%mem=3200MB
%nprocshared=12
#p freq=noraman b3lyp/genecp nosymm 5d 7f
empiricaldispersion=gd3 scrf=(pcm,solvent=water)

nbnh24-H2eta1_vacuum_aq

1 1
 Nb	-0.000017000	-0.015186000	-0.026300000
 N	 0.000932000	 1.930720000	-0.093802000
 N	-0.000251000	-0.376358000	 1.895560000
 N	-1.740382000	-0.506314000	-0.817814000
 N	 1.739906000	-0.507998000	-0.817713000
 H	 0.001670000	 2.565246000	 0.703949000
 H	 0.001723000	 2.461597000	-0.967775000
 H	-0.836271000	-0.553970000	 2.454184000
 H	 0.835563000	-0.554759000	 2.454242000
 H	-2.464109000	 0.193493000	-0.986562000
 H	-2.047133000	-1.402111000	-1.193728000
 H	 2.045813000	-1.404092000	-1.193608000
 H	 2.464277000	 0.191131000	-0.986510000
 H	-0.004563000	-2.971303000	-0.418334000
 H	-0.004689000	-3.711251000	-0.490311000

-H -C -N -O -P -B -S -Al -Cl -F -He -Si 0
6-31+g*
****
-Pd -Os -Au -W -Fe -K -Ti -Cu -Co -Pt -Ag -Cr -V -Sc -Mn -Hf -Ir -I -Br -Ta -Zn -Zr -Mo -Re -Ru -Rh -Ru -Ni -Nb -Xe -Sn -In -Y -Ga -Hg 0
sdd
*******************

-Pd -Os -Au -W -Fe -K -Ti -Cu -Co -Pt -Ag -Cr -V -Sc -Mn -Hf -Ir -I -Br -Ta -Zn -Zr -Mo -Re -Ru -Rh -Ru -Ni -Nb -Xe -Sn -In -Y -Ga -Hg 0
sdd


