Date:Thu May 07 09:10:13 2015
Set |
PM7 | No. in set | PM6 | No. in set | RM1 | No. in set | PM3 | No. in set | AM1 | No. in set | MNDOD | No. in set | MNDO | No. in set |
MNDO | 0.55 | 379 |
0.50 | 379 |
0.44 | 214 |
0.67 | 380 |
0.63 | 364 |
0.60 | 295 |
0.85 | 380 |
RM1 | 0.47 | 229 |
0.47 | 229 |
0.44 | 214 |
0.50 | 229 |
0.56 | 229 |
0.54 | 229 |
0.74 | 229 |
AM1 | 0.55 | 368 |
0.50 | 368 |
0.44 | 214 |
0.66 | 369 |
0.63 | 364 |
0.59 | 285 |
0.85 | 369 |
HCNO | 0.42 | 92 |
0.42 | 92 |
0.37 | 92 |
0.50 | 92 |
0.44 | 92 |
0.61 | 92 |
0.61 | 92 |
CORE | 0.41 | 180 |
0.40 | 180 |
0.36 | 169 |
0.46 | 180 |
0.50 | 180 |
0.47 | 180 |
0.70 | 180 |
H C O S | 0.21 | 2 |
0.41 | 2 |
0.26 | 2 |
0.35 | 2 |
0.42 | 2 |
0.09 | 2 |
0.81 | 2 |
H C O P | 0.34 | 1 |
0.61 | 1 |
0.44 | 1 |
0.55 | 1 |
1.01 | 1 |
0.26 | 1 |
1.52 | 1 |
EVERYTHING | 0.54 | 380 |
0.50 | 380 |
0.44 | 214 |
0.67 | 380 |
0.63 | 364 |
0.60 | 295 |
0.85 | 380 |
Elements in
MNDO: H Li Be B C N O F
Na Mg Al Si P S Cl K Ca
Zn Ga Ge As Se Br Rb Sr
Cd In Sn Sb Te I Cs Ba
Hg
Tl Pb Bi
RM1: H
C N O F
P S Cl
Br
I La Ce Pr Nd Pm Sm Eu Gd
Tb Dy Ho Er Tm Yb Lu
AM1: H Li Be
C N O F Na Mg Al Si P S Cl K Ca
Zn Ga Ge As Se Br Rb Sr
Mo
Cd In Sn Sb Te I Cs Ba La Ce Pr Nd Pm Sm Eu Gd Tb Dy Ho Er Tm
Yb Lu Hg
Tl Pb Bi
HCNO: H
C N O
CORE: H
C N O F
P S Cl
Br
I
H C O S
H C
O
S
H C O P
H C
O
P
EVERYTHING: H He Li Be B C N O F Ne Na Mg Al Si P S Cl K Ar K Ca Sc Ti V Cr Mn
Fe Co Ni Cu Zn Ga Ge As Se Br Kr Rb Sr Y Zr Nb Mo Tc Ru Rh Pd Ag Cd In Sn Sb Te
I Kr Cs Ba La Ce Pr Nd Pm Sm Eu Gd Tb Dy Ho Er Tm Yb Lu Hf Ta W Re Os Ir Pt Au
Hg Tl Pb Bi