%mem=35GB
%nproc=12
#p opt freq=NoRaman B3LYP empiricaldispersion=GD3 SCRF=(SMD,solvent=water) gen pseudo=read

Ottimizzazione CuHHSB

0 2
 C                 -6.45449458   -3.95884743    2.14973107
 C                 -7.00504558   -3.15319243    3.30860707
 H                 -6.82718258   -3.52581843    1.18434607
 H                 -6.73904158   -3.65891443    4.27392207
 H                 -8.12359358   -3.11813143    3.24366907
 C                 -4.34220529   -2.64859807    2.30051815
 C                 -3.13123624   -2.33442791    1.68300500
 C                 -2.37923669   -1.24968836    2.13362514
 C                 -2.83871937   -0.47782523    3.20148259
 C                 -4.04963777   -0.79169273    3.81849217
 C                 -4.80126759   -1.87739299    3.36825064
 H                 -2.76922208   -2.94309245    0.84174701
 H                 -2.24565057    0.37744080    3.55656814
 C                 -6.19982668   -2.11225086    4.03334239
 N                 -6.65584760   -1.41711219    5.02441661
 O                 -4.93938858   -3.95884743    2.14973107
 O                 -1.13761784   -0.92808708    1.50128406
 H                 -0.41922451   -1.04644389    2.12698582
 C                 -6.97051169   -5.40719650    2.23697383
 C                 -6.52817429   -6.24490449    3.26059714
 C                 -7.88052705   -5.88163891    1.29146180
 C                 -6.99632518   -7.55677293    3.34001609
 H                 -5.81132782   -5.87119099    4.00605750
 C                 -8.34815902   -7.19335031    1.37064878
 H                 -8.22910675   -5.22096969    0.48442729
 C                 -7.90634237   -8.03088201    2.39522117
 H                 -9.06535579   -7.56756558    0.62562130
 O                 -6.54307696   -8.41528688    4.38997792
 H                 -6.98093393   -9.26668744    4.31927887
 O                 -8.38613991   -9.37554608    2.47629440
 C                 -9.43541449   -9.56622394    1.52363244
 H                 -9.04531945   -9.44605971    0.53454881
 H                 -9.83947837  -10.55122289    1.63044742
 H                -10.20656688   -8.84406415    1.69307043
 O                 -4.52086137   -0.00095050    4.91282989
 N                 -7.92020945   -1.70009135    5.55480506
 H                 -8.61309592   -1.58856089    4.84243627
 C                 -8.20424348   -0.77743059    6.66337250
 O                 -7.40707554    0.08634220    7.01653943
 C                 -9.56859328   -0.96669711    7.35208710
 C                 -9.66444796   -1.73798883    8.51016425
 C                -10.70923522   -0.36670805    6.81714256
 C                -10.90038662   -1.90874217    9.13448015
 H                 -8.76568547   -2.21062676    8.93216090
 C                -11.94492407   -0.53785456    7.44109685
 H                -10.63342138    0.24133507    5.90399845
 C                -12.04047012   -1.30860173    8.60007469
 H                -10.97566872   -2.51651189   10.04776620
 H                -12.84406922   -0.06512889    7.01973874
 H                -13.01469226   -1.44322461    9.09190487
 C                 -4.80619766    2.68763500    7.03067796
 O                 -5.08148568    3.53195404    6.17926521
 O                 -5.29711685    1.43464371    6.85626127
 C                 -3.96516054    2.81209995    8.31472042
 H                 -3.13861337    2.13429190    8.26680352
 H                 -4.57233822    2.57474219    9.16318759
 H                 -3.60017329    3.81374468    8.40632912
 Cu                -5.96794706   -0.10282380    5.86429858

-O C H N 0
6-31g(d,p)
****
-Cu 0
SDD
F 1 1.0
3.525 1.0
****

-Cu 0
SDD



