%nproc=24
%mem=120GB
%chk=tscf05G_09_single-point_hydrogen.chk
#p b3lyp/gen pseudo=read EmpiricalDispersion=GD3BJ scrf=(pcm,solvent=chlorobenzene) pop=(orbitals=20) optcyc=300 nosymm

Title Card Required

0 1
 C                 -2.28347600   -2.17916300   -0.88264200
 C                 -2.30153000   -0.88383800   -0.34919700
 C                  0.08339000   -0.11731700   -0.41047300
 H                 -2.21290800   -0.55753800    0.68250600
 C                 -2.59999700   -2.05754100   -2.27062500
 N                 -2.68418700    0.00603700   -1.34590600
 C                 -2.78927800   -0.66518400   -2.53843700
 H                 -2.47086300    1.00637700   -1.26754500
 C                 -2.03143300   -3.46992600   -0.20774100
 C                 -3.06899000   -4.10214500    0.55510800
 C                 -0.84385500   -4.16168300   -0.38817700
 C                 -4.33775500   -3.48707500    0.74823400
 C                 -2.85954400   -5.41660200    1.08682500
 C                 -0.58882700   -5.41578100    0.20921700
 C                 -5.35292500   -4.15751400    1.39760200
 H                 -4.50393900   -2.48219200    0.36328600
 C                 -3.92982700   -6.08222000    1.74296700
 C                 -1.59216100   -6.03134900    0.92148600
 H                  0.38021000   -5.89019600    0.08771400
 C                 -5.15648400   -5.47220900    1.88694400
 H                 -6.32082300   -3.67362000    1.53195700
 H                 -3.75617500   -7.08609900    2.13542100
 H                 -1.41614400   -7.01169000    1.36625100
 H                 -5.97459400   -5.99238600    2.38892000
 C                 -3.02912400   -0.19301800   -3.84095200
 C                 -2.74005400   -2.99424200   -3.31658000
 C                 -3.13629200   -1.13799000   -4.85074000
 C                 -3.00844100   -2.52784000   -4.59241300
 Rh                -0.01671100    1.74571800    0.37012700
 Rh                 0.10032700    4.01407000    1.30523700
 O                 -1.24988800    3.33980500    2.74484800
 O                  1.48725500    4.48151700   -0.18037600
 O                 -1.47298900    4.55450000    0.06659500
 C                 -1.62482200    2.13694600    2.73564400
 C                  1.85210800    3.55429300   -0.95216900
 C                 -2.04158500    3.66738000   -0.61479100
 O                 -1.39230300    1.28293300    1.81553400
 C                 -2.50093100    1.59142100    3.86741300
 O                  1.40020600    2.36152600   -0.96601200
 C                  3.01546600    3.75233700   -1.92676400
 O                 -1.59989600    2.47583100   -0.79673100
 C                 -3.32450800    4.00148300   -1.38578300
 N                 -2.08539300    0.19541600    4.13264600
 H                 -3.48621800    1.47805500    3.40116500
 C                 -2.72637900    2.48980300    5.12342700
 N                  2.77313000    2.86481600   -3.08963900
 H                  3.84405300    3.25824900   -1.40274000
 C                  3.51995500    5.19106200   -2.23495900
 N                 -4.27782600    2.87842600   -1.23157400
 H                 -3.03472500    3.94191900   -2.44345700
 C                 -3.94362400    5.42013800   -1.18693100
 C                 -3.07961700   -0.79086300    4.08493700
 C                 -0.71282100   -0.07772100    4.25544400
 C                 -3.47234400    1.66921400    6.19123300
 C                 -1.43813700    3.05100200    5.74788300
 C                 -3.64385200    3.64589100    4.67931100
 C                  3.65660900    1.78488100   -3.24352300
 C                  1.52318700    2.94396400   -3.72253700
 C                  4.14197600    5.74525600   -0.93651200
 C                  4.62902000    5.08084200   -3.29653700
 C                  2.43692700    6.16051000   -2.73143700
 C                 -4.79719000    2.31863500   -2.41166100
 C                 -4.51876700    2.36878800    0.05478000
 C                 -5.25586100    5.50080300   -1.98865600
 C                 -4.23878300    5.78019900    0.27814900
 C                 -2.95451700    6.43956300   -1.78460400
 O                 -4.25937800   -0.49096600    3.91992600
 C                 -2.64647100   -2.19383500    4.25177600
 O                  0.08933700    0.84600400    4.30762100
 C                 -0.29695900   -1.49323600    4.29566100
 H                 -3.72121000    2.31951400    7.04441500
 H                 -2.85215700    0.84243500    6.57045500
 H                 -4.40519400    1.24280500    5.79535100
 H                 -0.78557200    2.24727400    6.11273900
 H                 -1.70646000    3.69205000    6.60401100
 H                 -0.86665600    3.64919700    5.02839300
 H                 -3.81794000    4.33372800    5.52165200
 H                 -4.62230600    3.26384500    4.34578500
 H                 -3.20244400    4.21142800    3.85051300
 O                  4.70775600    1.73616100   -2.61171500
 C                  3.25091400    0.69494000   -4.15668500
 O                  0.74521500    3.84594600   -3.44178000
 C                  1.17407500    1.88333000   -4.69506400
 H                  4.91917900    5.06793800   -0.54803700
 H                  3.38301800    5.86905000   -0.15392800
 H                  4.60759100    6.72311500   -1.13741700
 H                  5.07465400    6.07210600   -3.47377300
 H                  4.23391500    4.71120100   -4.25512400
 H                  5.42692800    4.39552800   -2.97167300
 H                  2.05081300    5.87091000   -3.71709700
 H                  2.86794700    7.17225300   -2.81146600
 H                  1.58930800    6.19876700   -2.03529700
 O                 -4.48711200    2.77495200   -3.50808400
 C                 -5.68287600    1.14665700   -2.27157400
 O                 -3.97457900    2.87819000    1.02591600
 C                 -5.40831100    1.19386300    0.16704600
 H                 -5.66347500    6.52097900   -1.91622400
 H                 -6.01615900    4.81039400   -1.59192400
 H                 -5.09995100    5.26376900   -3.05098800
 H                 -4.60332700    6.81950600    0.32228100
 H                 -3.33979000    5.70064800    0.89775200
 H                 -5.01436700    5.13177800    0.70801900
 H                 -1.99993900    6.43349500   -1.24682400
 H                 -3.38187600    7.45257900   -1.72111900
 H                 -2.75666400    6.22248500   -2.84721800
 C                 -3.60218100   -3.19307300    4.32777000
 C                 -1.26978300   -2.52232600    4.30598700
 C                  1.05106800   -1.80303600    4.30030800
 C                  4.05339100   -0.42799800   -4.26636900
 C                  2.02060200    0.75719400   -4.85666400
 C                 -0.04213900    1.94729600   -5.35409400
 C                 -6.19783700    0.54983800   -3.41076500
 C                 -5.95537400    0.59563300   -0.99638400
 C                 -5.66067800    0.65433500    1.41673600
 H                 -4.65631800   -2.92511200    4.27943500
 C                 -3.21738100   -4.53901500    4.46544200
 C                 -0.85026400   -3.89004400    4.37239700
 C                  1.46770000   -3.14881000    4.31767800
 H                  1.79428100   -1.01181500    4.27524900
 H                  4.99381900   -0.46300700   -3.71892300
 C                  3.65161200   -1.52270200   -5.05397400
 C                  1.59178300   -0.33800500   -5.67563900
 C                 -0.45157000    0.88664500   -6.18639000
 H                 -0.68190000    2.81400400   -5.19091600
 H                 -5.97133900    0.98385500   -4.38344400
 C                 -6.98115700   -0.61510400   -3.31796700
 C                 -6.76056900   -0.58100000   -0.87141500
 C                 -6.46442800   -0.49573200    1.54546700
 H                 -5.22439400    1.11329500    2.29911300
 H                 -3.97418600   -5.31458000    4.55011500
 C                 -1.87712300   -4.87267800    4.46485600
 C                  0.54194700   -4.17234500    4.35981300
 H                  2.53499400   -3.37096500    4.29857100
 H                  4.27794300   -2.41134500   -5.11059000
 C                  2.45241300   -1.47462300   -5.73731500
 C                  0.33898500   -0.23653100   -6.33613600
 H                 -1.41281500    0.94332100   -6.69733800
 H                 -7.36534300   -1.08776700   -4.22066100
 C                 -7.24719300   -1.16513600   -2.07791600
 C                 -7.00792700   -1.09748400    0.42811700
 H                 -6.63387700   -0.91455100    2.53671600
 Br                -1.42158700   -6.72833900    4.60197100
 H                  0.86882100   -5.21119300    4.38824000
 Br                 1.95458100   -3.00218100   -6.77415100
 H                 -0.00076400   -1.06611200   -6.95470800
 Br                -8.28776700   -2.76836300   -2.01103300
 H                 -7.62896000   -1.98642300    0.52797600
 C                  5.81507000   -0.81317100    2.43848400
 C                  4.60742500   -0.23516800    3.06313400
 C                  6.29362400   -2.02921300    2.89441400
 C                  6.46936000   -0.14463100    1.37661000
 O                  4.00849800   -0.81155000    3.96427500
 N                  4.19423300    1.02614900    2.60840700
 H                  5.77240500   -2.52998300    3.70936500
 C                  7.42999400   -2.61687400    2.30805800
 C                  7.62075300   -0.72367100    0.75378600
 C                  5.94707700    1.07707800    0.88210100
 C                  3.12051600    1.70372700    3.36493200
 C                  4.72534800    1.65993800    1.47734900
 H                  7.79794600   -3.57570000    2.67064500
 C                  8.07051600   -1.97721000    1.26313400
 C                  8.21608300   -0.03705400   -0.33848000
 C                  6.55198000    1.71908600   -0.18404400
 C                  2.01655600    2.17005000    2.41557000
 H                  2.64260500    0.90753400    3.94352800
 C                  3.66418600    2.73892500    4.40155300
 O                  4.19245700    2.66554300    1.02405600
 Br                 9.58852600   -2.84142600    0.48079500
 H                  9.09098800   -0.47140300   -0.82085600
 C                  7.69305300    1.15758900   -0.79251400
 H                  6.12082000    2.64440900   -0.55755600
 O                  1.54370900    1.26663900    1.64743600
 O                  1.60961400    3.35750300    2.50988700
 C                  4.72621300    2.04191700    5.27420300
 C                  4.29932700    3.98473300    3.76203300
 C                  2.49979100    3.15318900    5.32361700
 H                  8.15649300    1.66738100   -1.63775700
 H                  5.61012200    1.74680200    4.68783700
 H                  4.32431200    1.14221500    5.76282700
 H                  5.06785900    2.73763500    6.05613100
 H                  5.21305800    3.73167100    3.20437400
 H                  4.58401400    4.69126000    4.55906500
 H                  3.60424300    4.48296100    3.07658900
 H                  1.73930600    3.72638500    4.78122100
 H                  2.88961800    3.77447300    6.14568500
 H                  2.01022300    2.26995100    5.76272500
 O                  0.43679500    6.41193400    2.25577700
 C                 -0.32593800    7.14405600    1.63936800
 C                  0.00418600    7.77759100    0.31816700
 O                 -1.55266400    7.44805000    2.07879100
 H                  0.21024200    6.97096900   -0.40043900
 H                  0.92686500    8.36670900    0.42415100
 H                 -0.81079400    8.41124200   -0.04938600
 C                 -1.93959600    6.83216000    3.34017100
 C                 -3.33845300    7.30282900    3.66946400
 H                 -1.20989700    7.13158800    4.10759900
 H                 -1.87838200    5.74146600    3.22162600
 H                 -3.64593500    6.88086000    4.63837900
 H                 -4.05838700    6.97143700    2.90688100
 H                 -3.37958100    8.40078800    3.74059300
 H                 -2.63100100   -4.05974600   -3.11575600
 H                 -3.11178200   -3.23420900   -5.41816300
 H                 -3.32747700   -0.80420600   -5.87250700
 H                 -3.13296500    0.87121200   -4.04769800
 C                  0.67317000   -1.19847000    0.46585300
 Br                 0.32637500   -0.31747900   -2.26074200
 C                  2.11677100   -1.53503000    0.29156200
 C                  3.01280400   -0.73214600   -0.43204100
 C                  2.55023200   -2.76395200    0.81361000
 C                  4.29852400   -1.19644000   -0.70079200
 H                  2.71112900    0.25387100   -0.78084000
 C                  3.83738000   -3.22361900    0.54157600
 H                  1.84643900   -3.36031400    1.39413900
 C                  4.70509900   -2.45032400   -0.23531300
 H                  4.98051700   -0.56609500   -1.27081700
 H                  4.15971800   -4.19453100    0.92149700
 H                  5.70891000   -2.81596900   -0.45896200
 O                 -0.02292800   -1.74219600    1.31253100
 H                 -0.08726276   -3.72651070   -1.00712228

-C H O N Br 0
cc-pVDZ
****
Rh     0
lanl2dz
F    1   1.00
      1.3500000              1.0000000
****

Rh     0
lanl2dz









