%chk=000196321.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000196321

0 1
O 5.881864 0.433378 0.337824
O 5.274295 -1.858833 0.222411
O -5.375830 1.235073 0.592630
O -6.015193 -0.945221 -0.089581
N -0.169400 1.499980 0.620831
N 0.661004 2.666576 -2.465959
C -0.545091 0.160809 0.196299
C 1.127217 1.956705 0.020838
C 0.420327 -0.786917 -0.154771
C 2.217750 0.901403 0.053757
C 1.848249 -0.451235 -0.029594
C -1.945177 -0.136036 0.107855
C -2.333836 -1.434517 -0.330088
C 0.000367 -2.061119 -0.627321
C 3.566166 1.316481 0.177097
C 2.833147 -1.476474 0.029591
C -0.169443 1.631694 2.109860
C -1.333715 -2.379733 -0.700851
C -2.941832 0.859196 0.429976
C 4.504134 0.313242 0.219497
C 4.138785 -1.067087 0.148600
C -3.726978 -1.804656 -0.420304
C -4.240739 0.478634 0.332532
C -4.634146 -0.851369 -0.086427
C 0.858831 2.346090 -1.375510
C 6.409114 -0.934533 0.329489
C -6.522394 0.368245 0.320165
H 1.461079 2.881765 0.578464
H 0.755687 -2.786632 -0.934487
H 3.842465 2.366545 0.225575
H 2.563008 -2.529016 -0.014888
H 0.661104 1.106018 2.606964
H -0.126249 2.701391 2.372551
H -1.115054 1.231405 2.515782
H -1.647633 -3.361945 -1.054632
H -2.642712 1.869915 0.707655
H -4.011196 -2.800607 -0.746983
H 7.026216 -1.053608 -0.571145
H 6.897761 -1.113496 1.296198
H -7.076140 0.235211 1.258878
H -7.075213 0.793976 -0.528178


%chk=000196321-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000196321

0 1
O 5.953022 0.420545 0.511043
O 5.353920 -1.886773 0.248115
O -5.412501 1.240751 0.660228
O -6.080832 -0.975875 0.043914
N -0.133679 1.447496 0.651309
N 0.692300 2.707813 -2.504237
C -0.543101 0.150267 0.184336
C 1.119650 1.938205 0.032293
C 0.435429 -0.798906 -0.210327
C 2.246989 0.900925 0.098646
C 1.870687 -0.466477 -0.057741
C -1.948282 -0.157279 0.122238
C -2.356020 -1.487337 -0.294593
C -0.001091 -2.081649 -0.678455
C 3.593296 1.300649 0.298024
C 2.883373 -1.476781 -0.021630
C -0.243573 1.710177 2.109986
C -1.350093 -2.423681 -0.700123
C -2.945183 0.835219 0.439614
C 4.557595 0.292962 0.305855
C 4.202243 -1.065396 0.147505
C -3.752667 -1.838390 -0.344713
C -4.270203 0.452848 0.375780
C -4.670449 -0.865770 0.000975
C 0.867557 2.356565 -1.378002
C 6.501295 -0.941145 0.261161
C -6.577862 0.405640 0.273789
H 1.426765 2.848792 0.581392
H 0.739905 -2.808652 -1.026434
H 3.866779 2.352736 0.419316
H 2.639330 -2.538501 -0.094835
H 0.572330 1.231323 2.693721
H -0.227064 2.798876 2.297946
H -1.202080 1.312270 2.478103
H -1.660815 -3.415147 -1.047915
H -2.647975 1.859330 0.671933
H -4.063773 -2.838776 -0.656636
H 6.991332 -0.953904 -0.730495
H 7.179396 -1.210586 1.084637
H -7.300817 0.392424 1.103646
H -7.004531 0.795910 -0.668768


