Please enable JavaScript in order to use this website.
Printed from https://www.webqc.org
Molecular format converter
molconverter_prompt
입력 형식 분자
3 water molecule (example of xyz input) O 0 0 0 H 0 0 1 H 0 1 0
입력 파일 형식
alc -- Alchemy format
bgf -- MSI BGF format
box -- Dock 3.5 Box format
bs -- Ball and Stick format
c3d1 -- Chem3D Cartesian 1 format
c3d2 -- Chem3D Cartesian 2 format
caccrt -- Cacao Cartesian format
car -- Accelrys/MSI Biosym/Insight II CAR format
ccc -- CCC format
crk2d -- Chemical Resource Kit diagram format (2D)
crk3d -- Chemical Resource Kit 3D format
ct -- ChemDraw Connection Table format
dmol -- DMol3 coordinates format
ent -- Protein Data Bank format
feat -- Feature format
fract -- Free Form Fractional format
fs -- FastSearching
g03 -- Gaussian98/03 Output
g98 -- Gaussian98/03 Output
gam -- GAMESS Output
gamout -- GAMESS Output
gpr -- Ghemical format
hin -- HyperChem HIN format
ins -- ShelX format
jout -- Jaguar output format
mdl -- MDL MOL format
mmd -- MacroModel format
mmod -- MacroModel format
mol -- MDL MOL format
mol2 -- Sybyl Mol2 format
mopcrt -- MOPAC Cartesian format
mopout -- MOPAC Output format
mpqc -- MPQC output format
nwo -- NWChem output format
pc -- PubChem format
pcm -- PCModel Format
pdb -- Protein Data Bank format
pqs -- Parallel Quantum Solutions format
prep -- Amber Prep format
qcout -- Q-Chem output format
res -- ShelX format
rxn -- MDL RXN format
sd -- MDL MOL format
sdf -- MDL MOL format
smi -- SMILES format
tmol -- TurboMole Coordinate format
unixyz -- UniChem XYZ format
vmol -- ViewMol format
xml -- General XML format
xyz -- XYZ cartesian coordinates format
출력 파일 형식
alc -- Alchemy format
bgf -- MSI BGF format
box -- Dock 3.5 Box format
bs -- Ball and Stick format
c3d1 -- Chem3D Cartesian 1 format
c3d2 -- Chem3D Cartesian 2 format
caccrt -- Cacao Cartesian format
cache -- CAChe MolStruct format
cacint -- Cacao Internal format
cht -- Chemtool format
com -- Gaussian 98/03 Cartesian Input
crk2d -- Chemical Resource Kit diagram format (2D)
crk3d -- Chemical Resource Kit 3D format
cssr -- CSD CSSR format
ct -- ChemDraw Connection Table format
dmol -- DMol3 coordinates format
ent -- Protein Data Bank format
feat -- Feature format
fh -- Fenske-Hall Z-Matrix format
fix -- SMILES FIX format
fpt -- Fingerecho format
fract -- Free Form Fractional format
gamin -- GAMESS Input
gau -- Gaussian 98/03 Cartesian Input
gpr -- Ghemical format
gr96 -- GROMOS96 format
hin -- HyperChem HIN format
inchi -- InChI format
inp -- GAMESS Input
jin -- Jaguar input format
k -- Compares first molecule to others using InChI.
mdl -- MDL MOL format
mmd -- MacroModel format
mmod -- MacroModel format
mol -- MDL MOL format
mol2 -- Sybyl Mol2 format
mopcrt -- MOPAC Cartesian format
mpd -- Sybyl descriptor format
mpqcin -- MPQC simplified input format
nw -- NWChem input format
pcm -- PCModel Format
pdb -- Protein Data Bank format
pov -- POV-Ray input format
pqs -- Parallel Quantum Solutions format
qcin -- Q-Chem input format
report -- Open Babel report format
rxn -- MDL RXN format
sd -- MDL MOL format
sdf -- MDL MOL format
smi -- SMILES format
tmol -- TurboMole Coordinate format
txyz -- Tinker MM2 format
unixyz -- UniChem XYZ format
vmol -- ViewMol format
xed -- XED format
xyz -- XYZ cartesian coordinates format
zin -- ZINDO input format
센터 위치
수소를 추가
수소 삭제
저희 화학반응식 계산기에 만족하셨다면 만족도 평가를 남겨주세요
화학 도구
기체 법칙
단위 변환기
주기율표
화학 포럼
상수
대칭성
기여
문의처
언어를 선택하세요
Deutsch
English
Español
Français
Italiano
Nederlands
Polski
Português
Русский
中文
日本語
한국어
인용법
메뉴
계수 맞추기
몰 질량
기체 법칙
단위
화학 도구
주기율표
화학 포럼
대칭성
상수
기여
문의처
인용법
언어를 선택하세요
Deutsch
English
Español
Français
Italiano
Nederlands
Polski
Português
Русский
中文
日本語
한국어
