%chk=000252429.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000252429

0 1
O 4.805460 1.942986 0.719060
O 5.496235 1.034563 -1.362473
O -2.157163 2.362116 -0.952048
O -5.665875 -0.591209 -0.380030
N -0.349605 0.187122 0.309456
N -3.598534 -1.319838 0.319427
N -3.910124 0.891610 -0.668809
N -1.229115 -1.823083 0.978200
C -1.726899 0.224605 0.027805
C -2.245058 -1.029159 0.453785
C -0.088833 -1.057218 0.874909
C 1.252067 -1.502387 1.343743
C 2.381224 -0.858195 0.585608
C -2.524356 1.271954 -0.564487
C -4.480469 -0.349361 -0.256198
C 3.007485 0.289301 1.143831
C 4.033719 0.834492 0.409708
C 2.786708 -1.388520 -0.638663
C -4.132213 -2.629184 0.766229
C 4.448370 0.287186 -0.844584
C 3.843131 -0.821038 -1.390158
C -4.866452 1.867787 -1.261540
C 5.752521 2.102464 -0.391261
H 1.312109 -2.617912 1.265843
H 1.338347 -1.307343 2.440291
H 0.294793 0.932805 0.099232
H 2.700750 0.703133 2.100144
H 2.282214 -2.267493 -1.043749
H -3.644088 -3.450125 0.211289
H -5.224186 -2.675442 0.589468
H -3.936789 -2.773335 1.843882
H 4.152553 -1.242697 -2.343178
H -4.331862 2.794461 -1.544571
H -5.658695 2.119337 -0.535365
H -5.343500 1.441194 -2.160789
H 6.765487 1.960273 0.008040
H 5.538944 3.062447 -0.879947


%chk=000252429-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000252429

0 1
O 4.735350 1.954341 0.882072
O 5.572779 1.164316 -1.225426
O -2.015675 2.258502 -1.224648
O -5.752592 -0.440417 -0.193381
N -0.334304 0.007701 0.114843
N -3.638907 -1.245819 0.434573
N -3.881840 0.881117 -0.695297
N -1.296761 -1.859906 0.982882
C -1.710761 0.143716 -0.090739
C -2.271371 -1.020381 0.456092
C -0.123322 -1.200803 0.757676
C 1.235022 -1.701615 1.182772
C 2.395364 -0.978354 0.508612
C -2.473644 1.190091 -0.714071
C -4.499072 -0.283090 -0.150851
C 2.960709 0.179980 1.124111
C 4.003373 0.821923 0.452506
C 2.898036 -1.435543 -0.735944
C -4.206849 -2.477534 1.015166
C 4.495683 0.356834 -0.786354
C 3.964300 -0.775807 -1.407023
C -4.809511 1.864470 -1.300096
C 5.644949 2.286482 -0.249829
H 1.266457 -2.785082 0.970301
H 1.311246 -1.605640 2.283465
H 0.381963 0.674170 -0.176493
H 2.605819 0.542897 2.093489
H 2.455500 -2.325591 -1.196730
H -3.782446 -3.362541 0.512309
H -5.296110 -2.441973 0.869265
H -3.968374 -2.534928 2.090515
H 4.353978 -1.138396 -2.361248
H -4.199040 2.693340 -1.687464
H -5.521685 2.229993 -0.542249
H -5.383710 1.392025 -2.113588
H 6.675100 2.365627 0.130531
H 5.288647 3.212193 -0.737648


