%chk=000261221.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000261221

0 1
O -3.453802 -1.380723 -0.569622
O -6.537452 -0.474277 -0.186581
O -5.077110 0.866530 0.912087
N 3.672477 1.258740 0.136403
N 2.539829 0.542901 0.029693
N 1.472631 1.029091 0.528216
C 4.941308 0.449847 0.045666
C 5.137411 -0.461975 1.275488
C 4.958037 -0.374838 -1.256927
C 6.458352 -1.232242 1.154982
C 6.282724 -1.138546 -1.374938
C 6.519647 -2.036034 -0.151877
C 3.753931 2.481386 0.986850
C 0.239345 0.358776 0.222287
C -0.837693 0.695728 1.066813
C 0.046499 -0.534108 -0.853118
C -2.097844 0.136619 0.853929
C -1.204871 -1.099880 -1.072591
C -2.260430 -0.756441 -0.208829
C -4.503233 -1.478294 0.402321
C -5.343028 -0.204227 0.423987
C -7.530819 0.599610 -0.278992
C -8.219286 0.781267 1.056564
H 5.775189 1.201219 0.006152
H 4.291223 -1.173209 1.355957
H 5.123347 0.133160 2.205918
H 4.809461 0.288997 -2.128908
H 4.106701 -1.084651 -1.272632
H 7.312237 -0.529668 1.204837
H 6.572668 -1.912451 2.020293
H 6.276522 -1.751803 -2.296022
H 7.122985 -0.427340 -1.489514
H 5.759793 -2.841472 -0.129224
H 7.499364 -2.541253 -0.238310
H 4.692714 3.015887 0.786304
H 2.915696 3.160146 0.737312
H 3.682165 2.256482 2.062712
H -0.683016 1.402222 1.884447
H 0.880264 -0.781327 -1.511632
H -2.937645 0.430876 1.485630
H -1.381410 -1.791098 -1.893925
H -4.111104 -1.701072 1.411734
H -5.087932 -2.342443 0.013617
H -7.021187 1.516181 -0.625879
H -8.195105 0.195342 -1.064869
H -7.527604 1.190308 1.808845
H -8.602134 -0.169534 1.448484
H -9.065317 1.474990 0.979464


%chk=000261221-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000261221

0 1
O -3.568267 -1.999154 0.872884
O -5.295683 -0.091210 -0.143091
O -6.075132 0.431471 1.995534
N 3.422811 1.180605 0.397549
N 2.295903 0.417649 0.365291
N 1.282182 0.945418 1.025188
C 4.655360 0.517522 -0.106642
C 5.218299 -0.497455 0.925781
C 4.430529 -0.155090 -1.482275
C 6.517447 -1.161333 0.409814
C 5.737701 -0.807176 -1.992913
C 6.298782 -1.824475 -0.970604
C 3.480862 2.420131 1.194252
C 0.084764 0.166300 0.942658
C -1.003671 0.625481 1.725993
C -0.092585 -1.003135 0.143295
C -2.239840 -0.055961 1.736251
C -1.318546 -1.684566 0.144928
C -2.393594 -1.217191 0.941851
C -4.704891 -1.580350 1.676879
C -5.419653 -0.300433 1.215618
C -5.978190 1.122382 -0.701214
C -7.437022 0.808618 -1.041617
H 5.398079 1.330392 -0.240857
H 4.442503 -1.268268 1.103352
H 5.401986 0.011555 1.892209
H 4.059083 0.598554 -2.202195
H 3.641081 -0.921649 -1.378119
H 7.315689 -0.394323 0.323759
H 6.873304 -1.908071 1.145403
H 5.548534 -1.303570 -2.964015
H 6.499226 -0.021263 -2.181079
H 5.581898 -2.664051 -0.861794
H 7.247891 -2.256715 -1.342064
H 4.468856 2.884831 1.048715
H 2.683469 3.111202 0.869855
H 3.310947 2.217598 2.269785
H -0.861525 1.526813 2.331357
H 0.739669 -1.358903 -0.471159
H -3.054229 0.330219 2.357236
H -1.473291 -2.580909 -0.463941
H -4.434257 -1.442777 2.741179
H -5.422668 -2.416042 1.602503
H -5.901186 1.938135 0.038875
H -5.381151 1.358550 -1.595641
H -8.016272 0.591168 -0.128706
H -7.504368 -0.054601 -1.725818
H -7.896335 1.681473 -1.541649


