%chk=000223749.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000223749

0 1
O 5.537584 0.821837 0.371090
N -2.089278 0.794929 0.274467
N 2.447633 0.321632 1.481374
N -1.615507 2.020659 0.716272
N -1.069004 -1.484953 -0.038085
N 1.300354 -1.558603 0.568590
C 0.113031 0.535500 0.794572
C -1.054604 -0.156022 0.306202
C 1.304531 -0.233082 0.924800
C -3.468005 0.646330 -0.123417
C -0.314648 1.887175 1.029252
C 3.741767 -0.403015 1.459972
C 0.123367 -2.127014 0.117636
C 4.505934 -0.127379 0.217883
C -3.901791 -0.546271 -0.725334
C -4.366364 1.708715 0.097676
C 0.180807 -3.575674 -0.232038
C 4.457331 -0.568209 -1.078852
C -5.241794 -0.668369 -1.101479
C -5.698778 1.564355 -0.288386
C -6.141418 0.379328 -0.886900
C 5.502957 0.122901 -1.793858
C 6.126812 0.943196 -0.891326
H 0.280630 2.706516 1.401245
H 2.516255 1.337927 1.509270
H 3.560701 -1.508045 1.558327
H 4.324178 -0.089945 2.361985
H -3.212959 -1.378540 -0.900154
H -4.025671 2.636058 0.563293
H -0.766155 -3.933188 -0.667379
H 0.987839 -3.779380 -0.953766
H 0.391467 -4.185063 0.662138
H 3.778666 -1.288161 -1.499063
H -5.582837 -1.592940 -1.567158
H -6.398019 2.383138 -0.120176
H -7.182888 0.274765 -1.183886
H 5.725145 -0.003950 -2.836048
H 6.936931 1.636942 -0.910542


%chk=000223749-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000223749

0 1
O 5.366100 1.079525 0.365134
N -2.146884 0.777595 0.269072
N 2.445553 0.253951 1.229334
N -1.669563 2.037792 0.686820
N -1.186021 -1.494952 -0.054727
N 1.200478 -1.603451 0.475730
C 0.056764 0.515601 0.718813
C -1.120136 -0.168366 0.278806
C 1.249004 -0.277242 0.806274
C -3.532623 0.643446 -0.080573
C -0.352405 1.868122 0.952512
C 3.705507 -0.518614 1.271877
C 0.004961 -2.150731 0.068014
C 4.668583 -0.143083 0.186257
C -4.045360 -0.602394 -0.522414
C -4.378209 1.776293 0.023545
C 0.029923 -3.619072 -0.277164
C 5.046576 -0.708986 -1.019588
C -5.412497 -0.701814 -0.858281
C -5.740861 1.655538 -0.316653
C -6.267560 0.419240 -0.759173
C 6.018580 0.177475 -1.629789
C 6.184613 1.246783 -0.768042
H 0.223234 2.726977 1.295366
H 2.494099 1.255952 1.415264
H 3.425540 -1.577832 1.161814
H 4.177932 -0.375687 2.261761
H -3.377105 -1.463693 -0.594045
H -3.958430 2.724355 0.366304
H -0.974848 -3.956300 -0.571210
H 0.737858 -3.806641 -1.104495
H 0.380649 -4.210367 0.587452
H 4.670097 -1.645805 -1.425434
H -5.808082 -1.664996 -1.199589
H -6.392865 2.532310 -0.235003
H -7.327356 0.332266 -1.022150
H 6.524925 0.034929 -2.582353
H 6.794032 2.145976 -0.781269


