%chk=000267092.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000267092

0 1
O 0.988035 -1.098597 0.070076
O -4.339800 -2.238470 -0.002375
O -5.189779 2.302826 -0.109038
N -1.329393 -1.512103 0.038235
N -2.975167 1.681309 -0.056382
N -0.666329 0.710993 0.005295
N -4.768328 0.025426 -0.056412
C 4.575169 -0.127631 -0.236311
C 4.888317 0.983055 0.786379
C 5.774506 -1.090098 -0.363867
C 6.164156 1.743433 0.398765
C 7.049620 -0.329973 -0.753409
C 7.358470 0.791324 0.248113
C 3.314517 -0.919251 0.166396
C 2.060207 -0.064404 0.077397
C -0.268691 -0.616367 0.038587
C -2.499618 -0.713202 0.000099
C -2.056515 0.638275 -0.018627
C -3.880832 -1.111983 -0.017143
C -1.293906 -2.974510 0.064158
C -4.379917 1.395580 -0.076374
C -2.510268 3.089278 -0.074247
C -6.236373 -0.224113 -0.080208
H 4.399674 0.346532 -1.233388
H 4.041767 1.689870 0.857420
H 5.007316 0.544425 1.795296
H 5.935572 -1.622563 0.592668
H 5.558739 -1.869641 -1.117443
H 6.001294 2.292789 -0.548430
H 6.388530 2.511724 1.162259
H 7.902368 -1.032311 -0.808077
H 6.938525 0.095208 -1.769472
H 8.251960 1.354720 -0.079001
H 7.614903 0.354063 1.232152
H 3.425283 -1.334719 1.187246
H 3.197037 -1.805875 -0.493719
H 1.893324 0.588788 0.949593
H 1.970277 0.511381 -0.859187
H -0.776374 -3.337976 0.970752
H -2.330984 -3.381229 0.066386
H -0.768714 -3.370309 -0.824336
H -1.926702 3.310233 0.837040
H -3.377899 3.775581 -0.120387
H -1.865207 3.266888 -0.953074
H -6.432901 -1.312494 -0.040955
H -6.681543 0.186539 -1.002720
H -6.722927 0.259078 0.784569


%chk=000267092-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000267092

0 1
O 0.931981 -1.240428 -0.055892
O -4.465732 -2.227395 0.313028
O -5.130767 2.416471 -0.210098
N -1.407784 -1.581162 0.091457
N -2.915522 1.639348 -0.222210
N -0.680341 0.581777 -0.199123
N -4.767442 0.114285 0.049881
C 4.596106 -0.111288 -0.324293
C 4.783841 0.896070 0.842278
C 5.867595 -0.986613 -0.484237
C 6.063901 1.750402 0.674520
C 7.146024 -0.133247 -0.657669
C 7.320016 0.862616 0.512763
C 3.346667 -1.013320 -0.137462
C 2.034780 -0.232586 -0.182581
C -0.331220 -0.727383 -0.058991
C -2.556025 -0.756617 0.045961
C -2.067270 0.547362 -0.131522
C -3.951329 -1.073650 0.150922
C -1.361872 -3.041402 0.268290
C -4.317384 1.450483 -0.132606
C -2.373195 2.997578 -0.412927
C -6.235987 -0.052416 0.141547
H 4.469709 0.473214 -1.263772
H 3.904494 1.564246 0.925778
H 4.845205 0.326607 1.794422
H 5.976011 -1.626393 0.417571
H 5.745076 -1.670428 -1.347796
H 5.956790 2.394527 -0.223111
H 6.180526 2.428785 1.541783
H 8.032579 -0.792010 -0.736320
H 7.082331 0.432365 -1.610549
H 8.216150 1.492325 0.350525
H 7.490871 0.296353 1.451992
H 3.418740 -1.551111 0.828470
H 3.325149 -1.781518 -0.934979
H 1.926796 0.487760 0.646896
H 1.898773 0.307651 -1.137862
H -0.804661 -3.298227 1.185234
H -2.398304 -3.403295 0.347670
H -0.864115 -3.515139 -0.594617
H -1.693475 3.253671 0.417008
H -3.224400 3.693327 -0.436977
H -1.810244 3.052530 -1.360031
H -6.433570 -1.124451 0.287276
H -6.716795 0.308118 -0.782586
H -6.631275 0.533710 0.987240


