B3LYP_D3BJ     WTMAD-1        WTMAD-2        WTMAD-3        WTMAD-4        
AL2X6          1.3680         0.2686         0.4957         2.1354         
ALK8           1.2519         0.1879         0.3467         0.9515         
ALKBDE10       0.2216         0.2584         0.4769         1.6194         
BH76RC         1.1358         1.8706         1.7317         1.8924         
DC13           5.3356         1.4815         2.7339         2.7482         
DIPCS10        0.2388         0.0429         0.0791         1.9124         
FH51           1.3175         2.5445         1.3856         2.1721         
G21EA          0.9641         0.8419         0.9353         1.3359         
G21IP          0.1792         0.2941         0.2269         2.0220         
G2RC           1.3781         0.7893         0.8768         1.1440         
HEAVYSB11      1.6658         0.3709         0.6844         1.9185         
NBPRC          1.0096         0.5134         0.9474         1.8238         
PA26           0.1449         0.2340         0.2499         1.9650         
RC21           1.2317         0.8508         1.1252         1.3106         
SIE4x4         9.1165         5.0798         8.8171         2.5903         
TAUT15         5.8555         3.3818         6.2404         2.0574         
W4-11          0.1716         0.9194         0.1824         1.1238         
YBDE18         2.3826         1.0220         1.5768         3.1481         
BSR36          1.6910         4.4129         3.4043         2.8374         
C60ISO         0.1121         0.1205         0.2224         0.7076         
CDIE20         5.0479         2.9201         4.0548         1.9478         
DARC           4.0534         2.0524         3.7872         4.1945         
ISO34          0.8985         2.4622         2.0112         2.6475         
ISOL24         2.9278         3.7644         4.3560         3.4576         
MB16-43        1.2539         1.3518         0.8731         2.1919         
PArel          5.9565         3.0215         4.1956         2.0546         
RSE43          0.8682         5.7687         3.7257         2.2588         
BH76           2.8773         13.7986        5.0423         2.6242         
BHDIV10        1.6254         0.4211         0.7770         1.7105         
BHPERI         0.5956         0.8714         0.9308         0.8184         
BHROT27        2.0696         1.0466         1.0765         1.7303         
INV24          0.5300         0.4690         0.5427         1.3851         
PX13           2.1857         1.0002         1.8457         1.7634         
WCPT18         1.1459         0.6922         1.0680         1.2929         
ADIM6          0.5553         0.1164         0.2149         0.5649         
AHB21          0.1666         0.1827         0.2416         0.7937         
CARBHB12       4.4421         1.0364         1.9124         1.8906         
CHB6           0.7118         0.1872         0.3454         1.7394         
HAL59          2.8773         4.3432         2.0444         1.5291         
HEAVY28        1.7163         4.5510         4.5139         1.4650         
IL16           0.0384         0.0661         0.1147         2.2317         
PNICO23        2.4230         1.5326         1.8506         1.3061         
RG18           0.6562         2.3916         3.6899         0.9975         
S22            1.5648         0.5538         0.6991         1.5004         
S66            1.3124         1.8596         0.7825         1.5193         
WATER27        0.2054         0.8028         0.8258         2.0179         
ACONF          0.2524         0.2429         0.4483         0.6493         
Amino20x4      1.0601         4.0814         1.4169         1.4378         
BUT14DIOL      1.5648         4.2003         1.8226         2.3603         
ICONF          1.4639         0.8937         1.4600         1.9000         
IDISP          1.8021         0.8929         1.6477         2.6866         
MCONF          1.1105         1.3382         0.7287         1.0258         
PCONF21        2.6754         3.4908         5.3859         1.4046         
SCONF          1.5144         0.6572         1.0736         1.3988         
UPU23          3.0792         1.4540         1.7556         2.0882         