Identifier_1 numAtoms_v1.0 nSK_v1.0 nH_v1.0 nC_v1.0 nN_v1.0 nO_v1.0 nP_v1.0 nS_v1.0 nF_v1.0 nCl_v1.0 nBr_v1.0 nI_v1.0 nB_v1.0 nHM_v1.0 nX_v1.0 numBonds_v1.0 nBO_v1.0 nCIC_v1.0 nCIR_v1.0 nBM_v1.0 SCBO_v1.0 RBN_v1.0 RBF_v1.0 nSB_v1.0 nDB_v1.0 nTB_v1.0 nAB_v1.0 nR03_v1.0 nR04_v1.0 nR05_v1.0 nR06_v1.0 nR07_v1.0 nR08_v1.0 nR09_v1.0 nR10_v1.0 nR11_v1.0 nR12_v1.0 nBNZ_v1.0 CH3R_v1.0 CH2R2_v1.0 CHR3_v1.0 CH3X_v1.0 CH2RX_v1.0 CH2X2_v1.0 CHR2X_v1.0 CHRX2_v1.0 CHX3_v1.0 CR4_v1.0 CR3X_v1.0 CR2X2_v1.0 CRX3_v1.0 CX4_v1.0 =CH2_v1.0 =CHR_v1.0 =CR2_v1.0 =CHX_v1.0 =CRX_v1.0 =CX2_v1.0 #CH_v1.0 #CR_v1.0 #CX_v1.0 R--CH--R_v1.0 R--CR--R_v1.0 R--CX--R_v1.0 R--CH--X_v1.0 R--CR--X_v1.0 R--CX--X_v1.0 X--CH--X_v1.0 X--CR--X_v1.0 X--CX--X_v1.0 R-C(=X)-X_v1.0 X-C(=X)-X_v1.0 nCp_v1.0 nCs_v1.0 nCt_v1.0 nCq_v1.0 Hy_v1.0 MW_v1.0 AMW_v1.0 Sv_v1.0 Mv_v1.0 Se_v1.0 Sp_v1.0 Me_v1.0 Mp_v1.0 MLOGP_v1.0 mlogpCX_v1.0 mlogpON_v1.0 mlogpPRX_v1.0 mlogpUB_v1.0 mlogpHB_v1.0 mlogpPOL_v1.0 mlogpAMP_v1.0 mlogpALK_v1.0 mlogpRNG_v1.0 mlogpQN_v1.0 mlogpNO2_v1.0 mlogpNCS_v1.0 mlogpBLM_v1.0 nHDon_v1.0 nHAcc_v1.0 a_hyd_v1.0 BEHm1_v1.0 BEHm2_v1.0 BEHm3_v1.0 BEHm4_v1.0 BEHm5_v1.0 BEHm6_v1.0 BEHm7_v1.0 BEHm8_v1.0 BELm1_v1.0 BELm2_v1.0 BELm3_v1.0 BELm4_v1.0 BELm5_v1.0 BELm6_v1.0 BELm7_v1.0 BELm8_v1.0 BEHv1_v1.0 BEHv2_v1.0 BEHv3_v1.0 BEHv4_v1.0 BEHv5_v1.0 BEHv6_v1.0 BEHv7_v1.0 BEHv8_v1.0 BELv1_v1.0 BELv2_v1.0 BELv3_v1.0 BELv4_v1.0 BELv5_v1.0 BELv6_v1.0 BELv7_v1.0 BELv8_v1.0 BEHe1_v1.0 BEHe2_v1.0 BEHe3_v1.0 BEHe4_v1.0 BEHe5_v1.0 BEHe6_v1.0 BEHe7_v1.0 BEHe8_v1.0 BELe1_v1.0 BELe2_v1.0 BELe3_v1.0 BELe4_v1.0 BELe5_v1.0 BELe6_v1.0 BELe7_v1.0 BELe8_v1.0 BEHp1_v1.0 BEHp2_v1.0 BEHp3_v1.0 BEHp4_v1.0 BEHp5_v1.0 BEHp6_v1.0 BEHp7_v1.0 BEHp8_v1.0 BELp1_v1.0 BELp2_v1.0 BELp3_v1.0 BELp4_v1.0 BELp5_v1.0 BELp6_v1.0 BELp7_v1.0 BELp8_v1.0 ATS1m_v1.0 ATS2m_v1.0 ATS3m_v1.0 ATS4m_v1.0 ATS5m_v1.0 ATS6m_v1.0 ATS7m_v1.0 ATS8m_v1.0 ATS1v_v1.0 ATS2v_v1.0 ATS3v_v1.0 ATS4v_v1.0 ATS5v_v1.0 ATS6v_v1.0 ATS7v_v1.0 ATS8v_v1.0 ATS1e_v1.0 ATS2e_v1.0 ATS3e_v1.0 ATS4e_v1.0 ATS5e_v1.0 ATS6e_v1.0 ATS7e_v1.0 ATS8e_v1.0 ATS1p_v1.0 ATS2p_v1.0 ATS3p_v1.0 ATS4p_v1.0 ATS5p_v1.0 ATS6p_v1.0 ATS7p_v1.0 ATS8p_v1.0 MATS1m_v1.0 MATS2m_v1.0 MATS3m_v1.0 MATS4m_v1.0 MATS5m_v1.0 MATS6m_v1.0 MATS7m_v1.0 MATS8m_v1.0 MATS1v_v1.0 MATS2v_v1.0 MATS3v_v1.0 MATS4v_v1.0 MATS5v_v1.0 MATS6v_v1.0 MATS7v_v1.0 MATS8v_v1.0 MATS1e_v1.0 MATS2e_v1.0 MATS3e_v1.0 MATS4e_v1.0 MATS5e_v1.0 MATS6e_v1.0 MATS7e_v1.0 MATS8e_v1.0 MATS1p_v1.0 MATS2p_v1.0 MATS3p_v1.0 MATS4p_v1.0 MATS5p_v1.0 MATS6p_v1.0 MATS7p_v1.0 MATS8p_v1.0 GATS1m_v1.0 GATS2m_v1.0 GATS3m_v1.0 GATS4m_v1.0 GATS5m_v1.0 GATS6m_v1.0 GATS7m_v1.0 GATS8m_v1.0 GATS1v_v1.0 GATS2v_v1.0 GATS3v_v1.0 GATS4v_v1.0 GATS5v_v1.0 GATS6v_v1.0 GATS7v_v1.0 GATS8v_v1.0 GATS1e_v1.0 GATS2e_v1.0 GATS3e_v1.0 GATS4e_v1.0 GATS5e_v1.0 GATS6e_v1.0 GATS7e_v1.0 GATS8e_v1.0 GATS1p_v1.0 GATS2p_v1.0 GATS3p_v1.0 GATS4p_v1.0 GATS5p_v1.0 GATS6p_v1.0 GATS7p_v1.0 GATS8p_v1.0 T(N..N)_v1.0 T(N..O)_v1.0 T(N..S)_v1.0 T(N..P)_v1.0 T(N..F)_v1.0 T(N..Cl)_v1.0 T(N..Br)_v1.0 T(N..I)_v1.0 T(O..O)_v1.0 T(O..S)_v1.0 T(O..P)_v1.0 T(O..F)_v1.0 T(O..Cl)_v1.0 T(O..Br)_v1.0 T(O..I)_v1.0 T(S..S)_v1.0 T(S..P)_v1.0 T(S..F)_v1.0 T(S..Cl)_v1.0 T(S..Br)_v1.0 T(S..I)_v1.0 T(P..P)_v1.0 T(P..F)_v1.0 T(P..Cl)_v1.0 T(P..Br)_v1.0 T(P..I)_v1.0 T(F..F)_v1.0 T(F..Cl)_v1.0 T(F..Br)_v1.0 T(F..I)_v1.0 T(Cl..Cl)_v1.0 T(Cl..Br)_v1.0 T(Cl..I)_v1.0 T(Br..Br)_v1.0 T(Br..I)_v1.0 T(I..I)_v1.0 X0_v1.0 X1_v1.0 X2_v1.0 X3_v1.0 X4_v1.0 X5_v1.0 X0A_v1.0 X1A_v1.0 X2A_v1.0 X3A_v1.0 X4A_v1.0 X5A_v1.0 X0v_v1.0 X1v_v1.0 X2v_v1.0 X3v_v1.0 X4v_v1.0 X5v_v1.0 X0Av_v1.0 X1Av_v1.0 X2Av_v1.0 X3Av_v1.0 X4Av_v1.0 X5Av_v1.0 J_v1.0 Uindex_v1.0 Vindex_v1.0 Xindex_v1.0 Yindex_v1.0 Jhetm_v1.0 Jhetv_v1.0 Jhete_v1.0 Jhetp_v1.0 JhetZ_v1.0 GGI1_v1.0 GGI2_v1.0 GGI3_v1.0 GGI4_v1.0 GGI5_v1.0 GGI6_v1.0 GGI7_v1.0 GGI8_v1.0 GGI9_v1.0 GGI10_v1.0 JGI1_v1.0 JGI2_v1.0 JGI3_v1.0 JGI4_v1.0 JGI5_v1.0 JGI6_v1.0 JGI7_v1.0 JGI8_v1.0 JGI9_v1.0 JGI10_v1.0 JGT_v1.0 PW2_v1.0 PW3_v1.0 PW4_v1.0 PW5_v1.0 PJI2_v1.0 ECC_v1.0 AECC_v1.0 DECC_v1.0 SEigm_v1.0 SEigv_v1.0 SEige_v1.0 SEigp_v1.0 SEigZ_v1.0 VEA1_v1.0 VEA2_v1.0 VEA3_v1.0 TIE_v1.0 BLI_v1.0 SPI_v1.0 MWC01_v1.0 MWC02_v1.0 MWC03_v1.0 MWC04_v1.0 MWC05_v1.0 MWC06_v1.0 MWC07_v1.0 MWC08_v1.0 MWC09_v1.0 MWC10_v1.0 TWC_v1.0 SRW01_v1.0 SRW02_v1.0 SRW03_v1.0 SRW04_v1.0 SRW05_v1.0 SRW06_v1.0 SRW07_v1.0 SRW08_v1.0 SRW09_v1.0 SRW10_v1.0 MPC01_v1.0 MPC02_v1.0 MPC03_v1.0 MPC04_v1.0 MPC05_v1.0 MPC06_v1.0 MPC07_v1.0 MPC08_v1.0 MPC09_v1.0 MPC10_v1.0 piPC01_v1.0 piPC02_v1.0 piPC03_v1.0 piPC04_v1.0 piPC05_v1.0 piPC06_v1.0 piPC07_v1.0 piPC08_v1.0 piPC09_v1.0 piPC10_v1.0 IC0_v1.0 IC1_v1.0 IC2_v1.0 IC3_v1.0 IC4_v1.0 IC5_v1.0 BIC0_v1.0 BIC1_v1.0 BIC2_v1.0 BIC3_v1.0 BIC4_v1.0 BIC5_v1.0 SIC0_v1.0 SIC1_v1.0 SIC2_v1.0 SIC3_v1.0 SIC4_v1.0 SIC5_v1.0 CIC0_v1.0 CIC1_v1.0 CIC2_v1.0 CIC3_v1.0 CIC4_v1.0 CIC5_v1.0 TIC0_v1.0 TIC1_v1.0 TIC2_v1.0 TIC3_v1.0 TIC4_v1.0 TIC5_v1.0 Lop_v1.0 DP01_v1.0 DP02_v1.0 DP03_v1.0 DP04_v1.0 DP05_v1.0 DP06_v1.0 DP07_v1.0 DP08_v1.0 DP09_v1.0 DP10_v1.0 DP11_v1.0 DP12_v1.0 DP13_v1.0 DP14_v1.0 DP15_v1.0 DP16_v1.0 DP17_v1.0 DP18_v1.0 DP19_v1.0 DP20_v1.0 RDF010u_v1.0 RDF015u_v1.0 RDF020u_v1.0 RDF025u_v1.0 RDF030u_v1.0 RDF035u_v1.0 RDF040u_v1.0 RDF045u_v1.0 RDF050u_v1.0 RDF055u_v1.0 RDF060u_v1.0 RDF065u_v1.0 RDF070u_v1.0 RDF075u_v1.0 RDF080u_v1.0 RDF085u_v1.0 RDF090u_v1.0 RDF095u_v1.0 RDF100u_v1.0 RDF105u_v1.0 RDF110u_v1.0 RDF115u_v1.0 RDF120u_v1.0 RDF125u_v1.0 RDF130u_v1.0 RDF135u_v1.0 RDF140u_v1.0 RDF145u_v1.0 RDF150u_v1.0 RDF155u_v1.0 RDF010m_v1.0 RDF015m_v1.0 RDF020m_v1.0 RDF025m_v1.0 RDF030m_v1.0 RDF035m_v1.0 RDF040m_v1.0 RDF045m_v1.0 RDF050m_v1.0 RDF055m_v1.0 RDF060m_v1.0 RDF065m_v1.0 RDF070m_v1.0 RDF075m_v1.0 RDF080m_v1.0 RDF085m_v1.0 RDF090m_v1.0 RDF095m_v1.0 RDF100m_v1.0 RDF105m_v1.0 RDF110m_v1.0 RDF115m_v1.0 RDF120m_v1.0 RDF125m_v1.0 RDF130m_v1.0 RDF135m_v1.0 RDF140m_v1.0 RDF145m_v1.0 RDF150m_v1.0 RDF155m_v1.0 RDF010v_v1.0 RDF015v_v1.0 RDF020v_v1.0 RDF025v_v1.0 RDF030v_v1.0 RDF035v_v1.0 RDF040v_v1.0 RDF045v_v1.0 RDF050v_v1.0 RDF055v_v1.0 RDF060v_v1.0 RDF065v_v1.0 RDF070v_v1.0 RDF075v_v1.0 RDF080v_v1.0 RDF085v_v1.0 RDF090v_v1.0 RDF095v_v1.0 RDF100v_v1.0 RDF105v_v1.0 RDF110v_v1.0 RDF115v_v1.0 RDF120v_v1.0 RDF125v_v1.0 RDF130v_v1.0 RDF135v_v1.0 RDF140v_v1.0 RDF145v_v1.0 RDF150v_v1.0 RDF155v_v1.0 RDF010e_v1.0 RDF015e_v1.0 RDF020e_v1.0 RDF025e_v1.0 RDF030e_v1.0 RDF035e_v1.0 RDF040e_v1.0 RDF045e_v1.0 RDF050e_v1.0 RDF055e_v1.0 RDF060e_v1.0 RDF065e_v1.0 RDF070e_v1.0 RDF075e_v1.0 RDF080e_v1.0 RDF085e_v1.0 RDF090e_v1.0 RDF095e_v1.0 RDF100e_v1.0 RDF105e_v1.0 RDF110e_v1.0 RDF115e_v1.0 RDF120e_v1.0 RDF125e_v1.0 RDF130e_v1.0 RDF135e_v1.0 RDF140e_v1.0 RDF145e_v1.0 RDF150e_v1.0 RDF155e_v1.0 RDF010p_v1.0 RDF015p_v1.0 RDF020p_v1.0 RDF025p_v1.0 RDF030p_v1.0 RDF035p_v1.0 RDF040p_v1.0 RDF045p_v1.0 RDF050p_v1.0 RDF055p_v1.0 RDF060p_v1.0 RDF065p_v1.0 RDF070p_v1.0 RDF075p_v1.0 RDF080p_v1.0 RDF085p_v1.0 RDF090p_v1.0 RDF095p_v1.0 RDF100p_v1.0 RDF105p_v1.0 RDF110p_v1.0 RDF115p_v1.0 RDF120p_v1.0 RDF125p_v1.0 RDF130p_v1.0 RDF135p_v1.0 RDF140p_v1.0 RDF145p_v1.0 RDF150p_v1.0 RDF155p_v1.0 Mor01u_v1.0 Mor02u_v1.0 Mor03u_v1.0 Mor04u_v1.0 Mor05u_v1.0 Mor06u_v1.0 Mor07u_v1.0 Mor08u_v1.0 Mor09u_v1.0 Mor10u_v1.0 Mor11u_v1.0 Mor12u_v1.0 Mor13u_v1.0 Mor14u_v1.0 Mor15u_v1.0 Mor16u_v1.0 Mor17u_v1.0 Mor18u_v1.0 Mor19u_v1.0 Mor20u_v1.0 Mor21u_v1.0 Mor22u_v1.0 Mor23u_v1.0 Mor24u_v1.0 Mor25u_v1.0 Mor26u_v1.0 Mor27u_v1.0 Mor28u_v1.0 Mor29u_v1.0 Mor30u_v1.0 Mor31u_v1.0 Mor32u_v1.0 Mor01m_v1.0 Mor02m_v1.0 Mor03m_v1.0 Mor04m_v1.0 Mor05m_v1.0 Mor06m_v1.0 Mor07m_v1.0 Mor08m_v1.0 Mor09m_v1.0 Mor10m_v1.0 Mor11m_v1.0 Mor12m_v1.0 Mor13m_v1.0 Mor14m_v1.0 Mor15m_v1.0 Mor16m_v1.0 Mor17m_v1.0 Mor18m_v1.0 Mor19m_v1.0 Mor20m_v1.0 Mor21m_v1.0 Mor22m_v1.0 Mor23m_v1.0 Mor24m_v1.0 Mor25m_v1.0 Mor26m_v1.0 Mor27m_v1.0 Mor28m_v1.0 Mor29m_v1.0 Mor30m_v1.0 Mor31m_v1.0 Mor32m_v1.0 Mor01v_v1.0 Mor02v_v1.0 Mor03v_v1.0 Mor04v_v1.0 Mor05v_v1.0 Mor06v_v1.0 Mor07v_v1.0 Mor08v_v1.0 Mor09v_v1.0 Mor10v_v1.0 Mor11v_v1.0 Mor12v_v1.0 Mor13v_v1.0 Mor14v_v1.0 Mor15v_v1.0 Mor16v_v1.0 Mor17v_v1.0 Mor18v_v1.0 Mor19v_v1.0 Mor20v_v1.0 Mor21v_v1.0 Mor22v_v1.0 Mor23v_v1.0 Mor24v_v1.0 Mor25v_v1.0 Mor26v_v1.0 Mor27v_v1.0 Mor28v_v1.0 Mor29v_v1.0 Mor30v_v1.0 Mor31v_v1.0 Mor32v_v1.0 Mor01e_v1.0 Mor02e_v1.0 Mor03e_v1.0 Mor04e_v1.0 Mor05e_v1.0 Mor06e_v1.0 Mor07e_v1.0 Mor08e_v1.0 Mor09e_v1.0 Mor10e_v1.0 Mor11e_v1.0 Mor12e_v1.0 Mor13e_v1.0 Mor14e_v1.0 Mor15e_v1.0 Mor16e_v1.0 Mor17e_v1.0 Mor18e_v1.0 Mor19e_v1.0 Mor20e_v1.0 Mor21e_v1.0 Mor22e_v1.0 Mor23e_v1.0 Mor24e_v1.0 Mor25e_v1.0 Mor26e_v1.0 Mor27e_v1.0 Mor28e_v1.0 Mor29e_v1.0 Mor30e_v1.0 Mor31e_v1.0 Mor32e_v1.0 Mor01p_v1.0 Mor02p_v1.0 Mor03p_v1.0 Mor04p_v1.0 Mor05p_v1.0 Mor06p_v1.0 Mor07p_v1.0 Mor08p_v1.0 Mor09p_v1.0 Mor10p_v1.0 Mor11p_v1.0 Mor12p_v1.0 Mor13p_v1.0 Mor14p_v1.0 Mor15p_v1.0 Mor16p_v1.0 Mor17p_v1.0 Mor18p_v1.0 Mor19p_v1.0 Mor20p_v1.0 Mor21p_v1.0 Mor22p_v1.0 Mor23p_v1.0 Mor24p_v1.0 Mor25p_v1.0 Mor26p_v1.0 Mor27p_v1.0 Mor28p_v1.0 Mor29p_v1.0 Mor30p_v1.0 Mor31p_v1.0 Mor32p_v1.0 L1m_v1.0 L2m_v1.0 L3m_v1.0 P1m_v1.0 P2m_v1.0 E1m_v1.0 E2m_v1.0 E3m_v1.0 Tm_v1.0 Am_v1.0 Vm_v1.0 Km_v1.0 Dm_v1.0 L1v_v1.0 L2v_v1.0 L3v_v1.0 P1v_v1.0 P2v_v1.0 E1v_v1.0 E2v_v1.0 E3v_v1.0 Tv_v1.0 Av_v1.0 Vv_v1.0 Kv_v1.0 Dv_v1.0 L1e_v1.0 L2e_v1.0 L3e_v1.0 P1e_v1.0 P2e_v1.0 E1e_v1.0 E2e_v1.0 E3e_v1.0 Te_v1.0 Ae_v1.0 Ve_v1.0 Ke_v1.0 De_v1.0 L1p_v1.0 L2p_v1.0 L3p_v1.0 P1p_v1.0 P2p_v1.0 E1p_v1.0 E2p_v1.0 E3p_v1.0 Tp_v1.0 Ap_v1.0 Vp_v1.0 Kp_v1.0 Dp_v1.0 L1u_v1.0 L2u_v1.0 L3u_v1.0 P1u_v1.0 P2u_v1.0 E1u_v1.0 E2u_v1.0 E3u_v1.0 Tu_v1.0 Au_v1.0 Vu_v1.0 Ku_v1.0 Du_v1.0 L1s_v1.0 L2s_v1.0 L3s_v1.0 P1s_v1.0 P2s_v1.0 E1s_v1.0 E2s_v1.0 E3s_v1.0 Ts_v1.0 As_v1.0 Vs_v1.0 Ks_v1.0 Ds_v1.0 HATS0m_v1.0 HATS1m_v1.0 HATS2m_v1.0 HATS3m_v1.0 HATS4m_v1.0 HATS5m_v1.0 HATS6m_v1.0 HATS7m_v1.0 HATS8m_v1.0 H0m_v1.0 H1m_v1.0 H2m_v1.0 H3m_v1.0 H4m_v1.0 H5m_v1.0 H6m_v1.0 H7m_v1.0 H8m_v1.0 R1m_v1.0 R2m_v1.0 R3m_v1.0 R4m_v1.0 R5m_v1.0 R6m_v1.0 R7m_v1.0 R8m_v1.0 R1m+_v1.0 R2m+_v1.0 R3m+_v1.0 R4m+_v1.0 R5m+_v1.0 R6m+_v1.0 R7m+_v1.0 R8m+_v1.0 HATSm_v1.0 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