%chk=000188035.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000188035

0 1
O -2.711826 1.682685 2.423204
O 3.383985 2.626852 -2.308652
O -5.915849 -1.711316 -2.425822
O 5.046607 -1.908678 2.374133
O -6.522484 0.373331 -2.294977
O 6.475923 -0.276359 2.220237
N -3.796730 0.607329 0.853191
N 4.004305 1.138917 -0.826418
N -3.524434 1.744704 1.560918
N 4.178896 2.327572 -1.481104
N -5.387046 1.891627 -0.453464
N 6.039894 1.599607 0.408632
N -4.967881 -0.463523 -0.892178
N 4.668108 -0.354041 0.874765
N -5.860689 -0.609402 -1.938038
N 5.448561 -0.880501 1.887988
C -0.706509 -0.050150 0.479000
C 0.457710 -0.333591 -0.479774
C -1.922927 -0.919235 0.142776
C 1.675805 0.534317 -0.138874
C -3.095934 -0.703541 1.102586
C 2.836029 0.226258 -1.092663
C -4.762293 0.691484 -0.213144
C 4.951269 0.787123 0.201255
H -0.979006 1.021836 0.435678
H -0.386318 -0.234709 1.524349
H 0.138572 -0.151490 -1.524672
H 0.733740 -1.406346 -0.427098
H -1.641370 -1.993551 0.175102
H -2.249960 -0.745425 -0.904037
H 1.993208 0.342179 0.908640
H 1.406097 1.606817 -0.188312
H -3.836671 -1.532795 0.993468
H -2.753999 -0.705325 2.163387
H 3.164610 -0.834910 -0.982830
H 2.532062 0.370647 -2.154971
H -5.207357 2.728255 0.084751
H -6.087440 1.954018 -1.208098
H 6.207842 2.447082 -0.116261
H 6.720798 1.353452 1.143225


%chk=000188035-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000188035

0 1
O -2.888182 1.363322 2.730879
O 3.307882 2.429188 -2.486541
O -5.860807 -1.264820 -2.868680
O 5.334805 -1.696821 2.599789
O -6.329168 0.927064 -2.445315
O 6.677157 0.106575 2.214035
N -3.833134 0.468943 0.873486
N 3.979761 1.037161 -0.836746
N -3.648966 1.580254 1.738736
N 4.190589 2.213625 -1.598825
N -5.217275 1.978600 -0.328594
N 5.966133 1.708040 0.275142
N -4.872967 -0.350539 -1.022455
N 4.705794 -0.303092 0.902442
N -5.730615 -0.211899 -2.162117
N 5.622270 -0.637454 1.951522
C -0.801741 -0.123430 0.455702
C 0.432231 -0.466175 -0.408874
C -1.961772 -1.118239 0.231531
C 1.608283 0.506010 -0.166687
C -3.207041 -0.858011 1.110620
C 2.818855 0.140380 -1.055852
C -4.697855 0.731427 -0.224602
C 4.954637 0.812650 0.173429
H -1.135761 0.906900 0.216120
H -0.515292 -0.119252 1.526121
H 0.146594 -0.449951 -1.480984
H 0.761499 -1.501270 -0.183542
H -1.619494 -2.145009 0.470290
H -2.270277 -1.126265 -0.830413
H 1.916413 0.457592 0.894653
H 1.288825 1.544335 -0.380226
H -3.974888 -1.622097 0.911460
H -2.935497 -0.867352 2.181804
H 3.152330 -0.886823 -0.842206
H 2.554102 0.236993 -2.124316
H -4.984692 2.677177 0.378813
H -5.837913 2.139051 -1.133663
H 5.996039 2.502820 -0.365303
H 6.656438 1.521593 1.015266


