%chk=000299005.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000299005

0 1
O -0.524028 -3.555151 -0.730379
O 1.322125 2.313817 -0.692289
O 2.926397 2.540442 0.890040
O 0.011968 1.986891 2.011748
O -1.343835 3.274660 0.915051
O 4.685948 -3.594674 0.576362
O 5.644232 -1.668782 0.844634
O -5.220684 -1.038170 -1.352763
O -5.335968 1.013680 -0.660070
N -0.830525 2.200451 1.163580
N 4.679607 -2.379667 0.637676
N -4.745938 -0.028724 -0.870035
C 0.897710 -0.411357 0.183518
C -0.556423 -0.086942 0.082945
C 1.031577 -1.827877 -0.005743
C -1.234206 -1.253780 -0.398022
C -0.281503 -2.421582 -0.431436
C 2.047115 0.348134 0.352142
C -1.331072 1.026167 0.398437
C 2.233103 -2.488078 0.130013
C -2.577426 -1.269079 -0.707378
C 3.289436 -0.317120 0.527289
C 3.369580 -1.703170 0.437669
C -3.304643 -0.072288 -0.502832
C -2.705597 1.051158 0.058958
C 2.157925 1.837112 0.283549
C 1.401610 3.765838 -0.981466
C 0.152176 4.045895 -1.781218
H 2.320143 -3.576878 0.001102
H -3.076852 -2.171178 -1.092788
H 4.197273 0.278320 0.735851
H -3.300187 1.964635 0.247543
H 1.448225 4.307844 -0.019064
H 2.336213 3.910877 -1.549290
H 0.005627 3.303298 -2.577839
H -0.751042 4.033780 -1.151055
H 0.203442 5.034999 -2.256837


%chk=000299005-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000299005

0 1
O -0.550821 -3.638102 -0.693799
O 1.234961 2.374476 -0.609692
O 3.069919 2.504029 0.827752
O 0.029971 2.003956 1.981907
O -1.436172 3.335097 0.849465
O 4.724006 -3.684385 0.479617
O 5.707321 -1.657899 0.855459
O -5.347991 -1.208792 -1.209735
O -5.461156 0.976738 -0.553182
N -0.886579 2.197318 1.097855
N 4.688119 -2.400852 0.594909
N -4.822472 -0.124167 -0.754708
C 0.880245 -0.434347 0.172784
C -0.579944 -0.116680 0.081145
C 1.021156 -1.850093 -0.012469
C -1.267062 -1.294900 -0.358887
C -0.298086 -2.443620 -0.399426
C 2.054472 0.342765 0.349369
C -1.387355 1.009824 0.365353
C 2.240570 -2.522964 0.102428
C -2.637114 -1.341753 -0.630324
C 3.293585 -0.333200 0.514532
C 3.368731 -1.733648 0.413207
C -3.367218 -0.147101 -0.443208
C -2.768576 1.017094 0.068582
C 2.167316 1.840699 0.270901
C 1.339531 3.860131 -0.851607
C 0.364267 4.199303 -1.971220
H 2.321952 -3.604206 -0.037994
H -3.126693 -2.259612 -0.967537
H 4.198875 0.250934 0.705450
H -3.369762 1.911034 0.255920
H 1.095055 4.368551 0.097449
H 2.389537 4.080402 -1.112068
H 0.606104 3.644177 -2.893483
H -0.673879 3.972970 -1.675113
H 0.426688 5.280323 -2.192030


