%chk=000236647.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000236647

0 1
O -0.137908 -0.978476 -1.522773
O 2.783572 0.655779 0.822248
O 4.054768 -1.000350 -0.055040
N -4.042033 0.285715 0.238451
N -1.231437 0.734536 -0.408528
N 0.480166 -0.627536 0.673848
C -2.988611 0.212103 1.305314
C -3.485304 -0.163753 -1.081392
C -1.813576 1.128343 0.905762
C -2.285683 0.723300 -1.469938
C -5.219604 -0.551227 0.615325
C -0.296196 -0.339674 -0.491355
C 1.702626 -1.424537 0.452814
C 2.983254 -0.616709 0.343309
C 3.893256 1.609545 0.728306
C 3.987446 2.136349 -0.686702
H -2.622048 -0.820084 1.493141
H -3.436030 0.576842 2.254894
H -4.285303 -0.050921 -1.844992
H -3.180451 -1.233082 -1.088375
H -2.173983 2.180290 0.797834
H -1.038044 1.138255 1.697575
H -1.840501 0.367705 -2.428331
H -2.610302 1.777569 -1.618986
H -5.009760 -1.624034 0.737959
H -5.999740 -0.437204 -0.155292
H -5.644622 -0.169750 1.557826
H 0.610005 0.127813 1.356664
H 1.807451 -2.149565 1.297984
H 1.594650 -2.046079 -0.482378
H 3.571909 2.371665 1.460973
H 4.817742 1.104058 1.060195
H 4.692280 2.972962 -0.759489
H 4.330461 1.355470 -1.382846
H 3.013049 2.485782 -1.054507


%chk=000236647-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000236647

0 1
O -0.212779 -1.653506 -1.773527
O 2.900416 0.825741 0.741198
O 4.426564 -0.773630 -0.015314
N -4.228341 0.370501 0.249846
N -1.516226 -0.129493 -0.562966
N 0.753875 -0.538279 0.028725
C -3.133422 0.382230 1.245631
C -3.935578 -0.602536 -0.832901
C -1.791001 0.759649 0.578444
C -2.620456 -0.231946 -1.538285
C -5.548274 0.146450 0.870506
C -0.323805 -0.813390 -0.819251
C 2.019995 -1.234375 -0.182353
C 3.246491 -0.400601 0.159753
C 4.033863 1.736891 1.103756
C 4.445029 2.589691 -0.098579
H -3.018011 -0.615618 1.744612
H -3.369560 1.128990 2.027158
H -4.762485 -0.573860 -1.566567
H -3.859874 -1.647608 -0.437080
H -1.845535 1.814482 0.236989
H -0.996067 0.675822 1.338243
H -2.337989 -0.995327 -2.280584
H -2.750895 0.743388 -2.050891
H -5.636202 -0.845940 1.381191
H -6.334678 0.202831 0.096812
H -5.748075 0.935024 1.618287
H 0.783489 0.287326 0.625339
H 2.091609 -2.165880 0.417727
H 2.081932 -1.555357 -1.239184
H 3.624823 2.344270 1.926868
H 4.873021 1.117212 1.465270
H 5.226839 3.309323 0.207493
H 4.856465 1.958892 -0.904012
H 3.586340 3.159732 -0.492856


