%chk=000214698.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000214698

0 1
O 0.567364 -0.316300 -1.864745
O -1.423696 1.153322 2.257665
O 2.410212 -1.292580 2.219845
O 3.305958 1.085636 -0.340683
O 4.829187 -0.265282 -1.274428
N 1.492477 -0.778593 0.152602
N 0.436033 -0.114395 2.210127
C -0.757181 0.405229 0.036391
C -0.870753 1.839095 -0.555997
C -2.032078 -0.387256 -0.252777
C 0.449138 -0.233141 -0.663913
C -0.648560 0.539506 1.561594
C 0.352308 2.712995 -0.250922
C 1.524087 -0.768277 1.582139
C -3.246693 0.071490 0.286899
C -2.028109 -1.545419 -1.041089
C 0.238683 4.067606 -0.943992
C 2.724936 -1.244219 -0.524394
C -4.433923 -0.619827 0.042705
C -3.221257 -2.235332 -1.282780
C -4.425190 -1.777017 -0.743457
C 3.741945 -0.146147 -0.767325
H -1.787954 2.324792 -0.162437
H -1.019797 1.753862 -1.654442
H 1.288219 2.208314 -0.575635
H 0.452579 2.864102 0.842939
H 0.461546 -0.078327 3.244795
H -3.265484 0.967337 0.915927
H -1.110873 -1.923218 -1.494754
H 2.456259 -1.700145 -1.516789
H 3.213181 -2.051778 0.087083
H 0.193954 3.963728 -2.035052
H -0.658667 4.613328 -0.628353
H 1.102174 4.702721 -0.712785
H -5.368961 -0.255834 0.468073
H -3.206356 -3.134183 -1.898972
H -5.351986 -2.316275 -0.933729
H 3.985877 1.799978 -0.500734


%chk=000214698-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000214698

0 1
O 0.925464 0.143351 -1.765716
O -1.177842 1.662754 2.249595
O 2.006166 -1.693743 2.370483
O 3.678287 0.531902 -0.053137
O 4.617638 -1.025717 -1.505780
N 1.394746 -0.852481 0.263859
N 0.346837 -0.067045 2.247516
C -0.640540 0.643786 0.063910
C -0.919929 2.021613 -0.619486
C -1.860517 -0.308767 -0.202107
C 0.615739 0.000624 -0.554119
C -0.514226 0.825088 1.586670
C 0.189906 3.079498 -0.427646
C 1.288419 -0.933929 1.673572
C -3.016189 -0.229447 0.617916
C -1.868369 -1.189183 -1.314479
C -0.158130 4.393496 -1.159840
C 2.508969 -1.572592 -0.373174
C -4.146128 -1.029648 0.340529
C -3.001452 -1.987729 -1.586877
C -4.143746 -1.916261 -0.759615
C 3.701991 -0.688191 -0.731912
H -1.873218 2.402760 -0.210115
H -1.068080 1.827105 -1.697122
H 1.150484 2.688033 -0.814501
H 0.325166 3.287271 0.651377
H 0.340543 -0.045517 3.272660
H -3.042642 0.461946 1.466432
H -1.005826 -1.243367 -1.985908
H 2.166583 -2.055252 -1.301310
H 2.854042 -2.346757 0.334068
H -0.272158 4.223509 -2.246768
H -1.106458 4.819381 -0.781997
H 0.632646 5.152273 -1.017609
H -5.028794 -0.955903 0.985348
H -2.989519 -2.661905 -2.450445
H -5.020363 -2.538030 -0.971496
H 4.479099 1.066569 -0.304179


