PcDNIW trach=JMK-dfAh8DOl `-CTj/9p#2/ iw/tH'Wv_bמu.G^~ {Ez|v )x<<V a&6[`R2F7V};Jz[mugK6Zdnob             bmysxCCCCNCCCCCCCCCCCONHHHHHHHHHHHHPYTp+ilyCiloSd"nRZp" TNIpg&i+wet{tcdx8uw xx  FڒwT!x -Try  yWr K)2xjw x x ,HwFx[+t+v}ORTSGSMc PiDNIWGSMcGSMpTXETMessage# CBALMessageSMApIAMtAtoms f&\CBALAtomsMessageMessages&'[ <nk(Z"T5g/aPJ|CPi System: 11 10 9 8 4 3 2 1 6 12 13 14 7 15 3Warning: Some parameters are guessed (Quality = 1).  Stretch: 665.4424  Bend: 937.1735  Stretch-Bend: 54.9637  Torsion: -10.5446  Non-1,4 VDW: 473.8511  1,4 VDW: 411.2260 Total: 2532.1121  7Warning: the Pi SCF computation has failed to converge. s Iteration 156: Minimization terminated normally because the gradient norm is less than the minimum gradient norm  Stretch: 1.6336  Bend: 8.0670   Stretch-Bend: -0.0275  Torsion: 18.3125  Non-1,4 VDW: -2.1235  1,4 VDW: 12.2172  Dipole/Dipole: -7.3110 Total: 30.7684 3Warning: Some parameters are guessed (Quality = 1).  Stretch: 1.6335  Bend: 8.0672  Stretch-Bend: -0.0284  Torsion: 18.3307  Non-1,4 VDW: -2.1236  1,4 VDW: 12.2173  Dipole/Dipole: -7.3110 Total: 30.7857 s Iteration 1: Minimization terminated normally because the gradient norm is less than the minimum gradient norm  Stretch: 1.6353  Bend: 8.0645  Stretch-Bend: -0.0279 ! ! Torsion: 18.3173!" " Non-1,4 VDW: -2.1235"# # 1,4 VDW: 12.2174#$ $ Dipole/Dipole: -7.3112$% %Total: 30.7719%& &%d,1wdnbpDNIW(~dnbtDNIWVTMpDNIWllunGSMc