%nproc=28
%mem=122200MB
#p guess=always b3lyp/gen opt freq empiricaldispersion=GD3 nosymm scrf=(SMD,solvent=toluene) pseudo=(read)

Title Card Required

0 1
 Cu                 1.22224800    0.49303500    0.73839600
 N                  2.10357300    2.36323200    0.81505300
 C                  1.74770500    3.64165100    0.55938900
 C                  3.88040100    3.64843000    1.18307700
 C                  2.85943000    4.48636900    0.77086900
 H                  4.89864800    3.86064500    1.47911400
 H                  2.88578200    5.56002700    0.65774300
 N                  3.09837200   -0.54709600    0.30564800
 C                  3.47709400   -1.66390000   -0.33197900
 C                  4.87059000   -1.84708700   -0.18800700
 C                  5.29098300   -0.77105200    0.58592000
 H                  5.47343100   -2.64359900   -0.59543300
 H                  6.27125600   -0.50084500    0.96000100
 N                  1.93821500    0.30117500    2.85940400
 C                  1.43182000   -0.00291300    4.06233700
 C                  2.41108100    0.21900400    5.06324400
 C                  3.52676200    0.67000000    4.37285500
 H                  2.30514100    0.06076900    6.12629900
 H                  4.50990600    0.96270100    4.72103600
 N                  3.41154500    2.38317700    1.20161300
 N                  3.22076800    0.70916800    3.05685800
 N                  4.21176700   -0.00862100    0.86797400
 H                  5.18478400    1.47653500    2.24902000
 C                 -0.29092200   -0.20362600   -0.02063400
 C                 -1.62472200   -0.44093400    0.59022500
 O                 -2.21918800    0.55400900    1.04396100
 C                 -3.49914000   -1.89369100    1.10620100
 H                 -3.70351400   -1.05834400    1.77783900
 H                 -3.52567600   -2.80731600    1.70201100
 B                  4.09229300    1.16074400    1.86105400
 C                 -4.53521300   -1.94413000   -0.01688000
 H                 -4.35715200   -2.78225700   -0.70028900
 H                 -4.50596100   -1.01862900   -0.60221500
 H                 -5.54500600   -2.05851700    0.40072500
 C                  2.51302200   -2.53227600   -1.05070600
 C                  1.90142300   -2.07201800   -2.24016100
 C                  2.23519300   -3.82831500   -0.57137500
 C                  0.98908000   -2.90043800   -2.90160500
 C                  1.33673800   -4.63554200   -1.27792400
 C                  0.69200100   -4.18698400   -2.43505600
 H                  0.49687300   -2.53095000   -3.79821800
 H                  1.12053300   -5.63349500   -0.90187100
 C                  0.05545300   -0.52291700    4.22207400
 C                 -0.90736700    0.20469600    4.95721200
 C                 -0.28045300   -1.77923900    3.67268700
 C                 -2.18957500   -0.32811000    5.11686400
 C                 -1.57027600   -2.28949100    3.87628000
 C                 -2.54027200   -1.57647200    4.59115400
 H                 -2.93242700    0.24198700    5.66824600
 H                 -1.82144600   -3.26090800    3.46820000
 C                  0.37049700    4.07406900    0.23486300
 C                 -0.68776300    3.81094800    1.13631300
 C                  0.12333500    4.84361800   -0.93328900
 C                 -1.97165900    4.29930600    0.84036500
 C                 -1.17177000    5.30262800   -1.18548500
 C                 -2.23257400    5.04996800   -0.31146500
 H                 -2.78104300    4.08444400    1.53426500
 H                 -1.35715800    5.87686300   -2.09379000
 C                  2.25372700   -0.72060900   -2.80822200
 H                  3.29173400   -0.71692800   -3.16499500
 H                  2.18056200    0.06180100   -2.05589600
 H                  1.60297300   -0.46065800   -3.64676600
 C                  2.89568800   -4.36911600    0.68112900
 H                  2.98169400   -3.60429800    1.45726900
 H                  3.90894100   -4.72469000    0.47207000
 H                  2.32864700   -5.20859200    1.08742200
 C                 -0.34164100   -5.03833300   -3.13259400
 H                 -0.23143600   -6.10112100   -2.87920300
 H                 -0.27256300   -4.93999000   -4.22168400
 H                 -1.35656900   -4.73341600   -2.84754600
 C                  0.72565300   -2.58256100    2.88181700
 H                  1.68730100   -2.63901100    3.39845500
 H                  0.92416900   -2.12070900    1.90856200
 H                  0.36811200   -3.60054000    2.70856200
 C                 -0.57636000    1.53520600    5.59534300
 H                  0.12396400    2.11710600    4.99317900
 H                 -0.10858000    1.39561300    6.58012000
 H                 -1.48224100    2.13166200    5.74635100
 C                 -3.93704000   -2.12325200    4.76728800
 H                 -4.29411700   -1.98479400    5.79359400
 H                 -3.98773600   -3.19341800    4.53703000
 H                 -4.65252800   -1.60944600    4.10903600
 C                  1.22430300    5.19861800   -1.90791100
 H                  1.99366000    4.42190400   -1.96857600
 H                  1.73047500    6.12704300   -1.60858600
 H                  0.81692200    5.35647400   -2.91139300
 C                 -0.48752200    3.03379600    2.41334200
 H                  0.51353600    3.18016700    2.82754600
 H                 -0.62623900    1.96468700    2.23496300
 H                 -1.22344300    3.33874500    3.16349200
 C                 -3.61075200    5.60242900   -0.58960200
 H                 -4.38685700    5.05051100   -0.04552800
 H                 -3.85197500    5.56615000   -1.65660000
 H                 -3.67906000    6.65218300   -0.28087400
 H                 -0.30016800   -0.49036200   -1.08972400
 N                 -2.13779400   -1.69836200    0.59693500
 C                 -1.47752600   -2.77217000   -0.17009500
 H                 -1.76448300   -2.69619800   -1.22850800
 C                 -1.77965600   -4.17311200    0.35074400
 H                 -1.17820500   -4.89285700   -0.21275400
 H                 -1.52054000   -4.27140700    1.40708300
 H                 -2.83047600   -4.44787400    0.22627200
 H                 -0.39763400   -2.60990600   -0.12451300
 N                 -0.14509900    1.98120800   -2.20494400
 N                  0.91247500    2.11929800   -2.60345000
 C                 -1.36650700    1.80535600   -1.77210600
 C                 -2.20318500    0.86833400   -2.54201200
 O                 -1.68549200   -0.01016500   -3.25627900
 N                 -3.55994600    1.00421100   -2.42300000
 C                 -4.22391500    2.17437300   -1.83459500
 H                 -3.49436600    2.97971200   -1.73086400
 H                 -4.97668400    2.52762800   -2.55447800
 C                 -4.40294200    0.07371300   -3.18001200
 H                 -5.38180200    0.04175200   -2.68745500
 H                 -3.96067200   -0.92382000   -3.11326300
 C                 -4.55817400    0.48137400   -4.65155600
 H                 -5.22316700   -0.21517600   -5.17286400
 H                 -4.98336300    1.48665900   -4.74283300
 H                 -3.58425500    0.46717100   -5.14786000
 C                 -4.88691200    1.88175800   -0.48263100
 H                 -4.14420100    1.53282600    0.24200900
 H                 -5.36174600    2.79054400   -0.09620500
 H                 -5.66587100    1.11687400   -0.58004800
 H                 -1.64033800    2.35653800   -0.88183800

-H -B -C -N -O 0
6-31+g(d,p)
****
-Cu 0
SDD
*****

-Cu 0
SDD


