -2.268407
H -1.283551 0.708324 1.774492
H -0.442501 2.255054 1.428691
H 4.993582 1.274471 -0.217566
H 4.877461 0.966515 1.575307
H 4.146466 3.374564 1.158558
H -2.386716 2.706547 -0.512039
H -2.984542 1.299201 0.403222
H -2.335355 1.136005 -2.612071
H -3.924112 1.618080 -1.991961
H 5.507619 -0.503823 -0.684584
H 1.411371 -1.700742 0.125302
H -3.549997 -0.916234 -2.596633
H -2.529654 -1.006699 -1.140934
H 5.938693 -2.701571 -1.693694
H 1.874136 -3.893625 -0.926421
H 4.133384 -4.408829 -1.833411
H -7.573779 -0.396567 0.294917
H -7.070741 -2.067823 0.623333
H -6.072011 0.376875 2.245691
H -7.481607 -0.593991 2.698767
H -4.619776 -1.712816 2.379290
H -5.398167 -1.336800 3.923875
H -6.023237 -2.642876 2.908428


%chk=000297075-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000297075

0 1
O 1.556070 3.579801 0.910815
N 2.872441 0.289499 0.256056
N -1.213531 1.375085 -0.513348
N 3.537328 2.325661 1.067516
C 1.660346 1.163563 0.198310
C 1.161699 1.391083 -1.266162
C 0.513031 0.648903 1.127595
C -0.205160 2.102232 -1.329212
C -0.815964 1.402529 0.919746
C 2.202108 2.506630 0.758927
C 4.053797 0.986650 0.798461
C -2.593188 1.887127 -0.724560
C 2.982279 -1.058723 -0.123513
C -3.225489 1.382680 -2.039590
C 4.238969 -1.730450 0.017404
C 1.888468 -1.814379 -0.654117
C -3.374630 -0.165292 -2.073791
C 4.388169 -3.082275 -0.353204
C 2.056140 -3.164429 -1.018588
C 3.301881 -3.818140 -0.875603
C -4.289665 -0.683666 -1.037639
C -5.044520 -1.096258 -0.149590
C -5.927695 -1.584413 0.928547
C -5.543880 -1.036163 2.335335
C -4.130886 -1.460920 2.785351
H 1.080283 0.415774 -1.773564
H 1.917095 1.983951 -1.816372
H 0.833919 0.741079 2.182740
H 0.344847 -0.422336 0.930092
H -0.100394 3.158885 -0.985173
H -0.541303 2.122428 -2.381885
H -1.604358 0.896250 1.508363
H -0.722144 2.448030 1.298367
H 4.889629 1.012297 0.064197
H 4.428786 0.500523 1.726807
H 4.107250 3.077333 1.454286
H -2.623001 3.005395 -0.701114
H -3.218870 1.529535 0.115137
H -2.614640 1.696287 -2.908742
H -4.219474 1.855527 -2.157711
H 5.110560 -1.203436 0.417598
H 0.903089 -1.362486 -0.784544
H -3.728065 -0.481388 -3.075142
H -2.369148 -0.604868 -1.923466
H 5.366835 -3.560891 -0.229734
H 1.194340 -3.710598 -1.419589
H 3.420905 -4.867899 -1.161901
H -6.976379 -1.305385 0.701978
H -5.897607 -2.693100 0.954186
H -5.615835 0.068400 2.319755
H -6.295725 -1.398366 3.064220
H -3.369659 -1.106281 2.066422
H -3.887885 -1.046234 3.780803
H -4.047667 -2.562558 2.845641


