B3LYP_NL       WTMAD-1        WTMAD-2        WTMAD-3        WTMAD-4        
AL2X6          1.5268         0.2941         0.5665         2.3018         
ALK8           1.7324         0.2550         0.4912         1.2717         
ALKBDE10       0.2205         0.2523         0.4860         1.5566         
BH76RC         1.1721         1.8934         1.8298         1.8862         
DC13           4.3953         1.1970         2.3059         2.1865         
DIPCS10        0.4236         0.0746         0.1437         3.2768         
FH51           1.2029         2.2787         1.2953         1.9154         
G21EA          1.2698         1.0875         1.2612         1.6992         
G21IP          0.2293         0.3690         0.2972         2.4986         
G2RC           1.6142         0.9068         1.0515         1.2943         
HEAVYSB11      1.3160         0.2874         0.5536         1.4639         
NBPRC          0.8791         0.4385         0.8446         1.5338         
PA26           0.0843         0.1335         0.1489         1.1044         
RC21           1.7119         1.1598         1.6012         1.7592         
SIE4x4         9.3047         5.0852         9.2143         2.5534         
TAUT15         5.9118         3.3488         6.4509         2.0062         
W4-11          0.1974         1.0372         0.2148         1.2484         
YBDE18         2.1180         0.8910         1.4351         2.7028         
BSR36          1.3880         3.5527         2.8610         2.2493         
C60ISO         0.1424         0.1502         0.2894         0.8684         
CDIE20         4.7294         2.6834         3.8898         1.7625         
DARC           2.4675         1.2254         2.3606         2.4661         
ISO34          0.7351         1.9759         1.6848         2.0920         
ISOL24         2.0666         2.6061         3.1482         2.3571         
MB16-43        1.2065         1.2758         0.8602         2.0370         
PArel          4.8837         2.4298         3.5222         1.6270         
RSE43          0.8688         5.6616         3.8172         2.1830         
BH76           3.0896         14.5326        5.5437         2.7215         
BHDIV10        1.9123         0.4859         0.9360         1.9437         
BHPERI         0.8122         1.1655         1.2996         1.0778         
BHROT27        2.2105         1.0964         1.1773         1.7849         
INV24          0.5089         0.4417         0.5336         1.2845         
PX13           3.0022         1.3475         2.5958         2.3394         
WCPT18         1.6656         0.9869         1.5895         1.8151         
ADIM6          0.8739         0.1797         0.3463         0.8586         
AHB21          0.3701         0.3981         0.5496         1.7033         
CARBHB12       4.2668         0.9764         1.8809         1.7539         
CHB6           0.5141         0.1326         0.2555         1.2133         
HAL59          3.2386         4.7949         2.3561         1.6623         
HEAVY28        1.3366         3.4762         3.5993         1.1019         
IL16           0.0159         0.0269         0.0488         0.8953         
PNICO23        1.9021         1.1801         1.4875         0.9902         
RG18           0.5655         2.0213         3.2556         0.8302         
S22            2.4675         0.8565         1.1287         2.2850         
S66            2.2105         3.0720         1.3494         2.4714         
WATER27        0.3773         1.4462         1.5529         3.5794         
ACONF          0.3084         0.2912         0.5610         0.7663         
Amino20x4      1.0795         4.0768         1.4774         1.4142         
BUT14DIOL      2.7246         7.1730         3.2493         3.9692         
ICONF          1.2852         0.7696         1.3124         1.6110         
IDISP          1.4959         0.7270         1.4005         2.1540         
MCONF          0.9767         1.1544         0.6562         0.8714         
PCONF21        1.8507         2.3684         3.8147         0.9384         
SCONF          2.9302         1.2473         2.1271         2.6142         
UPU23          2.2105         1.0238         1.2905         1.4479         