All data included in UNIV.tem file is stored in Data directory.
#TemplateFF UNIV 1.0
; ***************************** ; **** VEGA Template V3.0 **** ; **** UNIV atom types **** ; ******************************
; NOTE: ; This template is especially designed for Gasteiger-Marsili charge template and ; can't be renamed or removed. It's based on MENG atom type definitions.
; Description: ; ~~~~~~~~~~~~ ; General atom type - Bond order - Ring indicator - Aromatic indicator
; General atom types: Bond order: ; ~~~~~~~~~~~~~~~~~~~ ~~~~~~~~~~~ ; X = Any atom 0 = Atom not bonded ; # = Heavy atom 1-6 = Bond order ; - = None 9 = Any bond order
; Ring Indicator: Aromatic Indicator: ; ~~~~~~~~~~~~~~~ ~~~~~~~~~~~~~~~~~~~ ; 0 = Don't check ring 0 = Don't check ; 3...6 = From 3 to 6 member ring 1 = Aromatic ; 9 = Generic ring
; Type Atm Bonded Atoms ; ======================================================================== H H-100
C3 C-400 C+ C-300 (N-300 N-300 N-300) C+ C-300 (N-300 N-300 C-900) C2 C-300 C1 C-200
N3+ N-400 NP+ N-391 N3 N-300 N2 N-200 N1 N-100
O- O-200 (C-300 Zn900) O3 O-200 O- O-100 (C-300 (O-100 O-100)) OP= O-100 (P-400 (O-100 O-100 O-100)) O2 O-100
S- S-200 (C-400 Zn900) S3 S-200 S- S-100 (C-400) P= P-400 (O-100 O-100 O-100) P P-900
F F-900 Cl Cl900 Br Br900 I I-900
Na Na900 K K-900 Ca Ca900 Mg Mg900 Mn Mn900 Co Co900 Fe Fe900 Zn Zn900
Du X-900