diff CADDSuite-1.0.1/data/atomtyping/SYBYLTypes.dat @ 5:e30a41af9d2b

Uploaded

--- /dev/null	Thu Jan 01 00:00:00 1970 +0000
+++ b/CADDSuite-1.0.1/data/atomtyping/SYBYLTypes.dat	Tue Nov 15 10:53:16 2011 -0500
@@ -0,0 +1,66 @@
+C.3	6	4	*	*	*	*
+C.cat	6	3	*	*	*	(N3,N3,N3)
+C.ar	6	3	*	*	[AR1]	*
+C.2	6	3	*	*	*	*
+C.1	6	2	*	*	*	*
+C.1	6	1	*	*	*	*
+H	1	-1	*	*	*	*
+F	9	-1	*	*	*	*
+Cl	17	-1	*	*	*	*
+Br	35	-1	*	*	*	*
+I	53	-1	*	*	*	*
+P.3	15	-1	*	*	*	*
+N.4	7	4	*	*	*	*
+N.am	7	3	*	*	*	(C3(XA1))
+N.pl3	7	3	*	*	*	(O1,O1)
+N.pl3	7	3	*	*	[AR1.AR2.AR3]	*
+N.3	7	3	*	*	*	*
+N.ar	7	2	*	*	[AR1]	*
+N.2	7	2	*	*	*	*
+N.1	7	1	*	*	*	*
+O.co2	8	1	*	*	*	(C3(O1))
+O.co2	8	1	*	*	*	(P(O1))
+O.2	8	1	*	*	*	*
+O.3	8	2	*	*	*	*
+S.2	16	1	*	*	*	*
+S.3	16	2	*	*	*	*
+S.o	16	3	*	*	*	(O1[DB'])
+S.o2	16	4	*	*	*	(O1[DB'],O1[DB'])
+s.3	16	-1	*	*	*	*
+Li	3	-1	*	*	*	*
+Be	4	-1	*	*	*	*
+B	5	-1	*	*	*	*
+Na	11	-1	*	*	*	*
+Mg	12	-1	*	*	*	*
+Al	13	-1	*	*	*	*
+Si	14	-1	*	*	*	*
+K	19	-1	*	*	*	*
+Ca	20	-1	*	*	*	*
+Sr	38	-1	*	*	*	*
+Ba	56	-1	*	*	*	*
+Sc	21	-1	*	*	*	*
+Ti	22	-1	*	*	*	*
+V	23	-1	*	*	*	*
+Cr	24	-1	*	*	*	*
+Mn	25	-1	*	*	*	*
+Fe	26	-1	*	*	*	*
+Co	27	-1	*	*	*	*
+Ni	28	-1	*	*	*	*
+Cu	29	-1	*	*	*	*
+Zn	30	-1	*	*	*	*
+Ga	31	-1	*	*	*	*
+Ge	32	-1	*	*	*	*
+As	33	-1	*	*	*	*
+Se	34	-1	*	*	*	*
+Ru	44	-1	*	*	*	*
+Rh	45	-1	*	*	*	*
+Pd	46	-1	*	*	*	*
+Ag	47	-1	*	*	*	*
+Cd	48	-1	*	*	*	*
+Pt	78	-1	*	*	*	*
+Au	79	-1	*	*	*	*
+Hg	80	-1	*	*	*	*
+Tl	81	-1	*	*	*	*
+Pb	82	-1	*	*	*	*
+lp	0	1	*	*	*	*
+ANY	-1	-1	*	*	*	*	*