%chk=000117665.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000117665

0 1
O -5.297645 2.364610 -0.444450
O 6.199654 0.666281 0.872376
O 1.625885 -2.434267 -2.174031
N -4.938913 0.158283 1.104492
N -0.418610 -0.376620 -0.699420
C -2.676085 -0.136741 0.181436
C -3.913377 0.559797 0.262430
C -1.659360 0.331554 -0.728993
C -4.096434 1.731898 -0.569005
C -1.882146 1.455422 -1.505412
C -2.510370 -1.286504 1.018012
C -3.103088 2.167474 -1.424879
C 2.746987 -0.749109 -0.940524
C -3.529466 -1.675812 1.849877
C -4.745108 -0.917602 1.861712
C 1.588788 -1.350438 -1.631013
C 2.642948 0.370949 -0.103320
C 4.007976 -1.365007 -1.125934
C 0.309317 -0.536922 -1.748774
C 5.008545 0.272647 0.324557
C 3.768608 0.893882 0.535096
C 5.140595 -0.862765 -0.508459
C 6.201623 1.812266 1.761391
H -1.115699 1.825579 -2.187040
H -1.563067 -1.833405 0.979914
H -3.240020 3.049667 -2.043822
H -3.436403 -2.544256 2.498799
H -5.572267 -1.216473 2.518591
H 1.672167 0.843886 0.068769
H 4.072856 -2.251083 -1.767764
H 0.108204 -0.208297 -2.779741
H 3.669710 1.758405 1.182644
H 6.119506 -1.318949 -0.641534
H -5.361124 3.155120 -1.044137
H 7.263022 1.877445 2.036955
H 5.580410 1.612480 2.639260
H 5.879682 2.709103 1.224742


%chk=000117665-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000117665

0 1
O -5.779260 1.520774 -0.651969
O 5.946496 0.096559 1.395713
O 2.061175 -1.062388 -3.559327
N -4.457242 0.460864 1.503184
N -0.309153 0.096799 -1.140609
C -2.361052 0.261977 0.179981
C -3.755786 0.620799 0.320563
C -1.684349 0.426568 -1.089138
C -4.444523 1.172728 -0.824665
C -2.400755 0.975349 -2.171723
C -1.702796 -0.275034 1.332129
C -3.760163 1.352105 -2.039417
C 2.760485 -0.384143 -1.352695
C -2.415000 -0.428559 2.523249
C -3.793972 -0.048627 2.559142
C 1.734909 -0.592936 -2.412568
C 2.509196 0.253408 -0.106800
C 4.087039 -0.838628 -1.628192
C 0.274435 -0.285838 -2.249803
C 4.849109 -0.028035 0.542134
C 3.540736 0.435421 0.836347
C 5.117724 -0.669163 -0.698524
C 5.740298 0.752276 2.692365
H -1.892356 1.157380 -3.124558
H -0.649208 -0.555805 1.246406
H -4.280639 1.796220 -2.897601
H -1.939025 -0.833840 3.421564
H -4.376009 -0.164694 3.481318
H 1.498167 0.605811 0.111481
H 4.274214 -1.322813 -2.592108
H -0.277990 -0.471196 -3.194035
H 3.319592 0.936293 1.783483
H 6.135807 -1.016059 -0.898588
H -6.159872 1.877074 -1.494935
H 6.725169 0.734698 3.180695
H 5.006581 0.198164 3.308428
H 5.405317 1.798990 2.561875


