Unused files

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Showing below up to 50 results in range #4,351 to #4,400.

Frozents.mol ; 2 KB
Anti opt 1 jmol.mol ; 2 KB
Gauche opt 1 jmol.mol ; 2 KB
Chair conf opt 1.chk ; 1,000 KB
Allyl Chair conf opt freq 3.chk ; 924 KB
QST2 1.chk ; 1 MB
Irc chairtom.jpg 555 × 471; 15 KB
Labelled boat TS molecules.jpg 819 × 1,650; 64 KB
QST2 2.chk ; 1 MB
THDiels alder vib.bmp 768 × 380; 855 KB
Exo ts geom.GIF 527 × 495; 19 KB
Allyl Chair conf IRC 1.chk ; 2.7 MB
Allyl Chair conf IRC 1 opt.gjf ; 1 KB
YtkEndovib.JPG 457 × 443; 14 KB
1ts.jpg 705 × 564; 30 KB
Reopt activation energy chair conf 3.chk ; 1.34 MB
REOPT ACTIVATION ENERGY BOAT CONF 4.chk ; 1.53 MB
Jlphysdastereoscheme.jpg 574 × 697; 22 KB
Ts chair side.tif 2,559 × 1,104; 633 KB
IRC part 2.jpg 1,267 × 706; 111 KB
IRC INPUT.jpg 1,257 × 718; 110 KB
BasicDA TS.mol ; 2 KB
Maleic reactionscheme.gif 615 × 320; 9 KB
Endofinallumo.jpg 750 × 744; 57 KB
Endofinalhumo.jpg 750 × 744; 57 KB
YtkSecondary orbital.JPG 452 × 292; 12 KB
Cis butadiene opt 1.chk ; 984 KB
EXO LUMO (2).jpg 2,877 × 1,500; 203 KB
HOMO- endo side.JPG 522 × 405; 18 KB
HOMO- exo side.JPG 506 × 438; 19 KB
HOMO- endo top.JPG 547 × 440; 23 KB
HOMO- exo top.JPG 462 × 433; 21 KB
LUMO- endo side.JPG 469 × 423; 16 KB
LUMO- exo side.JPG 547 × 419; 21 KB
LUMO- endo top.JPG 538 × 441; 20 KB
LUMO- exo top.JPG 493 × 452; 24 KB
Jlphys28.jpg 528 × 521; 49 KB
Endo bond strain.jpg 504 × 401; 13 KB
Endo bond strainf.jpg 515 × 377; 22 KB
Exo bond strain.jpg 459 × 247; 12 KB
Cycloaddition.jpg 2,496 × 1,413; 156 KB
Transiton state.jpg 1,272 × 927; 61 KB
Boatjmole.mol ; 2 KB
Endo TS3.gif 498 × 480; 31 KB
Endo imaginary freq.gif 711 × 586; 675 KB
Cycloaddition opt freq 1.chk ; 1.48 MB
Exo imaginary freq.gif 711 × 586; 779 KB
Bo Anti1.mol ; 2 KB
Tsberny section3 jmol.mol ; 2 KB
Bo Anti2.mol ; 2 KB