%chk=000004461.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000004461

0 1
O -1.088528 1.215744 -0.648163
O -6.190821 -2.437814 1.174702
O 4.660284 -1.710507 0.941656
N -3.288339 -2.973841 0.896516
N 1.744736 1.907999 -1.027833
N -0.417462 -0.920100 0.053510
N -5.913546 -0.637013 -0.292094
N 4.914562 0.419395 -0.078097
N -5.315184 2.378295 0.065656
N 7.496819 0.470140 0.047048
N -7.330257 3.056206 -1.112712
N 9.751239 -0.305226 0.458001
N 9.354684 1.661244 -0.761276
C -3.952054 -1.823668 0.448610
C -1.694459 -1.477102 0.278331
C 1.281585 0.711607 -0.455617
C -2.974669 -0.878967 0.059652
C -1.916817 -2.773437 0.791046
C 3.571551 0.747839 -0.332197
C 2.409563 -0.021275 -0.015048
C -0.154931 0.384174 -0.367045
C 3.132573 1.933964 -0.957782
C -5.425591 -1.683385 0.480510
C -3.909261 -4.215809 1.391103
C 0.934268 2.981441 -1.629621
C -7.304347 -0.174282 -0.227421
C -7.445620 1.205145 0.481266
C 5.378784 -0.735887 0.515178
C -6.682651 2.310331 -0.241672
C 6.917976 -0.751579 0.635225
C 8.805215 0.584364 -0.060425
H -3.125455 0.129934 -0.314292
H -1.207557 -3.545181 1.084238
H 0.386601 -1.526575 0.222318
H 2.441593 -0.979589 0.498804
H 3.703207 2.773889 -1.348729
H -4.605475 -4.625546 0.641634
H -3.111132 -4.949459 1.591800
H -4.486419 -4.020567 2.307711
H -7.721165 -0.096708 -1.248452
H -7.871337 -0.940340 0.328417
H 1.618240 3.735904 -2.052942
H 0.286941 2.579783 -2.424878
H 0.281802 3.446450 -0.874286
H -5.261122 -0.110291 -0.875437
H 5.695369 1.054073 -0.333782
H -7.105730 1.108573 1.529676
H -8.510385 1.489222 0.482564
H 7.137535 -0.856138 1.721578
H 7.268230 -1.686293 0.143071
H -4.919045 1.817335 0.818851
H -4.715196 3.082336 -0.362913
H -6.723421 3.759974 -1.586737
H 9.450632 -1.063661 1.063124
H 10.699976 -0.331317 0.092721
H 10.266068 2.032748 -0.501964
H 8.690939 2.288947 -1.208905


%chk=000004461-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000004461

0 1
O -1.087649 1.217172 -0.650910
O -6.188382 -2.437073 1.174309
O 4.661140 -1.691292 0.941447
N -3.285859 -2.972868 0.894736
N 1.745837 1.908621 -1.034093
N -0.416041 -0.918680 0.049441
N -5.912451 -0.637926 -0.294466
N 4.914086 0.423349 -0.076247
N -5.316048 2.376569 0.074186
N 7.495428 0.471549 0.049422
N -7.332488 3.059869 -1.098659
N 9.743967 -0.311513 0.462977
N 9.354936 1.652698 -0.761834
C -3.950166 -1.823147 0.446501
C -1.692774 -1.475934 0.275139
C 1.282462 0.713698 -0.458553
C -2.973271 -0.878303 0.056691
C -1.914484 -2.772097 0.788539
C 3.571812 0.751061 -0.333091
C 2.410013 -0.017300 -0.014491
C -0.153989 0.385890 -0.370198
C 3.133437 1.935102 -0.962995
C -5.423727 -1.683248 0.479031
C -3.906213 -4.215141 1.389295
C 0.935654 2.979278 -1.641237
C -7.303334 -0.175477 -0.229144
C -7.445630 1.200585 0.485872
C 5.375477 -0.728000 0.519250
C -6.683756 2.309700 -0.232145
C 6.913887 -0.746798 0.641099
C 8.801865 0.580202 -0.058118
H -3.124534 0.130462 -0.317446
H -1.204847 -3.543446 1.081863
H 0.388287 -1.525247 0.216830
H 2.441687 -0.973685 0.503208
H 3.704339 2.773858 -1.356135
H -4.596932 -4.629102 0.636987
H -3.107272 -4.946012 1.596729
H -4.489192 -4.018649 2.301895
H -7.718681 -0.093134 -1.250380
H -7.871111 -0.944033 0.322412
H 1.619775 3.736264 -2.059769
H 0.295251 2.575618 -2.441175
H 0.276400 3.441533 -0.890238
H -5.260583 -0.111823 -0.878961
H 5.695650 1.056995 -0.332496
H -7.105363 1.099429 1.533725
H -8.510632 1.483753 0.488822
H 7.132136 -0.847899 1.728017
H 7.262825 -1.683949 0.152657
H -4.918754 1.811183 0.823449
H -4.716681 3.082928 -0.351409
H -6.726322 3.766260 -1.569633
H 9.440159 -1.066816 1.070534
H 10.692622 -0.342704 0.097790
H 10.267599 2.021681 -0.503468
H 8.693432 2.281489 -1.211362


