Run as: ionizer -i 2 -ph 7 -s /raid1/people/joha/PETC/PYTHON/DB/ionizer_tiSHO_exclude.ini -i b9.4_thio_parts_connect_2_ln_corina.mae -l b9.5_thio_parts_connect_2_ln_corina_ionizer.log -b b9.5_thio_parts_connect_2_ln_corina_ionizer_bad.mae -o b9.5_thio_parts_connect_2_ln_corina_ionizer.mae

Ionizable group spec file used:
/raid1/people/joha/PETC/PYTHON/DB/ionizer_tiSHO_exclude.ini

Treating input CT 1 "C14322_1p0_i001_c001"
  Total candidate ionization centers: 1
  Maximum possible ionization states: 2 (unrestricted)
  Proceeding with expansion....
  Expanded to 2 output CTs (after restrictions imposed)
Finished input CT 1 "C14322_1p0_i001_c001"

Treating input CT 2 "C14322_2p0_i001_c001"
  Total candidate ionization centers: 1
  Maximum possible ionization states: 2 (unrestricted)
  Proceeding with expansion....
  Expanded to 2 output CTs (after restrictions imposed)
Finished input CT 2 "C14322_2p0_i001_c001"

Treating input CT 3 "C14322_3p0_i001_c001"
  Total candidate ionization centers: 1
  Maximum possible ionization states: 2 (unrestricted)
  Proceeding with expansion....
  Expanded to 2 output CTs (after restrictions imposed)
Finished input CT 3 "C14322_3p0_i001_c001"

Treating input CT 4 "C11018_2p0_i001_c001"
  Total candidate ionization centers: 0
  Maximum possible ionization states: 1 (unrestricted)
  Proceeding with expansion....
  Expanded to 1 output CT (after restrictions imposed)
Finished input CT 4 "C11018_2p0_i001_c001"

Treating input CT 5 "C11018_3p0_i001_c001"
  Total candidate ionization centers: 0
  Maximum possible ionization states: 1 (unrestricted)
  Proceeding with expansion....
  Expanded to 1 output CT (after restrictions imposed)
Finished input CT 5 "C11018_3p0_i001_c001"

Treating input CT 6 "C11018_4p0_i001_c001"
  Total candidate ionization centers: 0
  Maximum possible ionization states: 1 (unrestricted)
  Proceeding with expansion....
  Expanded to 1 output CT (after restrictions imposed)
Finished input CT 6 "C11018_4p0_i001_c001"

Treating input CT 7 "C14431_2p0_i001_c001"
  Total candidate ionization centers: 0
  Maximum possible ionization states: 1 (unrestricted)
  Proceeding with expansion....
  Expanded to 1 output CT (after restrictions imposed)
Finished input CT 7 "C14431_2p0_i001_c001"

Treating input CT 8 "C14431_3p0_i001_c001"
  Total candidate ionization centers: 0
  Maximum possible ionization states: 1 (unrestricted)
  Proceeding with expansion....
  Expanded to 1 output CT (after restrictions imposed)
Finished input CT 8 "C14431_3p0_i001_c001"

Treating input CT 9 "C14431_4p0_i001_c001"
  Total candidate ionization centers: 0
  Maximum possible ionization states: 1 (unrestricted)
  Proceeding with expansion....
  Expanded to 1 output CT (after restrictions imposed)
Finished input CT 9 "C14431_4p0_i001_c001"

Treating input CT 10 "C04380_2p0_i001_c001"
  Total candidate ionization centers: 3
  Maximum possible ionization states: 8 (unrestricted)
  Proceeding with expansion....
  Expanded to 2 output CTs (after restrictions imposed)
Finished input CT 10 "C04380_2p0_i001_c001"

Treating input CT 11 "C04380_2p0_i001_c002"
  Total candidate ionization centers: 3
  Maximum possible ionization states: 8 (unrestricted)
  Proceeding with expansion....
  Expanded to 2 output CTs (after restrictions imposed)
Finished input CT 11 "C04380_2p0_i001_c002"

Treating input CT 12 "C04380_2p0_i001_c003"
  Total candidate ionization centers: 3
  Maximum possible ionization states: 8 (unrestricted)
  Proceeding with expansion....
  Expanded to 2 output CTs (after restrictions imposed)
Finished input CT 12 "C04380_2p0_i001_c003"

Treating input CT 13 "C04380_2p0_i001_c004"
  Total candidate ionization centers: 3
  Maximum possible ionization states: 8 (unrestricted)
  Proceeding with expansion....
  Expanded to 2 output CTs (after restrictions imposed)
Finished input CT 13 "C04380_2p0_i001_c004"

Treating input CT 14 "C04380_2p0_i001_c005"
  Total candidate ionization centers: 3
  Maximum possible ionization states: 8 (unrestricted)
  Proceeding with expansion....
  Expanded to 2 output CTs (after restrictions imposed)
Finished input CT 14 "C04380_2p0_i001_c005"

Treating input CT 15 "C04380_2p0_i001_c006"
  Total candidate ionization centers: 3
  Maximum possible ionization states: 8 (unrestricted)
  Proceeding with expansion....
  Expanded to 2 output CTs (after restrictions imposed)
Finished input CT 15 "C04380_2p0_i001_c006"

Treating input CT 16 "C04380_2p0_i001_c007"
  Total candidate ionization centers: 3
  Maximum possible ionization states: 8 (unrestricted)
  Proceeding with expansion....
  Expanded to 2 output CTs (after restrictions imposed)
Finished input CT 16 "C04380_2p0_i001_c007"

Treating input CT 17 "C14442_1p0_i001_c001"
  Total candidate ionization centers: 0
  Maximum possible ionization states: 1 (unrestricted)
  Proceeding with expansion....
  Expanded to 1 output CT (after restrictions imposed)
Finished input CT 17 "C14442_1p0_i001_c001"

Treating input CT 18 "C14442_2p0_i001_c001"
  Total candidate ionization centers: 0
  Maximum possible ionization states: 1 (unrestricted)
  Proceeding with expansion....
  Expanded to 1 output CT (after restrictions imposed)
Finished input CT 18 "C14442_2p0_i001_c001"

Treating input CT 19 "C14434_1p0_i001_c001"
  Total candidate ionization centers: 0
  Maximum possible ionization states: 1 (unrestricted)
  Proceeding with expansion....
  Expanded to 1 output CT (after restrictions imposed)
Finished input CT 19 "C14434_1p0_i001_c001"

Treating input CT 20 "C14434_2p0_i001_c001"
  Total candidate ionization centers: 0
  Maximum possible ionization states: 1 (unrestricted)
  Proceeding with expansion....
  Expanded to 1 output CT (after restrictions imposed)
Finished input CT 20 "C14434_2p0_i001_c001"

Treating input CT 21 "C14520_1p0_i001_c001"
  Total candidate ionization centers: 1
  Maximum possible ionization states: 2 (unrestricted)
  Proceeding with expansion....
  Expanded to 2 output CTs (after restrictions imposed)
Finished input CT 21 "C14520_1p0_i001_c001"

Treating input CT 22 "C14520_2p0_i001_c001"
  Total candidate ionization centers: 1
  Maximum possible ionization states: 2 (unrestricted)
  Proceeding with expansion....
  Expanded to 2 output CTs (after restrictions imposed)
Finished input CT 22 "C14520_2p0_i001_c001"

Treating input CT 23 "C11022_1p0_i001_c001"
  Total candidate ionization centers: 0
  Maximum possible ionization states: 1 (unrestricted)
  Proceeding with expansion....
  Expanded to 1 output CT (after restrictions imposed)
Finished input CT 23 "C11022_1p0_i001_c001"

Treating input CT 24 "C11022_2p0_i001_c001"
  Total candidate ionization centers: 0
  Maximum possible ionization states: 1 (unrestricted)
  Proceeding with expansion....
  Expanded to 1 output CT (after restrictions imposed)
Finished input CT 24 "C11022_2p0_i001_c001"

Treating input CT 25 "C14434_3p0_i001_c001"
  Total candidate ionization centers: 0
  Maximum possible ionization states: 1 (unrestricted)
  Proceeding with expansion....
  Expanded to 1 output CT (after restrictions imposed)
Finished input CT 25 "C14434_3p0_i001_c001"

Treating input CT 26 "C14434_4p0_i001_c001"
  Total candidate ionization centers: 0
  Maximum possible ionization states: 1 (unrestricted)
  Proceeding with expansion....
  Expanded to 1 output CT (after restrictions imposed)
Finished input CT 26 "C14434_4p0_i001_c001"

Treating input CT 27 "C14580_1p0_i001_c001"
  Total candidate ionization centers: 0
  Maximum possible ionization states: 1 (unrestricted)
  Proceeding with expansion....
  Expanded to 1 output CT (after restrictions imposed)
Finished input CT 27 "C14580_1p0_i001_c001"

Treating input CT 28 "C11002_2p0_i001_c001"
  Total candidate ionization centers: 0
  Maximum possible ionization states: 1 (unrestricted)
  Proceeding with expansion....
  Expanded to 1 output CT (after restrictions imposed)
Finished input CT 28 "C11002_2p0_i001_c001"

Treating input CT 29 "C11002_3p0_i001_c001"
  Total candidate ionization centers: 0
  Maximum possible ionization states: 1 (unrestricted)
  Proceeding with expansion....
  Expanded to 1 output CT (after restrictions imposed)
Finished input CT 29 "C11002_3p0_i001_c001"

Treating input CT 30 "C07641_1p0_i001_c001"
  Total candidate ionization centers: 0
  Maximum possible ionization states: 1 (unrestricted)
  Proceeding with expansion....
  Expanded to 1 output CT (after restrictions imposed)
Finished input CT 30 "C07641_1p0_i001_c001"

Treating input CT 31 "C14580_2p0_i001_c001"
  Total candidate ionization centers: 0
  Maximum possible ionization states: 1 (unrestricted)
  Proceeding with expansion....
  Expanded to 1 output CT (after restrictions imposed)
Finished input CT 31 "C14580_2p0_i001_c001"

Treating input CT 32 "C14580_3p0_i001_c001"
  Total candidate ionization centers: 0
  Maximum possible ionization states: 1 (unrestricted)
  Proceeding with expansion....
  Expanded to 1 output CT (after restrictions imposed)
Finished input CT 32 "C14580_3p0_i001_c001"

Treating input CT 33 "C11022_3p0_i001_c001"
  Total candidate ionization centers: 0
  Maximum possible ionization states: 1 (unrestricted)
  Proceeding with expansion....
  Expanded to 1 output CT (after restrictions imposed)
Finished input CT 33 "C11022_3p0_i001_c001"

Treating input CT 34 "C11022_4p0_i001_c001"
  Total candidate ionization centers: 0
  Maximum possible ionization states: 1 (unrestricted)
  Proceeding with expansion....
  Expanded to 1 output CT (after restrictions imposed)
Finished input CT 34 "C11022_4p0_i001_c001"

Treating input CT 35 "C11023_1p0_i001_c001"
  Total candidate ionization centers: 0
  Maximum possible ionization states: 1 (unrestricted)
  Proceeding with expansion....
  Expanded to 1 output CT (after restrictions imposed)
Finished input CT 35 "C11023_1p0_i001_c001"

Treating input CT 36 "C11023_2p0_i001_c001"
  Total candidate ionization centers: 0
  Maximum possible ionization states: 1 (unrestricted)
  Proceeding with expansion....
  Expanded to 1 output CT (after restrictions imposed)
Finished input CT 36 "C11023_2p0_i001_c001"

Treating input CT 37 "C07497_3p0_i001_c001"
  Total candidate ionization centers: 0
  Maximum possible ionization states: 1 (unrestricted)
  Proceeding with expansion....
  Expanded to 1 output CT (after restrictions imposed)
Finished input CT 37 "C07497_3p0_i001_c001"

Treating input CT 38 "C07497_4p0_i001_c001"
  Total candidate ionization centers: 0
  Maximum possible ionization states: 1 (unrestricted)
  Proceeding with expansion....
  Expanded to 1 output CT (after restrictions imposed)
Finished input CT 38 "C07497_4p0_i001_c001"

Treating input CT 39 "C07497_5p0_i001_c001"
  Total candidate ionization centers: 0
  Maximum possible ionization states: 1 (unrestricted)
  Proceeding with expansion....
  Expanded to 1 output CT (after restrictions imposed)
Finished input CT 39 "C07497_5p0_i001_c001"

Treating input CT 40 "C11023_3p0_i001_c001"
  Total candidate ionization centers: 0
  Maximum possible ionization states: 1 (unrestricted)
  Proceeding with expansion....
  Expanded to 1 output CT (after restrictions imposed)
Finished input CT 40 "C11023_3p0_i001_c001"

Treating input CT 41 "C11023_4p0_i001_c001"
  Total candidate ionization centers: 0
  Maximum possible ionization states: 1 (unrestricted)
  Proceeding with expansion....
  Expanded to 1 output CT (after restrictions imposed)
Finished input CT 41 "C11023_4p0_i001_c001"

Treating input CT 42 "C14442_3p0_i001_c001"
  Total candidate ionization centers: 0
  Maximum possible ionization states: 1 (unrestricted)
  Proceeding with expansion....
  Expanded to 1 output CT (after restrictions imposed)
Finished input CT 42 "C14442_3p0_i001_c001"

Treating input CT 43 "C06607_1p0_i001_c001"
  Total candidate ionization centers: 0
  Maximum possible ionization states: 1 (unrestricted)
  Proceeding with expansion....
  Expanded to 1 output CT (after restrictions imposed)
Finished input CT 43 "C06607_1p0_i001_c001"

Treating input CT 44 "C11002_4p0_i001_c001"
  Total candidate ionization centers: 0
  Maximum possible ionization states: 1 (unrestricted)
  Proceeding with expansion....
  Expanded to 1 output CT (after restrictions imposed)
Finished input CT 44 "C11002_4p0_i001_c001"

Treating input CT 45 "C11002_5p0_i001_c001"
  Total candidate ionization centers: 0
  Maximum possible ionization states: 1 (unrestricted)
  Proceeding with expansion....
  Expanded to 1 output CT (after restrictions imposed)
Finished input CT 45 "C11002_5p0_i001_c001"

Treating input CT 46 "C14420_1p0_i001_c001"
  Total candidate ionization centers: 0
  Maximum possible ionization states: 1 (unrestricted)
  Proceeding with expansion....
  Expanded to 1 output CT (after restrictions imposed)
Finished input CT 46 "C14420_1p0_i001_c001"

Treating input CT 47 "C14520_3p0_i001_c001"
  Total candidate ionization centers: 1
  Maximum possible ionization states: 2 (unrestricted)
  Proceeding with expansion....
  Expanded to 2 output CTs (after restrictions imposed)
Finished input CT 47 "C14520_3p0_i001_c001"

Treating input CT 48 "C14420_2p0_i001_c001"
  Total candidate ionization centers: 0
  Maximum possible ionization states: 1 (unrestricted)
  Proceeding with expansion....
  Expanded to 1 output CT (after restrictions imposed)
Finished input CT 48 "C14420_2p0_i001_c001"

Treating input CT 49 "C14420_3p0_i001_c001"
  Total candidate ionization centers: 0
  Maximum possible ionization states: 1 (unrestricted)
  Proceeding with expansion....
  Expanded to 1 output CT (after restrictions imposed)
Finished input CT 49 "C14420_3p0_i001_c001"

Treating input CT 50 "C14429_2p0_i001_c001"
  Total candidate ionization centers: 0
  Maximum possible ionization states: 1 (unrestricted)
  Proceeding with expansion....
  Expanded to 1 output CT (after restrictions imposed)
Finished input CT 50 "C14429_2p0_i001_c001"

Treating input CT 51 "C14429_3p0_i001_c001"
  Total candidate ionization centers: 0
  Maximum possible ionization states: 1 (unrestricted)
  Proceeding with expansion....
  Expanded to 1 output CT (after restrictions imposed)
Finished input CT 51 "C14429_3p0_i001_c001"

Treating input CT 52 "C14429_4p0_i001_c001"
  Total candidate ionization centers: 0
  Maximum possible ionization states: 1 (unrestricted)
  Proceeding with expansion....
  Expanded to 1 output CT (after restrictions imposed)
Finished input CT 52 "C14429_4p0_i001_c001"

Treating input CT 53 "C14326_2p0_i001_c001"
  Total candidate ionization centers: 0
  Maximum possible ionization states: 1 (unrestricted)
  Proceeding with expansion....
  Expanded to 1 output CT (after restrictions imposed)
Finished input CT 53 "C14326_2p0_i001_c001"

Treating input CT 54 "C14326_3p0_i001_c001"
  Total candidate ionization centers: 0
  Maximum possible ionization states: 1 (unrestricted)
  Proceeding with expansion....
  Expanded to 1 output CT (after restrictions imposed)
Finished input CT 54 "C14326_3p0_i001_c001"

Treating input CT 55 "C14326_4p0_i001_c001"
  Total candidate ionization centers: 0
  Maximum possible ionization states: 1 (unrestricted)
  Proceeding with expansion....
  Expanded to 1 output CT (after restrictions imposed)
Finished input CT 55 "C14326_4p0_i001_c001"

Treating input CT 56 "C11022_5p0_i001_c001"
  Total candidate ionization centers: 0
  Maximum possible ionization states: 1 (unrestricted)
  Proceeding with expansion....
  Expanded to 1 output CT (after restrictions imposed)
Finished input CT 56 "C11022_5p0_i001_c001"

Treating input CT 57 "C11022_6p0_i001_c001"
  Total candidate ionization centers: 0
  Maximum possible ionization states: 1 (unrestricted)
  Proceeding with expansion....
  Expanded to 1 output CT (after restrictions imposed)
Finished input CT 57 "C11022_6p0_i001_c001"

Treating input CT 58 "C14228_1p0_i001_c001"
  Total candidate ionization centers: 0
  Maximum possible ionization states: 1 (unrestricted)
  Proceeding with expansion....
  Expanded to 1 output CT (after restrictions imposed)
Finished input CT 58 "C14228_1p0_i001_c001"

Treating input CT 59 "C14228_2p0_i001_c001"
  Total candidate ionization centers: 0
  Maximum possible ionization states: 1 (unrestricted)
  Proceeding with expansion....
  Expanded to 1 output CT (after restrictions imposed)
Finished input CT 59 "C14228_2p0_i001_c001"

Treating input CT 60 "C14228_3p0_i001_c001"
  Total candidate ionization centers: 0
  Maximum possible ionization states: 1 (unrestricted)
  Proceeding with expansion....
  Expanded to 1 output CT (after restrictions imposed)
Finished input CT 60 "C14228_3p0_i001_c001"

Treating input CT 61 "C06604_1p0_i001_c001"
  Total candidate ionization centers: 0
  Maximum possible ionization states: 1 (unrestricted)
  Proceeding with expansion....
  Expanded to 1 output CT (after restrictions imposed)
Finished input CT 61 "C06604_1p0_i001_c001"

Treating input CT 62 "C11023_5p0_i001_c001"
  Total candidate ionization centers: 0
  Maximum possible ionization states: 1 (unrestricted)
  Proceeding with expansion....
  Expanded to 1 output CT (after restrictions imposed)
Finished input CT 62 "C11023_5p0_i001_c001"

Treating input CT 63 "C11023_6p0_i001_c001"
  Total candidate ionization centers: 0
  Maximum possible ionization states: 1 (unrestricted)
  Proceeding with expansion....
  Expanded to 1 output CT (after restrictions imposed)
Finished input CT 63 "C11023_6p0_i001_c001"

Treating input CT 64 "C06604_2p0_i001_c001"
  Total candidate ionization centers: 0
  Maximum possible ionization states: 1 (unrestricted)
  Proceeding with expansion....
  Expanded to 1 output CT (after restrictions imposed)
Finished input CT 64 "C06604_2p0_i001_c001"

Treating input CT 65 "C06604_3p0_i001_c001"
  Total candidate ionization centers: 0
  Maximum possible ionization states: 1 (unrestricted)
  Proceeding with expansion....
  Expanded to 1 output CT (after restrictions imposed)
Finished input CT 65 "C06604_3p0_i001_c001"

Treating input CT 66 "C14324_1p0_i001_c001"
  Total candidate ionization centers: 0
  Maximum possible ionization states: 1 (unrestricted)
  Proceeding with expansion....
  Expanded to 1 output CT (after restrictions imposed)
Finished input CT 66 "C14324_1p0_i001_c001"

Treating input CT 67 "C14324_2p0_i001_c001"
  Total candidate ionization centers: 0
  Maximum possible ionization states: 1 (unrestricted)
  Proceeding with expansion....
  Expanded to 1 output CT (after restrictions imposed)
Finished input CT 67 "C14324_2p0_i001_c001"

Treating input CT 68 "C14324_3p0_i001_c001"
  Total candidate ionization centers: 0
  Maximum possible ionization states: 1 (unrestricted)
  Proceeding with expansion....
  Expanded to 1 output CT (after restrictions imposed)
Finished input CT 68 "C14324_3p0_i001_c001"

Treating input CT 69 "C11030_1p0_i001_c001"
  Total candidate ionization centers: 0
  Maximum possible ionization states: 1 (unrestricted)
  Proceeding with expansion....
  Expanded to 1 output CT (after restrictions imposed)
Finished input CT 69 "C11030_1p0_i001_c001"

Treating input CT 70 "C11030_2p0_i001_c001"
  Total candidate ionization centers: 0
  Maximum possible ionization states: 1 (unrestricted)
  Proceeding with expansion....
  Expanded to 1 output CT (after restrictions imposed)
Finished input CT 70 "C11030_2p0_i001_c001"

Treating input CT 71 "C11030_3p0_i001_c001"
  Total candidate ionization centers: 0
  Maximum possible ionization states: 1 (unrestricted)
  Proceeding with expansion....
  Expanded to 1 output CT (after restrictions imposed)
Finished input CT 71 "C11030_3p0_i001_c001"

Treating input CT 72 "C11025_2p0_i001_c001"
  Total candidate ionization centers: 0
  Maximum possible ionization states: 1 (unrestricted)
  Proceeding with expansion....
  Expanded to 1 output CT (after restrictions imposed)
Finished input CT 72 "C11025_2p0_i001_c001"

Treating input CT 73 "C11025_3p0_i001_c001"
  Total candidate ionization centers: 0
  Maximum possible ionization states: 1 (unrestricted)
  Proceeding with expansion....
  Expanded to 1 output CT (after restrictions imposed)
Finished input CT 73 "C11025_3p0_i001_c001"

Treating input CT 74 "C11025_4p0_i001_c001"
  Total candidate ionization centers: 0
  Maximum possible ionization states: 1 (unrestricted)
  Proceeding with expansion....
  Expanded to 1 output CT (after restrictions imposed)
Finished input CT 74 "C11025_4p0_i001_c001"

Treating input CT 75 "C11028_2p0_i001_c001"
  Total candidate ionization centers: 0
  Maximum possible ionization states: 1 (unrestricted)
  Proceeding with expansion....
  Expanded to 1 output CT (after restrictions imposed)
Finished input CT 75 "C11028_2p0_i001_c001"

Treating input CT 76 "C11002_6p0_i001_c001"
  Total candidate ionization centers: 0
  Maximum possible ionization states: 1 (unrestricted)
  Proceeding with expansion....
  Expanded to 1 output CT (after restrictions imposed)
Finished input CT 76 "C11002_6p0_i001_c001"

Treating input CT 77 "C11002_7p0_i001_c001"
  Total candidate ionization centers: 0
  Maximum possible ionization states: 1 (unrestricted)
  Proceeding with expansion....
  Expanded to 1 output CT (after restrictions imposed)
Finished input CT 77 "C11002_7p0_i001_c001"

Treating input CT 78 "C11028_3p0_i001_c001"
  Total candidate ionization centers: 0
  Maximum possible ionization states: 1 (unrestricted)
  Proceeding with expansion....
  Expanded to 1 output CT (after restrictions imposed)
Finished input CT 78 "C11028_3p0_i001_c001"

Treating input CT 79 "C11028_4p0_i001_c001"
  Total candidate ionization centers: 0
  Maximum possible ionization states: 1 (unrestricted)
  Proceeding with expansion....
  Expanded to 1 output CT (after restrictions imposed)
Finished input CT 79 "C11028_4p0_i001_c001"

Treating input CT 80 "C14510_1p0_i001_c001"
  Total candidate ionization centers: 0
  Maximum possible ionization states: 1 (unrestricted)
  Proceeding with expansion....
  Expanded to 1 output CT (after restrictions imposed)
Finished input CT 80 "C14510_1p0_i001_c001"

Treating input CT 81 "C14510_2p0_i001_c001"
  Total candidate ionization centers: 0
  Maximum possible ionization states: 1 (unrestricted)
  Proceeding with expansion....
  Expanded to 1 output CT (after restrictions imposed)
Finished input CT 81 "C14510_2p0_i001_c001"

Treating input CT 82 "C14510_3p0_i001_c001"
  Total candidate ionization centers: 0
  Maximum possible ionization states: 1 (unrestricted)
  Proceeding with expansion....
  Expanded to 1 output CT (after restrictions imposed)
Finished input CT 82 "C14510_3p0_i001_c001"

Treating input CT 83 "C06605_1p0_i001_c001"
  Total candidate ionization centers: 1
  Maximum possible ionization states: 2 (unrestricted)
  Proceeding with expansion....
  Expanded to 1 output CT (after restrictions imposed)
Finished input CT 83 "C06605_1p0_i001_c001"

Treating input CT 84 "C06605_2p0_i001_c001"
  Total candidate ionization centers: 1
  Maximum possible ionization states: 2 (unrestricted)
  Proceeding with expansion....
  Expanded to 1 output CT (after restrictions imposed)
Finished input CT 84 "C06605_2p0_i001_c001"

Treating input CT 85 "C06605_3p0_i001_c001"
  Total candidate ionization centers: 1
  Maximum possible ionization states: 2 (unrestricted)
  Proceeding with expansion....
  Expanded to 1 output CT (after restrictions imposed)
Finished input CT 85 "C06605_3p0_i001_c001"

Treating input CT 86 "C01806_3p0_i001_c001"
  Total candidate ionization centers: 2
  Maximum possible ionization states: 4 (unrestricted)
  Proceeding with expansion....
  Expanded to 1 output CT (after restrictions imposed)
Finished input CT 86 "C01806_3p0_i001_c001"

Treating input CT 87 "C01806_3p0_i001_c002"
  Total candidate ionization centers: 2
  Maximum possible ionization states: 4 (unrestricted)
  Proceeding with expansion....
  Expanded to 1 output CT (after restrictions imposed)
Finished input CT 87 "C01806_3p0_i001_c002"

Treating input CT 88 "C01806_3p0_i001_c003"
  Total candidate ionization centers: 2
  Maximum possible ionization states: 4 (unrestricted)
  Proceeding with expansion....
  Expanded to 1 output CT (after restrictions imposed)
Finished input CT 88 "C01806_3p0_i001_c003"

Treating input CT 89 "C01806_3p0_i001_c004"
  Total candidate ionization centers: 2
  Maximum possible ionization states: 4 (unrestricted)
  Proceeding with expansion....
  Expanded to 1 output CT (after restrictions imposed)
Finished input CT 89 "C01806_3p0_i001_c004"

Treating input CT 90 "C01806_3p0_i001_c005"
  Total candidate ionization centers: 2
  Maximum possible ionization states: 4 (unrestricted)
  Proceeding with expansion....
  Expanded to 1 output CT (after restrictions imposed)
Finished input CT 90 "C01806_3p0_i001_c005"

Treating input CT 91 "C01806_3p0_i001_c006"
  Total candidate ionization centers: 2
  Maximum possible ionization states: 4 (unrestricted)
  Proceeding with expansion....
  Expanded to 1 output CT (after restrictions imposed)
Finished input CT 91 "C01806_3p0_i001_c006"

Treating input CT 92 "C01806_3p0_i001_c007"
  Total candidate ionization centers: 2
  Maximum possible ionization states: 4 (unrestricted)
  Proceeding with expansion....
  Expanded to 1 output CT (after restrictions imposed)
Finished input CT 92 "C01806_3p0_i001_c007"

Input structures treated: 92
Output structures written: 105
Size of output file "b9.5_thio_parts_connect_2_ln_corina_ionizer.mae" is 985856 bytes
Bad input structures skipped over: 0