SCSD model generated from precomputed using D3h symmetry, available as subporphyrin
Table 1; Model atom positions
x | y | z |
2.102 | 1.1605 | -0.0 |
3.4535 | 0.6902 | -0.0 |
3.4535 | -0.6902 | -0.0 |
2.102 | -1.1605 | -0.0 |
1.3862 | -2.4009 | -0.0 |
-0.046 | -2.4007 | -0.0 |
-1.1291 | -3.3359 | -0.0 |
-2.3245 | -2.6458 | 0.0 |
-2.056 | -1.2402 | 0.0 |
-2.7723 | 0.0 | 0.0 |
-2.056 | 1.2402 | 0.0 |
-2.3245 | 2.6458 | 0.0 |
-1.1291 | 3.3359 | 0.0 |
-0.046 | 2.4007 | 0.0 |
1.3862 | 2.4009 | -0.0 |
1.3697 | 0.0 | -0.0 |
-0.6848 | -1.1862 | 0.0 |
-0.6848 | 1.1862 | 0.0 |
Figure 2; Model atom positions and symmetry operations
AKOREZ, AVUCAW, AXEQIE, AXEQOK, AXEQUQ, AXERAX, BACSUW, BONJOE, CEYPAZ, DONMOK, EFELUX, EFEMAE, ENAFIK, ENAFOQ, ENAFUW, ENAGAD, ENAGEH, FUPFIH, FUPSOA, FUPSUG, GUFWUA, GUFXAH, GUFXEL, GUFXIP, HIFQEV, HIFQIZ, HIFQOF, HUJFUQ, HUJGAX, HUJGEB, IQUQUH, IQURAO, IWOVAT, IWOVEX, JOTGEG, JOTMIQ, JOTMOW, JOTTET, JOTTIX, JOTTOD, JOTTUJ, JOTVAR, JUKWIY, JUKWOE, JUKWUK, JUKXAR, JUKXEV, JUKXIZ, JUKXOF, KEBZEY, KEBZIC, KEBZOI, KEBZUO, KECBAX, KECBEB, KECBIF, KECBOL, KECBUR, KIGTIE, LIHSUR, LOCPOJ, LUMFOP, MAJROH, MAJRUN, MAJSAU, MAJSEY, MAJSIC, MAJSOI, MISFEC, MISFIG, MISFOM, MISFUS, MISGAZ, MISGED, MISGIH, MISGON, MIVPIT, MIVPOZ, MIVPUF, MIVQAM, MIVQEQ, MUKMEN, MUKMOX, NEDQOF, NEDQUL, NEFYUU, NEFZAB, NEFZEF, NEFZIJ, NIHJUK, NULLAK, NULLEO, NULLIS, NULLOY, ODUVOA, ODUVUG, ODUWAN, ODUWER, ONIYUG, OSASUY, OSATAF, OVATEM, OVATIQ, POKPIQ, POKPOW, POKPUC, POKQAJ, POKQEN, POKQIR, POQPAN, POQSIZ, POQSOF, POQSUL, POQTAS, QOKQIR, QOKQOX, QONBIF, QONBOL, QONBUR, QONCAY, QUGRAN, QUGRUH, QUSQEC, QUSWUY, RASYIW, RASYOC, RASYUI, RIBJOD, RIBMUM, RIBNAT, RIBNEX, ROCCUK, ROCDAR, ROYDUG, ROYFAO, ROYFES, ROYFIW, ROYFOC, SETVIY, SUBGUT, SUBHAA, SUHWIC, SUHWUO, TILDUP, TILFAX, TILFEB, TILFIF, TILFOL, TILFUR, UCOHAY, UCOHEC, UCOHIG, UCOHOM, UCOHUS, UKOPER, UKOPIV, UKOPOB, UKOPUH, UKOQAO, UKOQES, UKOQIW, UKOQOC, UMUNEX, UMUNIB, UMUNOH, UMUNUN, UMUPAV, UMUPEZ, UPIQUG, UPIRAN, UPIRER, UPIRIV, XEGMED, XEGMIH, XEGMON, XEMCIC, XIFBEU, XIFBIY, XIFBOE, XIFBUK, XIFCAR, XIFCEV, YEZQUS, YEZRAZ, YIQLAN, YIYJAS, YUKMAT, ZUWHEG, ZUWHIK