%chk=000259705.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000259705

0 1
O 1.500817 -3.261842 -0.405832
N 4.050982 -0.202220 0.355557
N 3.571235 -2.561977 0.263632
N 5.777074 -1.818294 0.786826
C -0.568437 -0.918062 0.322369
C -1.997285 -0.576220 -0.113419
C 0.440778 -0.625233 -0.800363
C -3.013456 -0.913489 0.989526
C 1.844201 -0.888338 -0.344979
C 2.735797 0.104040 -0.083398
C -4.409802 -0.563345 0.552304
C 2.463833 1.556917 -0.209378
C 2.231345 -2.322333 -0.191484
C -4.958443 0.689334 0.867654
C -5.171593 -1.485811 -0.182399
C 4.413021 -1.571007 0.478874
C 1.685993 2.207108 0.759652
C 2.983522 2.272835 -1.297961
C -6.254609 1.011494 0.456316
C -6.466565 -1.158591 -0.591431
C -7.011825 0.089565 -0.272914
C 1.434352 3.576454 0.639190
C 2.725736 3.641460 -1.411576
C 1.953940 4.293446 -0.443801
H -0.499560 -1.992897 0.597068
H -0.298813 -0.352155 1.232620
H -2.073606 0.496597 -0.376051
H -2.255677 -1.131946 -1.037034
H 0.218600 -1.277755 -1.675188
H 0.325026 0.416237 -1.160821
H -2.947730 -1.991639 1.244681
H -2.751467 -0.378775 1.924139
H 4.733636 0.546577 0.449792
H -4.374288 1.412043 1.432358
H -4.751484 -2.457504 -0.435182
H 1.274603 1.642633 1.596853
H 3.574567 1.761397 -2.057600
H -6.675539 1.983906 0.705083
H -7.052898 -1.878367 -1.160102
H 0.828817 4.084724 1.389083
H 3.123834 4.200120 -2.258176
H -8.020363 0.341508 -0.591257
H 1.754036 5.360710 -0.535888
H 6.160088 -1.299583 1.568610
H 6.000807 -2.814423 0.857143


%chk=000259705-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000259705

0 1
O 1.289497 -3.186716 -0.330970
N 4.093799 -0.286834 0.191933
N 3.513755 -2.609537 0.107589
N 5.713122 -1.972638 0.584901
C -0.652196 -0.765573 0.440633
C -2.106414 -0.543860 -0.026403
C 0.370160 -0.535254 -0.707885
C -3.141131 -0.796800 1.105670
C 1.800305 -0.828201 -0.308519
C 2.776199 0.134428 -0.113894
C -4.577001 -0.602433 0.640961
C 2.621040 1.613033 -0.220632
C 2.164087 -2.277781 -0.174536
C -5.256879 0.624606 0.853858
C -5.257090 -1.635610 -0.056188
C 4.404076 -1.642141 0.283906
C 1.556459 2.293689 0.428109
C 3.572014 2.376327 -0.954889
C -6.576005 0.817643 0.383199
C -6.575390 -1.449179 -0.528255
C -7.240658 -0.219607 -0.310812
C 1.440493 3.696975 0.337088
C 3.454804 3.780343 -1.044490
C 2.388529 4.446625 -0.397528
H -0.531612 -1.800984 0.809109
H -0.427941 -0.089540 1.292609
H -2.233021 0.488883 -0.411451
H -2.326108 -1.223204 -0.874230
H 0.104350 -1.235100 -1.523955
H 0.270633 0.494145 -1.098491
H -2.997727 -1.829262 1.481104
H -2.919887 -0.114746 1.950438
H 4.778303 0.430601 0.438110
H -4.748783 1.431942 1.396746
H -4.748690 -2.593609 -0.224126
H 0.834620 1.722064 1.019434
H 4.378545 1.865453 -1.495056
H -7.085821 1.771753 0.561165
H -7.084951 -2.260766 -1.060540
H 0.614911 4.205952 0.846283
H 4.186260 4.351157 -1.626998
H -8.264512 -0.073839 -0.673550
H 2.296592 5.535950 -0.466502
H 6.467235 -1.294471 0.646838
H 5.915233 -2.966588 0.663310


