%chk=000270663.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000270663

0 1
O -7.559554 -1.070942 -2.151142
O -9.164502 -0.903804 -0.410306
O 8.765124 -0.474645 0.348541
O 6.935205 -1.778121 -0.117006
N 6.758595 0.492115 0.509678
N -2.922506 0.199517 -0.031198
C 1.950826 -1.029795 -0.103522
C 3.100464 -0.099027 0.205257
C 0.737728 -0.152064 0.101119
C 2.606368 1.197596 0.554431
C 1.142319 1.166244 0.490275
C 4.454954 -0.369762 0.180189
C -0.596249 -0.475709 -0.043042
C 3.489106 2.218355 0.876941
C 0.195214 2.150198 0.729674
C 5.340304 0.680873 0.511616
C -1.555507 0.536122 0.214219
C 4.867486 1.960812 0.856587
C -1.165511 1.829302 0.595852
C -5.259052 0.070761 0.529443
C -3.853100 0.418593 0.842374
C -6.945618 -0.644916 -0.978732
C -5.618423 -0.346517 -0.781361
C -7.913103 -0.545494 0.066350
C 7.407583 -0.710464 0.204313
C -6.211793 0.166580 1.550815
C -7.573292 -0.143314 1.339389
C -8.976032 -1.247526 -1.824998
C 9.661482 -1.585096 0.010088
C 9.755296 -1.736482 -1.492025
H 1.943007 -1.912112 0.565589
H 2.006428 -1.423359 -1.137645
H 4.833305 -1.361032 -0.086548
H -0.920265 -1.467721 -0.351350
H 3.124707 3.209032 1.143129
H 0.493126 3.155939 1.017723
H 5.559012 2.760442 1.109218
H -1.915506 2.597475 0.769810
H 7.345254 1.294657 0.760168
H -3.697241 0.848369 1.847959
H -4.870688 -0.423610 -1.573102
H -5.910687 0.487042 2.548869
H -8.305493 -0.067412 2.137903
H -9.221906 -2.310525 -1.947478
H -9.553404 -0.531039 -2.423862
H 10.598039 -1.226640 0.476814
H 9.291538 -2.497707 0.510919
H 10.532500 -2.456183 -1.775766
H 8.804465 -2.096074 -1.916350
H 9.987096 -0.782435 -1.983021


%chk=000270663-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000270663

0 1
O -7.683201 -1.545058 -1.915000
O -9.358521 -0.664164 -0.434942
O 8.880201 -0.450453 0.350565
O 7.075764 -1.829209 -0.297089
N 6.788140 0.363363 0.566812
N -2.976835 0.050679 0.000353
C 1.948138 -1.125232 -0.225970
C 3.103481 -0.217993 0.182392
C 0.720521 -0.267753 0.061884
C 2.595001 1.030602 0.656743
C 1.126616 1.001374 0.585116
C 4.479618 -0.482991 0.135030
C -0.633752 -0.562728 -0.130590
C 3.492107 2.032222 1.091417
C 0.155112 1.975661 0.910800
C 5.375954 0.531059 0.575101
C -1.622040 0.400670 0.229528
C 4.876734 1.778161 1.048777
C -1.210018 1.673361 0.735924
C -5.360741 0.224940 0.465789
C -3.949137 0.515409 0.750064
C -7.077450 -0.798686 -0.872104
C -5.722820 -0.567662 -0.672276
C -8.070030 -0.282035 -0.002866
C 7.514109 -0.742608 0.158231
C -6.364125 0.739821 1.333655
C -7.743658 0.493984 1.112482
C -9.144427 -1.483054 -1.662899
C 9.831171 -1.511302 -0.086723
C 10.150624 -1.381272 -1.578562
H 1.940568 -2.067917 0.355318
H 2.009931 -1.415194 -1.293056
H 4.875681 -1.434520 -0.226490
H -0.970314 -1.518706 -0.544760
H 3.127710 2.997560 1.459123
H 0.452983 2.962123 1.284173
H 5.582364 2.548990 1.383789
H -1.966778 2.436177 0.953350
H 7.354749 1.143815 0.906032
H -3.758579 1.134184 1.652726
H -4.942057 -0.955855 -1.330151
H -6.062218 1.342491 2.198112
H -8.515734 0.888046 1.777408
H -9.525072 -2.502658 -1.480678
H -9.638534 -0.983416 -2.513574
H 10.718313 -1.338905 0.543747
H 9.387941 -2.496329 0.142921
H 10.918858 -2.124674 -1.862334
H 9.250356 -1.568321 -2.187768
H 10.540393 -0.375495 -1.812729


