B3LYP_D3BJ     WTMAD-1        WTMAD-2        WTMAD-3        WTMAD-4        
AL2X6          1.3680         0.2686         0.4957         2.7041         
ALK8           1.2519         0.1879         0.3467         0.9838         
ALKBDE10       0.2216         0.2584         0.4769         1.4199         
BH76RC         1.1358         1.8706         1.7317         1.7507         
DC13           5.3356         1.4815         2.7339         2.5158         
DIPCS10        0.2388         0.0429         0.0791         2.3815         
FH51           1.3175         2.5445         1.3856         1.9034         
G21EA          0.9641         0.8419         0.9353         1.2531         
G21IP          0.1792         0.2941         0.2269         1.7657         
G2RC           1.3781         0.7893         0.8768         0.9330         
HEAVYSB11      1.6658         0.3709         0.6844         2.7490         
NBPRC          1.0096         0.5134         0.9474         1.4158         
PA26           0.1449         0.2340         0.2499         1.7340         
RC21           1.2317         0.8508         1.1252         1.0796         
SIE4x4         9.1165         5.0798         8.8171         2.5846         
TAUT15         5.8555         3.3818         6.2404         2.0530         
W4-11          0.1716         0.9194         0.1824         1.1101         
YBDE18         2.3826         1.0220         1.5768         3.6727         
BSR36          1.6910         4.4129         3.4043         2.0751         
C60ISO         0.1121         0.1205         0.2224         0.8061         
CDIE20         5.0479         2.9201         4.0548         1.7546         
DARC           4.0534         2.0524         3.7872         3.5284         
ISO34          0.8985         2.4622         2.0112         2.4387         
ISOL24         2.9278         3.7644         4.3560         3.5219         
MB16-43        1.2539         1.3518         0.8731         2.4937         
PArel          5.9565         3.0215         4.1956         1.9840         
RSE43          0.8682         5.7687         3.7257         2.7659         
BH76           2.8773         13.7986        5.0423         2.6611         
BHDIV10        1.6254         0.4211         0.7770         1.6310         
BHPERI         0.5956         0.8714         0.9308         0.8245         
BHROT27        2.0696         1.0466         1.0765         1.3762         
INV24          0.5300         0.4690         0.5427         1.4129         
PX13           2.1857         1.0002         1.8457         1.5591         
WCPT18         1.1459         0.6922         1.0680         1.2260         
ADIM6          0.5553         0.1164         0.2149         1.2352         
AHB21          0.1666         0.1827         0.2416         0.6283         
CARBHB12       4.4421         1.0364         1.9124         1.4769         
CHB6           0.7118         0.1872         0.3454         1.7812         
HAL59          2.8773         4.3432         2.0444         1.6749         
HEAVY28        1.7163         4.5510         4.5139         1.4525         
IL16           0.0384         0.0661         0.1147         2.6669         
PNICO23        2.4230         1.5326         1.8506         1.1512         
RG18           0.6562         2.3916         3.6899         1.1861         
S22            1.5648         0.5538         0.6991         1.2770         
S66            1.3124         1.8596         0.7825         1.4598         
WATER27        0.2054         0.8028         0.8258         1.7759         
ACONF          0.2524         0.2429         0.4483         0.9337         
Amino20x4      1.0601         4.0814         1.4169         1.4482         
BUT14DIOL      1.5648         4.2003         1.8226         2.8378         
ICONF          1.4639         0.8937         1.4600         1.7698         
IDISP          1.8021         0.8929         1.6477         2.7234         
MCONF          1.1105         1.3382         0.7287         1.4232         
PCONF21        2.6754         3.4908         5.3859         1.4005         
SCONF          1.5144         0.6572         1.0736         1.7485         
UPU23          3.0792         1.4540         1.7556         1.8800         