PcDNIW!,trach*=0Ely|ـ3^(=d4+bkYucDM=A_p2+:R#,BLh1M YA}=EpͮŻw$xFy uyly x yChwEwGy]iyORTSRSMcPiDNIWRSMcSMApIAMtAtomsCBALAtomstcAp#XTtActual MeasurementCRPprohsCBALActualtpOp#XTtOptimal MeasurementCRPprohsCBALOptimalLUQpTLQtQualityCBALQuality Measurement Measurements%dh1WEVcWEVc( soppSTEpVNFpGSMcPiDNIWGSMcGSMpTXETMessage CBALMessageSMApIAMtAtoms&\CBALAtomsMessageMessages b:Bt <n:Warning: Arbitrary dihedral chosen for C(5)-C(4)-C(7)-C(8) =Warning: Arbitrary dihedral chosen for C(8)-C(11)-N(12)-C(14)  [Pi System: 19 18 17 14 20 15 21 16 12 11 9 6 1 2 3 5 4 8 7 22 3Warning: Some parameters are guessed (Quality = 1). s Iteration 111: Minimization terminated normally because the gradient norm is less than the minimum gradient norm  Stretch: 0.3878  Bend: 25.5618  Stretch-Bend: -0.2347  Torsion: -6.6237  Non-1,4 VDW: -2.6388  1,4 VDW: 4.2207  Dipole/Dipole: 3.2069 Total: 23.8800 %dh1 WEVcWEVc( sopp STEpVNFptaMp1B|{?J?Lh0e(h3 E_%?r,2?ݼ? y˿sǨ??-|Ly?^7G !?\?ZOs?PASp.`ff????noCp.`ff????PYTp+S&lBdahSd3nRZpB DDVp2roCpceRp(SpAptnCpxPBp NRTp8VS#pDPSpIPSpCCPp4tAPpMZPpsMPpLBPpOBPpCPPpFWTp SystemSWTp PrlCfnpm DNIWVSSp DNIWPlbLDNIWSystem VDMptAMpPSSpWDVpPSDpWDVptDwVDNIWw lcSp3dnbpDNIW& sVBRsVCMsVsMsVBSsVbMsVTMTMsVdWTMtHsMsOrSpDNIWdnbpDNIW&