%chk=000267391.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000267391

0 1
O -5.199811 0.705699 0.541360
O -2.764516 -2.956600 -0.733907
N -1.670077 -0.943199 -0.573465
N -4.012187 -1.110094 -0.095856
N 1.880828 1.184346 -0.342101
N 0.713095 0.538346 -0.211981
C -2.849297 1.044888 0.109045
C -1.686458 0.433035 -0.273097
C -4.105313 0.294323 0.219797
C -2.934579 2.494823 0.447670
C -2.828074 -1.770038 -0.481759
C -0.417139 1.171585 -0.426137
C 3.102029 0.477126 -0.071359
C 4.301893 1.193209 -0.254765
C 3.118162 -0.862401 0.353775
C 5.516504 0.550401 -0.009446
C 4.346231 -1.481874 0.591546
C 5.544617 -0.782892 0.412014
H -0.783972 -1.402252 -0.818903
H -3.936660 2.756400 0.834389
H -2.764987 3.128776 -0.433235
H -2.213026 2.775776 1.226508
H -4.868847 -1.678745 -0.030699
H -0.536385 2.227971 -0.702861
H 1.942643 2.175922 -0.596270
H 4.295982 2.229205 -0.583025
H 2.186783 -1.410119 0.498990
H 6.450211 1.096164 -0.149048
H 4.367350 -2.521553 0.921339
H 6.496502 -1.275429 0.600282


%chk=000267391-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000267391

0 1
O -5.346965 0.738764 -0.036530
O -2.587037 -3.041205 -0.017957
N -1.609262 -0.911891 -0.012784
N -3.936435 -1.115800 -0.027630
N 1.881944 1.146014 0.009747
N 0.690697 0.500996 0.001672
C -2.943487 1.120381 -0.020961
C -1.703284 0.486096 -0.013068
C -4.159419 0.291172 -0.028849
C -3.126652 2.621427 -0.021903
C -2.701532 -1.785949 -0.019309
C -0.434796 1.203501 -0.004763
C 3.113671 0.445840 0.016163
C 4.313379 1.204902 0.027055
C 3.165795 -0.971608 0.011734
C 5.559489 0.545236 0.033368
C 4.419877 -1.615204 0.018330
C 5.621873 -0.867735 0.029099
H -0.671120 -1.322941 -0.006308
H -4.207117 2.839357 -0.028388
H -2.679154 3.098406 -0.914290
H -2.689805 3.098267 0.875806
H -4.770742 -1.709937 -0.032885
H -0.463263 2.304037 -0.004322
H 1.916138 2.176147 0.011186
H 4.272518 2.301914 0.030641
H 2.236576 -1.545997 0.003208
H 6.481433 1.136624 0.041746
H 4.457844 -2.710041 0.014923
H 6.590338 -1.377970 0.034072


