TQN

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
CD3	CD2	sing	0.00Å	1.52Å
CD2	CD1	sing	0.00Å	1.52Å
CF8	CF7	sing	0.00Å	1.54Å
CD1	CC9	sing	0.00Å	1.51Å
CF7	CF6	sing	0.00Å	1.53Å
CE7	CE6	sing	0.00Å	1.53Å
CE6	CE5	sing	0.00Å	1.52Å
CC9	CC8	sing	0.00Å	1.52Å
CF6	CF5	sing	0.00Å	1.54Å
CE5	C69	sing	0.00Å	1.52Å
CC5	CC4	sing	0.00Å	1.52Å
CF5	CF4	sing	0.00Å	1.52Å
CC8	CC7	sing	0.00Å	1.53Å
C69	C68	sing	0.00Å	1.52Å
CC4	CC3	sing	0.00Å	1.52Å
CC7	CC6	sing	0.00Å	1.54Å
CF3	CF2	sing	0.00Å	1.53Å
CF4	C89	sing	0.00Å	1.53Å
C89	C88	sing	0.00Å	1.53Å
C68	C67	sing	0.00Å	1.51Å
CF2	CF1	sing	0.00Å	1.54Å
CC3	CC2	sing	0.00Å	1.53Å
CC6	C29	sing	0.00Å	1.55Å
C29	C28	sing	0.00Å	1.54Å
CC2	CC1	sing	0.00Å	1.53Å
C67	C66	sing	0.00Å	1.53Å
CD6	CD7	sing	0.00Å	1.52Å
CD6	CD5	sing	0.00Å	1.53Å
C88	C87	sing	0.00Å	1.53Å
CF1	CE9	sing	0.00Å	1.53Å
CD8	CD7	sing	0.00Å	1.52Å
C87	C86	sing	0.00Å	1.52Å
CE9	CE8	sing	0.00Å	1.53Å
C66	C65	sing	0.00Å	1.54Å
CC1	C19	sing	0.00Å	1.54Å
C28	C27	sing	0.00Å	1.54Å
C27	C26	sing	0.00Å	1.54Å
CD4	CD5	sing	0.00Å	1.52Å
CD4	C39	sing	0.00Å	1.53Å
CE4	CE3	sing	0.00Å	1.52Å
C38	C39	sing	0.00Å	1.53Å
C38	C37	sing	0.00Å	1.53Å
C19	C18	sing	0.00Å	1.53Å
C65	C64	sing	0.00Å	1.54Å
CE8	C79	sing	0.00Å	1.54Å
C26	C25	sing	0.00Å	1.54Å
C86	C85	sing	0.00Å	1.52Å
CE3	CE2	sing	0.00Å	1.51Å
C85	C84	sing	0.00Å	1.52Å
C37	C36	sing	0.00Å	1.54Å
C79	C78	sing	0.00Å	1.54Å
CE2	CE1	sing	0.00Å	1.52Å
C18	C17	sing	0.00Å	1.52Å
C64	C63	sing	0.00Å	1.56Å
C25	C24	sing	0.00Å	1.55Å
CE1	CD9	sing	0.00Å	1.53Å
C36	C35	sing	0.00Å	1.53Å
C17	C16	sing	0.00Å	1.53Å
C78	C77	sing	0.00Å	1.54Å
C63	C62	sing	0.00Å	1.56Å
C84	C83	sing	0.00Å	1.52Å
C24	C23	sing	0.00Å	1.55Å
CD9	C59	sing	0.00Å	1.53Å
C83	C82	sing	0.00Å	1.52Å
C77	C76	sing	0.00Å	1.55Å
C35	C34	sing	0.00Å	1.52Å
C16	C15	sing	0.00Å	1.52Å
C62	C61	sing	0.00Å	1.56Å
C59	C58	sing	0.00Å	1.55Å
C23	C22	sing	0.00Å	1.55Å
C82	C81	sing	0.00Å	1.53Å
C34	C33	sing	0.00Å	1.52Å
C15	C14	sing	0.00Å	1.54Å
C76	C75	sing	0.00Å	1.54Å
C58	C57	sing	0.00Å	1.54Å
O61	C61	doub	0.00Å	1.18Å
C61	O53	sing	0.00Å	1.44Å
C22	C21	sing	0.00Å	1.56Å
O13	C21	sing	0.00Å	1.42Å
O13	C13	sing	0.00Å	1.41Å
O81	C81	doub	0.00Å	1.19Å
C21	O21	doub	0.00Å	1.18Å
C75	C74	sing	0.00Å	1.54Å
C81	O73	sing	0.00Å	1.41Å
C57	C56	sing	0.00Å	1.55Å
C33	C32	sing	0.00Å	1.53Å
C33	O33	sing	0.00Å	1.40Å
C14	C13	sing	0.00Å	1.52Å
C32	C31	sing	0.00Å	1.52Å
C13	C12	sing	0.00Å	1.53Å
O53	C53	sing	0.00Å	1.39Å
C74	C73	sing	0.00Å	1.53Å
C55	C56	sing	0.00Å	1.55Å
C55	C54	sing	0.00Å	1.56Å
O73	C73	sing	0.00Å	1.38Å
C53	C54	sing	0.00Å	1.54Å
C53	C52	sing	0.00Å	1.55Å
C73	C72	sing	0.00Å	1.55Å
C12	C11	sing	0.00Å	1.59Å
C31	O31	doub	0.00Å	1.18Å
C31	OA3	sing	0.00Å	1.40Å
C52	C51	sing	0.00Å	1.56Å
O71	C71	doub	0.00Å	1.18Å
OA3	CA3	sing	0.00Å	1.40Å
C11	O11	doub	0.00Å	1.18Å
C11	NA2	sing	0.00Å	1.50Å
C72	C71	sing	0.00Å	1.56Å
C71	OB3	sing	0.00Å	1.44Å
NA2	CA2	sing	0.00Å	1.52Å
C51	NB2	sing	0.00Å	1.50Å
C51	O51	doub	0.00Å	1.18Å
NB2	CB2	sing	0.00Å	1.49Å
CA3	CA2	sing	0.00Å	1.50Å
CA3	CA4	sing	0.00Å	1.55Å
CA2	CA1	sing	0.00Å	1.47Å
OB3	CB3	sing	0.00Å	1.42Å
OA4	CA4	sing	0.00Å	1.39Å
CA4	CA5	sing	0.00Å	1.54Å
CB3	CB2	sing	0.00Å	1.50Å
CB3	CB4	sing	0.00Å	1.53Å
CB2	CB1	sing	0.00Å	1.52Å
CA1	OA1	sing	0.00Å	1.40Å
CA1	OA5	sing	0.00Å	1.44Å
OB4	CB4	sing	0.00Å	1.39Å
OB4	PB	sing	0.00Å	1.64Å
OA1	PA	sing	0.00Å	1.64Å
OP4	PB	doub	0.00Å	1.46Å
CB1	OA6	sing	0.00Å	1.41Å
CB1	OB5	sing	0.00Å	1.40Å
CB4	CB5	sing	0.00Å	1.53Å
CA5	OA5	sing	0.00Å	1.40Å
CA5	CA6	sing	0.00Å	1.54Å
OA6	CA6	sing	0.00Å	1.42Å
OP5	PA	doub	0.00Å	1.46Å
PB	OP2	sing	0.00Å	1.46Å
PB	OP3	sing	0.00Å	1.46Å
CB5	OB5	sing	0.00Å	1.44Å
CB5	CB6	sing	0.00Å	1.50Å
PA	OP6	sing	0.00Å	1.46Å
PA	OP7	sing	0.00Å	1.46Å
CB6	OB6	sing	0.00Å	1.19Å
CB1	HB1	sing	0.00Å	1.10Å
CB2	HB2	sing	0.00Å	1.10Å
NB2	HNB2	sing	0.00Å	1.00Å
CB3	HB3	sing	0.00Å	1.10Å
C12	H12S	sing	0.00Å	1.10Å
C12	H12R	sing	0.00Å	1.10Å
C13	H13R	sing	0.00Å	1.10Å
C14	H14S	sing	0.00Å	1.10Å
C14	H14R	sing	0.00Å	1.10Å
C15	H15S	sing	0.00Å	1.10Å
C15	H15R	sing	0.00Å	1.10Å
C16	H16S	sing	0.00Å	1.10Å
C16	H16R	sing	0.00Å	1.10Å
C17	H17S	sing	0.00Å	1.10Å
C17	H17R	sing	0.00Å	1.10Å
C18	H18S	sing	0.00Å	1.10Å
C18	H18R	sing	0.00Å	1.10Å
C19	H19S	sing	0.00Å	1.10Å
C19	H19R	sing	0.00Å	1.10Å
C22	H22R	sing	0.00Å	1.10Å
C22	H22S	sing	0.00Å	1.10Å
C23	H23S	sing	0.00Å	1.10Å
C23	H23R	sing	0.00Å	1.10Å
C24	H24S	sing	0.00Å	1.10Å
C24	H24R	sing	0.00Å	1.10Å
C25	H25S	sing	0.00Å	1.10Å
C25	H25R	sing	0.00Å	1.10Å
C26	H26S	sing	0.00Å	1.10Å
C26	H26R	sing	0.00Å	1.10Å
C27	H27S	sing	0.00Å	1.10Å
C27	H27R	sing	0.00Å	1.10Å
C28	H28S	sing	0.00Å	1.10Å
C28	H28R	sing	0.00Å	1.10Å
C29	H29S	sing	0.00Å	1.10Å
C29	H29R	sing	0.00Å	1.10Å
C32	H32S	sing	0.00Å	1.10Å
C32	H32R	sing	0.00Å	1.10Å
C33	H33R	sing	0.00Å	1.10Å
C34	H34S	sing	0.00Å	1.10Å
C34	H34R	sing	0.00Å	1.10Å
C35	H35S	sing	0.00Å	1.10Å
C35	H35R	sing	0.00Å	1.10Å
C36	H36S	sing	0.00Å	1.10Å
C36	H36R	sing	0.00Å	1.10Å
C37	H37S	sing	0.00Å	1.10Å
C37	H37R	sing	0.00Å	1.10Å
C38	H38S	sing	0.00Å	1.10Å
C38	H38R	sing	0.00Å	1.10Å
C39	H39S	sing	0.00Å	1.10Å
C39	H39R	sing	0.00Å	1.10Å
C52	H52S	sing	0.00Å	1.10Å
C52	H52R	sing	0.00Å	1.10Å
C53	H53R	sing	0.00Å	1.10Å
C54	H54S	sing	0.00Å	1.10Å
C54	H54R	sing	0.00Å	1.10Å
C55	H55S	sing	0.00Å	1.10Å
C55	H55R	sing	0.00Å	1.10Å
C56	H56S	sing	0.00Å	1.10Å
C56	H56R	sing	0.00Å	1.10Å
C57	H57S	sing	0.00Å	1.10Å
C57	H57R	sing	0.00Å	1.10Å
C58	H58S	sing	0.00Å	1.10Å
C58	H58R	sing	0.00Å	1.10Å
C59	H59S	sing	0.00Å	1.10Å
C59	H59R	sing	0.00Å	1.10Å
C62	H62S	sing	0.00Å	1.10Å
C62	H62R	sing	0.00Å	1.10Å
C63	H63S	sing	0.00Å	1.10Å
C63	H63R	sing	0.00Å	1.10Å
C64	H64S	sing	0.00Å	1.10Å
C64	H64R	sing	0.00Å	1.10Å
C65	H65S	sing	0.00Å	1.10Å
C65	H65R	sing	0.00Å	1.10Å
C66	H66S	sing	0.00Å	1.10Å
C66	H66R	sing	0.00Å	1.10Å
C67	H67S	sing	0.00Å	1.10Å
C67	H67R	sing	0.00Å	1.10Å
C68	H68S	sing	0.00Å	1.10Å
C68	H68R	sing	0.00Å	1.10Å
C69	H69S	sing	0.00Å	1.10Å
C69	H69R	sing	0.00Å	1.10Å
C72	H72S	sing	0.00Å	1.10Å
C72	H72R	sing	0.00Å	1.10Å
C73	H73R	sing	0.00Å	1.10Å
C74	H74S	sing	0.00Å	1.10Å
C74	H74R	sing	0.00Å	1.10Å
C75	H75S	sing	0.00Å	1.10Å
C75	H75R	sing	0.00Å	1.10Å
C76	H76S	sing	0.00Å	1.10Å
C76	H76R	sing	0.00Å	1.10Å
C77	H77S	sing	0.00Å	1.10Å
C77	H77R	sing	0.00Å	1.10Å
C78	H78S	sing	0.00Å	1.10Å
C78	H78R	sing	0.00Å	1.10Å
C79	H79S	sing	0.00Å	1.10Å
C79	H79R	sing	0.00Å	1.10Å
C82	H82S	sing	0.00Å	1.10Å
C82	H82R	sing	0.00Å	1.10Å
C83	H83S	sing	0.00Å	1.10Å
C83	H83R	sing	0.00Å	1.10Å
C84	H84S	sing	0.00Å	1.10Å
C84	H84R	sing	0.00Å	1.10Å
C85	H85S	sing	0.00Å	1.10Å
C85	H85R	sing	0.00Å	1.10Å
C86	H86S	sing	0.00Å	1.10Å
C86	H86R	sing	0.00Å	1.10Å
C87	H87S	sing	0.00Å	1.10Å
C87	H87R	sing	0.00Å	1.10Å
C88	H88S	sing	0.00Å	1.10Å
C88	H88R	sing	0.00Å	1.10Å
C89	H89S	sing	0.00Å	1.10Å
C89	H89R	sing	0.00Å	1.10Å
CA1	HA1	sing	0.00Å	1.10Å
CA2	HA2	sing	0.00Å	1.10Å
CA3	HA3	sing	0.00Å	1.10Å
CA4	HA4	sing	0.00Å	1.10Å
CA5	HA5	sing	0.00Å	1.10Å
CA6	HA6S	sing	0.00Å	1.10Å
CA6	HA6R	sing	0.00Å	1.10Å
CB4	HB4	sing	0.00Å	1.10Å
CB5	HB5	sing	0.00Å	1.10Å
CB6	HB6R	sing	0.00Å	1.10Å
CB6	HB6S	sing	0.00Å	1.10Å
NA2	HNA2	sing	0.00Å	1.00Å
O33	HO33	sing	0.00Å	0.95Å
OA4	HOA4	sing	0.00Å	0.95Å
OB6	H1	sing	0.00Å	0.95Å
OP2	H2	sing	0.00Å	0.95Å
OP3	H3	sing	0.00Å	0.95Å
OP6	H4	sing	0.00Å	0.95Å
OP7	H5	sing	0.00Å	0.95Å
CC1	H111	sing	0.00Å	1.10Å
CC1	H110	sing	0.00Å	1.10Å
CC2	H113	sing	0.00Å	1.10Å
CC2	H112	sing	0.00Å	1.10Å
CC3	H115	sing	0.00Å	1.10Å
CC3	H114	sing	0.00Å	1.10Å
CC4	H117	sing	0.00Å	1.10Å
CC4	H116	sing	0.00Å	1.10Å
CC5	H119	sing	0.00Å	1.10Å
CC5	H120	sing	0.00Å	1.10Å
CC5	H118	sing	0.00Å	1.10Å
CC6	H211	sing	0.00Å	1.10Å
CC6	H210	sing	0.00Å	1.10Å
CC7	H213	sing	0.00Å	1.10Å
CC7	H212	sing	0.00Å	1.10Å
CC8	H215	sing	0.00Å	1.10Å
CC8	H214	sing	0.00Å	1.10Å
CC9	H217	sing	0.00Å	1.10Å
CC9	H216	sing	0.00Å	1.10Å
CD1	H219	sing	0.00Å	1.10Å
CD1	H218	sing	0.00Å	1.10Å
CD2	H221	sing	0.00Å	1.10Å
CD2	H220	sing	0.00Å	1.10Å
CD3	H222	sing	0.00Å	1.10Å
CD3	H223	sing	0.00Å	1.10Å
CD3	H224	sing	0.00Å	1.10Å
CD4	H311	sing	0.00Å	1.10Å
CD4	H310	sing	0.00Å	1.10Å
CD5	H313	sing	0.00Å	1.10Å
CD5	H312	sing	0.00Å	1.10Å
CD6	H315	sing	0.00Å	1.10Å
CD6	H314	sing	0.00Å	1.10Å
CD7	H316	sing	0.00Å	1.10Å
CD7	H317	sing	0.00Å	1.10Å
CD8	H319	sing	0.00Å	1.10Å
CD8	H320	sing	0.00Å	1.10Å
CD8	H318	sing	0.00Å	1.10Å
CD9	H510	sing	0.00Å	1.10Å
CD9	H511	sing	0.00Å	1.10Å
CE1	H513	sing	0.00Å	1.10Å
CE1	H512	sing	0.00Å	1.10Å
CE2	H515	sing	0.00Å	1.10Å
CE2	H514	sing	0.00Å	1.10Å
CE3	H517	sing	0.00Å	1.10Å
CE3	H516	sing	0.00Å	1.10Å
CE4	H518	sing	0.00Å	1.10Å
CE4	H519	sing	0.00Å	1.10Å
CE4	H520	sing	0.00Å	1.10Å
CE5	H611	sing	0.00Å	1.10Å
CE5	H610	sing	0.00Å	1.10Å
CE6	H613	sing	0.00Å	1.10Å
CE6	H612	sing	0.00Å	1.10Å
CE7	H614	sing	0.00Å	1.10Å
CE7	H615	sing	0.00Å	1.10Å
CE7	H616	sing	0.00Å	1.10Å
CE8	H711	sing	0.00Å	1.10Å
CE8	H710	sing	0.00Å	1.10Å
CE9	H714	sing	0.00Å	1.10Å
CE9	H713	sing	0.00Å	1.10Å
CF1	H716	sing	0.00Å	1.10Å
CF1	H715	sing	0.00Å	1.10Å
CF2	H718	sing	0.00Å	1.10Å
CF2	H717	sing	0.00Å	1.10Å
CF3	H721	sing	0.00Å	1.10Å
CF3	H719	sing	0.00Å	1.10Å
CF3	H720	sing	0.00Å	1.10Å
CF4	H811	sing	0.00Å	1.10Å
CF4	H810	sing	0.00Å	1.10Å
CF5	H813	sing	0.00Å	1.10Å
CF5	H812	sing	0.00Å	1.10Å
CF6	H815	sing	0.00Å	1.10Å
CF6	H814	sing	0.00Å	1.10Å
CF7	H817	sing	0.00Å	1.10Å
CF7	H816	sing	0.00Å	1.10Å
CF8	H818	sing	0.00Å	1.10Å
CF8	H819	sing	0.00Å	1.10Å
CF8	H820	sing	0.00Å	1.10Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
CD3	CD2	CD1	109.8°	90.0°
CD3	CD2	H221	109.4°	90.0°
CD3	CD2	H220	109.4°	90.0°
CD2	CD3	H222	109.5°	90.0°
CD2	CD3	H223	109.4°	90.0°
CD2	CD3	H224	109.5°	90.0°
CD2	CD1	CC9	109.7°	90.0°
CD2	CD1	H219	109.4°	90.0°
CD2	CD1	H218	109.4°	90.0°
CD1	CD2	H221	109.4°	90.0°
CD1	CD2	H220	109.4°	90.0°
CF8	CF7	CF6	109.9°	90.0°
CF8	CF7	H817	109.4°	90.0°
CF8	CF7	H816	109.4°	90.0°
CF7	CF8	H818	109.5°	90.0°
CF7	CF8	H819	109.5°	90.0°
CF7	CF8	H820	109.5°	90.0°
CD1	CC9	CC8	110.7°	90.0°
CD1	CC9	H217	109.2°	90.0°
CD1	CC9	H216	109.2°	90.0°
CC9	CD1	H219	109.4°	90.0°
CC9	CD1	H218	109.4°	90.0°
CF7	CF6	CF5	109.1°	90.0°
CF7	CF6	H815	109.6°	90.0°
CF7	CF6	H814	109.6°	90.0°
CF6	CF7	H817	109.3°	90.0°
CF6	CF7	H816	109.3°	90.0°
CE7	CE6	CE5	109.3°	90.0°
CE7	CE6	H613	109.5°	90.0°
CE7	CE6	H612	109.5°	90.0°
CE6	CE7	H614	109.5°	90.0°
CE6	CE7	H615	109.4°	90.0°
CE6	CE7	H616	109.5°	90.0°
CE6	CE5	C69	110.5°	90.0°
CE6	CE5	H611	109.2°	90.0°
CE6	CE5	H610	109.2°	90.0°
CE5	CE6	H613	109.5°	90.0°
CE5	CE6	H612	109.5°	90.0°
CC9	CC8	CC7	109.1°	90.0°
CC9	CC8	H215	109.6°	90.0°
CC9	CC8	H214	109.6°	90.0°
CC8	CC9	H217	109.2°	90.0°
CC8	CC9	H216	109.2°	90.0°
CF6	CF5	CF4	109.9°	90.0°
CF6	CF5	H813	109.3°	90.0°
CF6	CF5	H812	109.4°	90.0°
CF5	CF6	H815	109.6°	90.0°
CF5	CF6	H814	109.5°	90.0°
CE5	C69	C68	108.7°	90.0°
CE5	C69	H69S	109.6°	90.0°
CE5	C69	H69R	109.7°	90.0°
C69	CE5	H611	109.2°	90.0°
C69	CE5	H610	109.2°	90.0°
CC5	CC4	CC3	109.9°	90.0°
CC5	CC4	H117	109.4°	90.0°
CC5	CC4	H116	109.4°	90.0°
CC4	CC5	H119	109.5°	90.0°
CC4	CC5	H120	109.5°	90.0°
CC4	CC5	H118	109.5°	90.0°
CF5	CF4	C89	109.3°	90.0°
CF5	CF4	H811	109.5°	90.0°
CF5	CF4	H810	109.5°	90.0°
CF4	CF5	H813	109.4°	90.0°
CF4	CF5	H812	109.3°	90.0°
CC8	CC7	CC6	110.8°	90.0°
CC8	CC7	H213	109.1°	90.0°
CC8	CC7	H212	109.1°	90.0°
CC7	CC8	H215	109.6°	90.0°
CC7	CC8	H214	109.6°	90.0°
C69	C68	C67	110.7°	90.0°
C69	C68	H68S	109.2°	90.0°
C69	C68	H68R	109.2°	90.0°
C68	C69	H69S	109.7°	90.0°
C68	C69	H69R	109.7°	90.0°
CC4	CC3	CC2	108.4°	90.0°
CC4	CC3	H115	109.7°	90.0°
CC4	CC3	H114	109.7°	90.0°
CC3	CC4	H117	109.3°	90.0°
CC3	CC4	H116	109.4°	90.0°
CC7	CC6	C29	110.6°	90.0°
CC7	CC6	H211	109.2°	90.0°
CC7	CC6	H210	109.2°	90.0°
CC6	CC7	H213	109.1°	90.0°
CC6	CC7	H212	109.1°	90.0°
CF3	CF2	CF1	109.6°	90.0°
CF3	CF2	H718	109.4°	90.0°
CF3	CF2	H717	109.4°	90.0°
CF2	CF3	H721	109.5°	90.0°
CF2	CF3	H719	109.5°	90.0°
CF2	CF3	H720	109.5°	90.0°
CF4	C89	C88	109.7°	90.0°
CF4	C89	H89S	109.4°	90.0°
CF4	C89	H89R	109.4°	90.0°
C89	CF4	H811	109.5°	90.0°
C89	CF4	H810	109.5°	90.0°
C89	C88	C87	109.4°	90.0°
C89	C88	H88S	109.5°	90.0°
C89	C88	H88R	109.5°	90.0°
C88	C89	H89S	109.4°	90.0°
C88	C89	H89R	109.4°	90.0°
C68	C67	C66	108.3°	90.0°
C68	C67	H67S	109.8°	90.0°
C68	C67	H67R	109.8°	90.0°
C67	C68	H68S	109.1°	90.0°
C67	C68	H68R	109.2°	90.0°
CF2	CF1	CE9	109.6°	90.0°
CF2	CF1	H716	109.5°	90.0°
CF2	CF1	H715	109.4°	90.0°
CF1	CF2	H718	109.4°	90.0°
CF1	CF2	H717	109.5°	90.0°
CC3	CC2	CC1	109.3°	90.0°
CC3	CC2	H113	109.5°	90.0°
CC3	CC2	H112	109.5°	90.0°
CC2	CC3	H115	109.8°	90.0°
CC2	CC3	H114	109.7°	90.0°
CC6	C29	C28	110.1°	90.0°
CC6	C29	H29S	109.3°	90.0°
CC6	C29	H29R	109.3°	90.0°
C29	CC6	H211	109.2°	90.0°
C29	CC6	H210	109.2°	90.0°
C29	C28	C27	110.2°	90.0°
C29	C28	H28S	109.3°	90.0°
C29	C28	H28R	109.3°	90.0°
C28	C29	H29S	109.3°	90.0°
C28	C29	H29R	109.3°	90.0°
CC2	CC1	C19	110.9°	90.0°
CC2	CC1	H111	109.1°	90.0°
CC2	CC1	H110	109.1°	90.0°
CC1	CC2	H113	109.5°	90.0°
CC1	CC2	H112	109.5°	90.0°
C67	C66	C65	111.4°	90.0°
C67	C66	H66S	109.0°	90.0°
C67	C66	H66R	109.0°	90.0°
C66	C67	H67S	109.8°	90.0°
C66	C67	H67R	109.8°	90.0°
CD7	CD6	CD5	110.6°	90.0°
CD6	CD7	CD8	109.6°	90.0°
CD7	CD6	H315	109.2°	90.0°
CD7	CD6	H314	109.2°	90.0°
CD6	CD7	H316	109.4°	90.0°
CD6	CD7	H317	109.4°	90.0°
CD6	CD5	CD4	109.3°	90.0°
CD6	CD5	H313	109.5°	90.0°
CD6	CD5	H312	109.5°	90.0°
CD5	CD6	H315	109.2°	90.0°
CD5	CD6	H314	109.2°	90.0°
C88	C87	C86	109.7°	90.0°
C88	C87	H87S	109.4°	90.0°
C88	C87	H87R	109.4°	90.0°
C87	C88	H88S	109.5°	90.0°
C87	C88	H88R	109.5°	90.0°
CF1	CE9	CE8	109.5°	90.0°
CF1	CE9	H714	109.4°	90.0°
CF1	CE9	H713	109.5°	90.0°
CE9	CF1	H716	109.4°	90.0°
CE9	CF1	H715	109.4°	90.0°
CD8	CD7	H316	109.4°	90.0°
CD8	CD7	H317	109.4°	90.0°
CD7	CD8	H319	109.5°	90.0°
CD7	CD8	H320	109.5°	90.0°
CD7	CD8	H318	109.5°	90.0°
C87	C86	C85	109.6°	90.0°
C87	C86	H86S	109.4°	90.0°
C87	C86	H86R	109.4°	90.0°
C86	C87	H87S	109.4°	90.0°
C86	C87	H87R	109.4°	90.0°
CE9	CE8	C79	109.6°	90.0°
CE9	CE8	H711	109.4°	90.0°
CE9	CE8	H710	109.4°	90.0°
CE8	CE9	H714	109.5°	90.0°
CE8	CE9	H713	109.5°	90.0°
C66	C65	C64	108.0°	90.0°
C66	C65	H65S	109.8°	90.0°
C66	C65	H65R	109.8°	90.0°
C65	C66	H66S	109.0°	90.0°
C65	C66	H66R	109.0°	90.0°
CC1	C19	C18	107.5°	90.0°
CC1	C19	H19S	110.0°	90.0°
CC1	C19	H19R	110.0°	90.0°
C19	CC1	H111	109.1°	90.0°
C19	CC1	H110	109.1°	90.0°
C28	C27	C26	110.2°	90.0°
C28	C27	H27S	109.3°	90.0°
C28	C27	H27R	109.3°	90.0°
C27	C28	H28S	109.3°	90.0°
C27	C28	H28R	109.3°	90.0°
C27	C26	C25	110.3°	90.0°
C27	C26	H26S	109.3°	90.0°
C27	C26	H26R	109.3°	90.0°
C26	C27	H27S	109.3°	90.0°
C26	C27	H27R	109.3°	90.0°
CD5	CD4	C39	109.9°	90.0°
CD5	CD4	H311	109.3°	90.0°
CD5	CD4	H310	109.4°	90.0°
CD4	CD5	H313	109.5°	90.0°
CD4	CD5	H312	109.5°	90.0°
CD4	C39	C38	109.1°	90.0°
CD4	C39	H39S	109.6°	90.0°
CD4	C39	H39R	109.6°	90.0°
C39	CD4	H311	109.4°	90.0°
C39	CD4	H310	109.4°	90.0°
CE4	CE3	CE2	110.0°	90.0°
CE4	CE3	H517	109.3°	90.0°
CE4	CE3	H516	109.3°	90.0°
CE3	CE4	H518	109.5°	90.0°
CE3	CE4	H519	109.5°	90.0°
CE3	CE4	H520	109.5°	90.0°
C39	C38	C37	109.9°	90.0°
C39	C38	H38S	109.4°	90.0°
C39	C38	H38R	109.4°	90.0°
C38	C39	H39S	109.6°	90.0°
C38	C39	H39R	109.6°	90.0°
C38	C37	C36	109.4°	90.0°
C38	C37	H37S	109.5°	90.0°
C38	C37	H37R	109.5°	90.0°
C37	C38	H38S	109.4°	90.0°
C37	C38	H38R	109.3°	90.0°
C19	C18	C17	110.7°	90.0°
C19	C18	H18S	109.2°	90.0°
C19	C18	H18R	109.2°	90.0°
C18	C19	H19S	110.0°	90.0°
C18	C19	H19R	110.0°	90.0°
C65	C64	C63	110.9°	90.0°
C65	C64	H64S	109.1°	90.0°
C65	C64	H64R	109.1°	90.0°
C64	C65	H65S	109.8°	90.0°
C64	C65	H65R	109.8°	90.0°
CE8	C79	C78	109.5°	90.0°
CE8	C79	H79S	109.4°	90.0°
CE8	C79	H79R	109.5°	90.0°
C79	CE8	H711	109.5°	90.0°
C79	CE8	H710	109.5°	90.0°
C26	C25	C24	112.1°	90.0°
C26	C25	H25S	108.8°	90.0°
C26	C25	H25R	108.8°	90.0°
C25	C26	H26S	109.3°	90.0°
C25	C26	H26R	109.3°	90.0°
C86	C85	C84	109.7°	90.0°
C86	C85	H85S	109.4°	90.0°
C86	C85	H85R	109.4°	90.0°
C85	C86	H86S	109.5°	90.0°
C85	C86	H86R	109.4°	90.0°
CE3	CE2	CE1	108.7°	90.0°
CE3	CE2	H515	109.7°	90.0°
CE3	CE2	H514	109.7°	90.0°
CE2	CE3	H517	109.3°	90.0°
CE2	CE3	H516	109.3°	90.0°
C85	C84	C83	108.6°	90.0°
C85	C84	H84S	109.7°	90.0°
C85	C84	H84R	109.7°	90.0°
C84	C85	H85S	109.4°	90.0°
C84	C85	H85R	109.4°	90.0°
C37	C36	C35	109.9°	90.0°
C37	C36	H36S	109.4°	90.0°
C37	C36	H36R	109.4°	90.0°
C36	C37	H37S	109.5°	90.0°
C36	C37	H37R	109.4°	90.0°
C79	C78	C77	109.4°	90.0°
C79	C78	H78S	109.5°	90.0°
C79	C78	H78R	109.5°	90.0°
C78	C79	H79S	109.5°	90.0°
C78	C79	H79R	109.5°	90.0°
CE2	CE1	CD9	111.4°	90.0°
CE2	CE1	H513	109.0°	90.0°
CE2	CE1	H512	109.0°	90.0°
CE1	CE2	H515	109.6°	90.0°
CE1	CE2	H514	109.6°	90.0°
C18	C17	C16	108.9°	90.0°
C18	C17	H17S	109.6°	90.0°
C18	C17	H17R	109.6°	90.0°
C17	C18	H18S	109.2°	90.0°
C17	C18	H18R	109.2°	90.0°
C64	C63	C62	108.8°	90.0°
C64	C63	H63S	109.6°	90.0°
C64	C63	H63R	109.7°	90.0°
C63	C64	H64S	109.1°	90.0°
C63	C64	H64R	109.1°	90.0°
C25	C24	C23	109.5°	90.0°
C25	C24	H24S	109.5°	90.0°
C25	C24	H24R	109.5°	90.0°
C24	C25	H25S	108.8°	90.0°
C24	C25	H25R	108.8°	90.0°
CE1	CD9	C59	133.9°	90.0°
CE1	CD9	H510	103.1°	90.0°
CE1	CD9	H511	103.1°	90.0°
CD9	CE1	H513	109.0°	90.0°
CD9	CE1	H512	109.0°	90.0°
C36	C35	C34	109.2°	90.0°
C36	C35	H35S	109.5°	90.0°
C36	C35	H35R	109.5°	90.0°
C35	C36	H36S	109.4°	90.0°
C35	C36	H36R	109.4°	90.0°
C17	C16	C15	109.9°	90.0°
C17	C16	H16S	109.4°	90.0°
C17	C16	H16R	109.4°	90.0°
C16	C17	H17S	109.6°	90.0°
C16	C17	H17R	109.6°	90.0°
C78	C77	C76	110.4°	90.0°
C78	C77	H77S	109.2°	90.0°
C78	C77	H77R	109.2°	90.0°
C77	C78	H78S	109.5°	90.0°
C77	C78	H78R	109.5°	90.0°
C63	C62	C61	110.4°	90.0°
C63	C62	H62S	109.2°	90.0°
C63	C62	H62R	109.2°	90.0°
C62	C63	H63S	109.6°	90.0°
C62	C63	H63R	109.6°	90.0°
C84	C83	C82	110.9°	90.0°
C84	C83	H83S	109.1°	90.0°
C84	C83	H83R	109.1°	90.0°
C83	C84	H84S	109.7°	90.0°
C83	C84	H84R	109.7°	90.0°
C24	C23	C22	110.2°	90.0°
C24	C23	H23S	109.3°	90.0°
C24	C23	H23R	109.3°	90.0°
C23	C24	H24S	109.5°	90.0°
C23	C24	H24R	109.5°	90.0°
CD9	C59	C58	108.6°	90.0°
CD9	C59	H59S	109.7°	90.0°
CD9	C59	H59R	109.7°	90.0°
C59	CD9	H510	103.1°	90.0°
C59	CD9	H511	103.1°	90.0°
C83	C82	C81	110.1°	90.0°
C83	C82	H82S	109.3°	90.0°
C83	C82	H82R	109.3°	90.0°
C82	C83	H83S	109.1°	90.0°
C82	C83	H83R	109.1°	90.0°
C77	C76	C75	110.1°	90.0°
C77	C76	H76S	109.3°	90.0°
C77	C76	H76R	109.3°	90.0°
C76	C77	H77S	109.2°	90.0°
C76	C77	H77R	109.3°	90.0°
C35	C34	C33	109.7°	90.0°
C35	C34	H34S	109.4°	90.0°
C35	C34	H34R	109.4°	90.0°
C34	C35	H35S	109.5°	90.0°
C34	C35	H35R	109.5°	90.0°
C16	C15	C14	109.7°	90.0°
C16	C15	H15S	109.4°	90.0°
C16	C15	H15R	109.4°	90.0°
C15	C16	H16S	109.4°	90.0°
C15	C16	H16R	109.4°	90.0°
C62	C61	O61	119.8°	90.0°
C62	C61	O53	120.3°	90.0°
C61	C62	H62S	109.3°	90.0°
C61	C62	H62R	109.3°	90.0°
C59	C58	C57	110.6°	90.0°
C59	C58	H58S	109.2°	90.0°
C59	C58	H58R	109.2°	90.0°
C58	C59	H59S	109.7°	90.0°
C58	C59	H59R	109.7°	90.0°
C23	C22	C21	110.6°	90.0°
C23	C22	H22R	109.2°	90.0°
C23	C22	H22S	109.2°	90.0°
C22	C23	H23S	109.3°	90.0°
C22	C23	H23R	109.3°	90.0°
C82	C81	O81	120.4°	90.0°
C82	C81	O73	119.4°	90.0°
C81	C82	H82S	109.3°	90.0°
C81	C82	H82R	109.3°	90.0°
C34	C33	C32	109.9°	90.0°
C34	C33	O33	109.4°	90.0°
C34	C33	H33R	108.9°	90.0°
C33	C34	H34S	109.4°	90.0°
C33	C34	H34R	109.4°	90.0°
C15	C14	C13	108.8°	90.0°
C15	C14	H14S	109.6°	90.0°
C15	C14	H14R	109.6°	90.0°
C14	C15	H15S	109.4°	90.0°
C14	C15	H15R	109.4°	90.0°
C76	C75	C74	109.6°	90.0°
C76	C75	H75S	109.4°	90.0°
C76	C75	H75R	109.5°	90.0°
C75	C76	H76S	109.3°	90.0°
C75	C76	H76R	109.3°	90.0°
C58	C57	C56	110.4°	90.0°
C58	C57	H57S	109.2°	90.0°
C58	C57	H57R	109.2°	90.0°
C57	C58	H58S	109.2°	90.0°
C57	C58	H58R	109.2°	90.0°
O61	C61	O53	119.9°	90.0°
C61	O53	C53	114.2°	90.0°
C22	C21	O13	120.4°	90.0°
C22	C21	O21	119.8°	90.0°
C21	C22	H22R	109.2°	90.0°
C21	C22	H22S	109.2°	90.0°
C21	O13	C13	113.6°	90.0°
O13	C21	O21	119.8°	90.0°
O13	C13	C14	109.7°	90.0°
O13	C13	C12	109.8°	90.0°
O13	C13	H13R	110.4°	90.0°
O81	C81	O73	120.2°	90.0°
C75	C74	C73	110.0°	90.0°
C75	C74	H74S	109.3°	90.0°
C75	C74	H74R	109.4°	90.0°
C74	C75	H75S	109.4°	90.0°
C74	C75	H75R	109.4°	90.0°
C81	O73	C73	115.7°	90.0°
C57	C56	C55	110.0°	90.0°
C57	C56	H56S	109.3°	90.0°
C57	C56	H56R	109.3°	90.0°
C56	C57	H57S	109.3°	90.0°
C56	C57	H57R	109.3°	90.0°
C32	C33	O33	109.3°	90.0°
C33	C32	C31	109.6°	90.0°
C33	C32	H32S	109.4°	90.0°
C33	C32	H32R	109.4°	90.0°
C32	C33	H33R	108.9°	90.0°
O33	C33	H33R	110.5°	90.0°
C33	O33	HO33	109.5°	90.0°
C14	C13	C12	109.5°	90.0°
C14	C13	H13R	108.8°	90.0°
C13	C14	H14S	109.6°	90.0°
C13	C14	H14R	109.6°	90.0°
C32	C31	O31	120.0°	90.0°
C32	C31	OA3	119.2°	90.0°
C31	C32	H32S	109.5°	90.0°
C31	C32	H32R	109.4°	90.0°
C13	C12	C11	108.2°	90.0°
C13	C12	H12S	109.8°	90.0°
C13	C12	H12R	109.8°	90.0°
C12	C13	H13R	108.7°	90.0°
O53	C53	C54	109.6°	90.0°
O53	C53	C52	109.0°	90.0°
O53	C53	H53R	110.1°	90.0°
C74	C73	O73	110.6°	90.0°
C74	C73	C72	110.4°	90.0°
C74	C73	H73R	108.8°	90.0°
C73	C74	H74S	109.3°	90.0°
C73	C74	H74R	109.3°	90.0°
C56	C55	C54	109.9°	90.0°
C56	C55	H55S	109.3°	90.0°
C56	C55	H55R	109.4°	90.0°
C55	C56	H56S	109.3°	90.0°
C55	C56	H56R	109.3°	90.0°
C55	C54	C53	108.9°	90.0°
C55	C54	H54S	109.6°	90.0°
C55	C54	H54R	109.6°	90.0°
C54	C55	H55S	109.4°	90.0°
C54	C55	H55R	109.4°	90.0°
O73	C73	C72	107.5°	90.0°
O73	C73	H73R	110.9°	90.0°
C54	C53	C52	112.0°	90.0°
C54	C53	H53R	108.1°	90.0°
C53	C54	H54S	109.6°	90.0°
C53	C54	H54R	109.6°	90.0°
C53	C52	C51	113.0°	90.0°
C53	C52	H52S	108.6°	90.0°
C53	C52	H52R	108.6°	90.0°
C52	C53	H53R	107.9°	90.0°
C73	C72	C71	108.7°	90.0°
C73	C72	H72S	109.7°	90.0°
C73	C72	H72R	109.7°	90.0°
C72	C73	H73R	108.6°	90.0°
C12	C11	O11	120.3°	90.0°
C12	C11	NA2	119.2°	90.0°
C11	C12	H12S	109.8°	90.0°
C11	C12	H12R	109.8°	90.0°
O31	C31	OA3	120.8°	90.0°
C31	OA3	CA3	115.8°	90.0°
C52	C51	NB2	120.4°	90.0°
C52	C51	O51	120.0°	90.0°
C51	C52	H52S	108.6°	90.0°
C51	C52	H52R	108.6°	90.0°
O71	C71	C72	119.8°	90.0°
O71	C71	OB3	120.1°	90.0°
OA3	CA3	CA2	108.0°	90.0°
OA3	CA3	CA4	109.3°	90.0°
OA3	CA3	HA3	110.9°	90.0°
O11	C11	NA2	120.5°	90.0°
C11	NA2	CA2	120.0°	90.0°
C11	NA2	HNA2	120.0°	90.0°
C72	C71	OB3	120.1°	90.0°
C71	C72	H72S	109.7°	90.0°
C71	C72	H72R	109.6°	90.0°
C71	OB3	CB3	114.5°	90.0°
NA2	CA2	CA3	108.8°	90.0°
NA2	CA2	CA1	110.4°	90.0°
NA2	CA2	HA2	109.1°	90.0°
CA2	NA2	HNA2	120.0°	90.0°
NB2	C51	O51	119.6°	90.0°
C51	NB2	CB2	120.2°	90.0°
C51	NB2	HNB2	119.9°	90.0°
NB2	CB2	CB3	108.5°	90.0°
NB2	CB2	CB1	108.3°	90.0°
NB2	CB2	HB2	109.7°	90.0°
CB2	NB2	HNB2	119.9°	90.0°
CA2	CA3	CA4	110.4°	90.0°
CA3	CA2	CA1	109.3°	90.0°
CA3	CA2	HA2	109.4°	90.0°
CA2	CA3	HA3	109.5°	90.0°
CA3	CA4	OA4	108.5°	90.0°
CA3	CA4	CA5	112.3°	90.0°
CA4	CA3	HA3	108.9°	90.0°
CA3	CA4	HA4	108.5°	90.0°
CA2	CA1	OA1	110.0°	90.0°
CA2	CA1	OA5	107.8°	90.0°
CA2	CA1	HA1	109.3°	90.0°
CA1	CA2	HA2	109.8°	90.0°
OB3	CB3	CB2	109.0°	90.0°
OB3	CB3	CB4	108.7°	90.0°
OB3	CB3	HB3	110.2°	90.0°
OA4	CA4	CA5	108.4°	90.0°
OA4	CA4	HA4	110.6°	90.0°
CA4	OA4	HOA4	109.5°	90.0°
CA4	CA5	OA5	112.2°	90.0°
CA4	CA5	CA6	108.6°	90.0°
CA5	CA4	HA4	108.5°	90.0°
CA4	CA5	HA5	108.6°	90.0°
CB2	CB3	CB4	111.2°	90.0°
CB3	CB2	CB1	111.5°	90.0°
CB3	CB2	HB2	109.6°	90.0°
CB2	CB3	HB3	109.1°	90.0°
CB3	CB4	OB4	109.0°	90.0°
CB3	CB4	CB5	109.2°	90.0°
CB4	CB3	HB3	108.7°	90.0°
CB3	CB4	HB4	109.0°	90.0°
CB2	CB1	OA6	109.5°	90.0°
CB2	CB1	OB5	110.9°	90.0°
CB2	CB1	HB1	108.2°	90.0°
CB1	CB2	HB2	109.3°	90.0°
OA1	CA1	OA5	109.7°	90.0°
CA1	OA1	PA	118.4°	90.0°
OA1	CA1	HA1	110.3°	90.0°
CA1	OA5	CA5	113.5°	90.0°
OA5	CA1	HA1	109.7°	90.0°
CB4	OB4	PB	119.3°	90.0°
OB4	CB4	CB5	109.7°	90.0°
OB4	CB4	HB4	111.0°	90.0°
OB4	PB	OP4	113.9°	90.0°
OB4	PB	OP2	114.6°	90.0°
OB4	PB	OP3	114.0°	90.0°
OA1	PA	OP5	114.1°	90.0°
OA1	PA	OP6	114.1°	90.0°
OA1	PA	OP7	114.2°	90.0°
OP4	PB	OP2	104.4°	90.0°
OP4	PB	OP3	104.2°	90.0°
OA6	CB1	OB5	108.6°	90.0°
CB1	OA6	CA6	114.1°	90.0°
OA6	CB1	HB1	109.7°	90.0°
CB1	OB5	CB5	112.9°	90.0°
OB5	CB1	HB1	109.9°	90.0°
CB4	CB5	OB5	108.4°	90.0°
CB4	CB5	CB6	110.1°	90.0°
CB5	CB4	HB4	108.9°	90.0°
CB4	CB5	HB5	109.0°	90.0°
OA5	CA5	CA6	108.2°	90.0°
OA5	CA5	HA5	110.5°	90.0°
CA5	CA6	OA6	109.5°	90.0°
CA6	CA5	HA5	108.6°	90.0°
CA5	CA6	HA6S	109.5°	90.0°
CA5	CA6	HA6R	109.5°	90.0°
OA6	CA6	HA6S	109.5°	90.0°
OA6	CA6	HA6R	109.5°	90.0°
OP5	PA	OP6	104.6°	90.0°
OP5	PA	OP7	104.3°	90.0°
OP2	PB	OP3	104.4°	90.0°
PB	OP2	H2	109.5°	90.0°
PB	OP3	H3	109.5°	90.0°
OB5	CB5	CB6	109.7°	90.0°
OB5	CB5	HB5	110.2°	90.0°
CB5	CB6	OB6	111.1°	90.0°
CB6	CB5	HB5	109.4°	90.0°
CB5	CB6	HB6R	109.1°	90.0°
CB5	CB6	HB6S	109.0°	90.0°
OP6	PA	OP7	104.4°	90.0°
PA	OP6	H4	109.5°	90.0°
PA	OP7	H5	109.5°	90.0°
OB6	CB6	HB6R	109.0°	90.0°
OB6	CB6	HB6S	109.1°	90.0°
CB6	OB6	H1	109.5°	90.0°
H12S	C12	H12R	109.5°	90.0°
H14S	C14	H14R	109.5°	90.0°
H15S	C15	H15R	109.5°	90.0°
H16S	C16	H16R	109.5°	90.0°
H17S	C17	H17R	109.5°	90.0°
H18S	C18	H18R	109.5°	90.0°
H19S	C19	H19R	109.4°	90.0°
H22R	C22	H22S	109.5°	90.0°
H23S	C23	H23R	109.5°	90.0°
H24S	C24	H24R	109.5°	90.0°
H25S	C25	H25R	109.5°	90.0°
H26S	C26	H26R	109.5°	90.0°
H27S	C27	H27R	109.4°	90.0°
H28S	C28	H28R	109.5°	90.0°
H29S	C29	H29R	109.5°	90.0°
H32S	C32	H32R	109.5°	90.0°
H34S	C34	H34R	109.4°	90.0°
H35S	C35	H35R	109.5°	90.0°
H36S	C36	H36R	109.5°	90.0°
H37S	C37	H37R	109.5°	90.0°
H38S	C38	H38R	109.5°	90.0°
H39S	C39	H39R	109.4°	90.0°
H52S	C52	H52R	109.4°	90.0°
H54S	C54	H54R	109.5°	90.0°
H55S	C55	H55R	109.5°	90.0°
H56S	C56	H56R	109.5°	90.0°
H57S	C57	H57R	109.5°	90.0°
H58S	C58	H58R	109.5°	90.0°
H59S	C59	H59R	109.5°	90.0°
H62S	C62	H62R	109.5°	90.0°
H63S	C63	H63R	109.5°	90.0°
H64S	C64	H64R	109.4°	90.0°
H65S	C65	H65R	109.5°	90.0°
H66S	C66	H66R	109.5°	90.0°
H67S	C67	H67R	109.5°	90.0°
H68S	C68	H68R	109.5°	90.0°
H69S	C69	H69R	109.5°	90.0°
H72S	C72	H72R	109.5°	90.0°
H74S	C74	H74R	109.5°	90.0°
H75S	C75	H75R	109.4°	90.0°
H76S	C76	H76R	109.5°	90.0°
H77S	C77	H77R	109.5°	90.0°
H78S	C78	H78R	109.5°	90.0°
H79S	C79	H79R	109.5°	90.0°
H82S	C82	H82R	109.5°	90.0°
H83S	C83	H83R	109.5°	90.0°
H84S	C84	H84R	109.5°	90.0°
H85S	C85	H85R	109.5°	90.0°
H86S	C86	H86R	109.5°	90.0°
H87S	C87	H87R	109.5°	90.0°
H88S	C88	H88R	109.5°	90.0°
H89S	C89	H89R	109.5°	90.0°
HA6S	CA6	HA6R	109.4°	90.0°
HB6R	CB6	HB6S	109.5°	90.0°
H111	CC1	H110	109.5°	90.0°
H113	CC2	H112	109.5°	90.0°
H115	CC3	H114	109.5°	90.0°
H117	CC4	H116	109.5°	90.0°
H119	CC5	H120	109.5°	90.0°
H119	CC5	H118	109.4°	90.0°
H120	CC5	H118	109.4°	90.0°
H211	CC6	H210	109.4°	90.0°
H213	CC7	H212	109.5°	90.0°
H215	CC8	H214	109.5°	90.0°
H217	CC9	H216	109.5°	90.0°
H219	CD1	H218	109.5°	90.0°
H221	CD2	H220	109.5°	90.0°
H222	CD3	H223	109.5°	90.0°
H222	CD3	H224	109.4°	90.0°
H223	CD3	H224	109.4°	90.0°
H311	CD4	H310	109.5°	90.0°
H313	CD5	H312	109.5°	90.0°
H315	CD6	H314	109.4°	90.0°
H316	CD7	H317	109.5°	90.0°
H319	CD8	H320	109.5°	90.0°
H319	CD8	H318	109.4°	90.0°
H320	CD8	H318	109.5°	90.0°
H510	CD9	H511	109.5°	90.0°
H513	CE1	H512	109.5°	90.0°
H515	CE2	H514	109.5°	90.0°
H517	CE3	H516	109.5°	90.0°
H518	CE4	H519	109.5°	90.0°
H518	CE4	H520	109.5°	90.0°
H519	CE4	H520	109.5°	90.0°
H611	CE5	H610	109.5°	90.0°
H613	CE6	H612	109.5°	90.0°
H614	CE7	H615	109.5°	90.0°
H614	CE7	H616	109.5°	90.0°
H615	CE7	H616	109.5°	90.0°
H711	CE8	H710	109.4°	90.0°
H714	CE9	H713	109.5°	90.0°
H716	CF1	H715	109.4°	90.0°
H718	CF2	H717	109.5°	90.0°
H721	CF3	H719	109.5°	90.0°
H721	CF3	H720	109.5°	90.0°
H719	CF3	H720	109.4°	90.0°
H811	CF4	H810	109.5°	90.0°
H813	CF5	H812	109.5°	90.0°
H815	CF6	H814	109.5°	90.0°
H817	CF7	H816	109.5°	90.0°
H818	CF8	H819	109.5°	90.0°
H818	CF8	H820	109.5°	90.0°
H819	CF8	H820	109.4°	90.0°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
CD3	CD2	CD1	H221	120.1°	90.0°
CD3	CD2	CD1	H220	120.0°	90.0°
CD3	CD2	CD1	CC9	161.3°	90.0°
CD3	CD2	CD1	H219	78.7°	90.0°
CD3	CD2	CD1	H218	41.3°	90.0°
CD3	CD2	H221	H220	119.8°	90.0°
CD2	CD3	H222	H223	120.0°	90.0°
CD2	CD3	H222	H224	120.0°	90.0°
CD2	CD3	H223	H224	120.0°	90.0°
CD2	CD1	CC9	H219	120.0°	90.0°
CD2	CD1	CC9	H218	120.1°	90.0°
CD2	CD1	CC9	CC8	88.3°	90.0°
CD2	CD1	CC9	H217	31.9°	90.0°
CD2	CD1	CC9	H216	151.5°	90.0°
CD2	CD1	H219	H218	119.9°	90.0°
CD1	CD2	H221	H220	119.8°	90.0°
CD1	CD2	CD3	H222	180.0°	90.0°
CD1	CD2	CD3	H223	60.0°	90.0°
CD1	CD2	CD3	H224	60.0°	90.0°
CF8	CF7	CF6	H817	120.1°	90.0°
CF8	CF7	CF6	H816	120.0°	90.0°
CF8	CF7	CF6	CF5	167.5°	90.0°
CF8	CF7	CF6	H815	47.5°	90.0°
CF8	CF7	CF6	H814	72.6°	90.0°
CF8	CF7	H817	H816	119.8°	90.0°
CF7	CF8	H818	H819	120.0°	90.0°
CF7	CF8	H818	H820	120.0°	90.0°
CF7	CF8	H819	H820	120.0°	90.0°
CD1	CC9	CC8	H217	120.2°	90.0°
CD1	CC9	CC8	H216	120.2°	90.0°
CD1	CC9	CC8	CC7	169.4°	90.0°
CD1	CC9	CC8	H215	49.5°	90.0°
CD1	CC9	CC8	H214	70.7°	90.0°
CD1	CC9	H217	H216	119.5°	90.0°
CC9	CD1	H219	H218	119.9°	90.0°
CC9	CD1	CD2	H221	41.2°	90.0°
CC9	CD1	CD2	H220	78.7°	90.0°
CF7	CF6	CF5	H815	119.9°	90.0°
CF7	CF6	CF5	H814	120.0°	90.0°
CF7	CF6	CF5	CF4	148.3°	90.0°
CF7	CF6	CF5	H813	28.3°	90.0°
CF7	CF6	CF5	H812	91.6°	90.0°
CF7	CF6	H815	H814	120.2°	90.0°
CF6	CF7	H817	H816	119.8°	90.0°
CF6	CF7	CF8	H818	180.0°	90.0°
CF6	CF7	CF8	H819	60.0°	90.0°
CF6	CF7	CF8	H820	60.0°	90.0°
CE7	CE6	CE5	H613	120.0°	90.0°
CE7	CE6	CE5	H612	120.0°	90.0°
CE7	CE6	CE5	C69	163.4°	90.0°
CE7	CE6	CE5	H611	76.5°	90.0°
CE7	CE6	CE5	H610	43.2°	90.0°
CE7	CE6	H613	H612	120.1°	90.0°
CE6	CE7	H614	H615	120.0°	90.0°
CE6	CE7	H614	H616	120.0°	90.0°
CE6	CE7	H615	H616	120.0°	90.0°
CE6	CE5	C69	H611	120.2°	90.0°
CE6	CE5	C69	H610	120.2°	90.0°
CE6	CE5	C69	C68	128.4°	90.0°
CE6	CE5	C69	H69S	8.5°	90.0°
CE6	CE5	C69	H69R	111.7°	90.0°
CE6	CE5	H611	H610	119.5°	90.0°
CE5	CE6	H613	H612	120.1°	90.0°
CE5	CE6	CE7	H614	180.0°	90.0°
CE5	CE6	CE7	H615	60.0°	90.0°
CE5	CE6	CE7	H616	60.0°	90.0°
CC9	CC8	CC7	H215	119.9°	90.0°
CC9	CC8	CC7	H214	119.9°	90.0°
CC9	CC8	CC7	CC6	149.2°	90.0°
CC9	CC8	CC7	H213	28.9°	90.0°
CC9	CC8	CC7	H212	90.6°	90.0°
CC9	CC8	H215	H214	120.2°	90.0°
CC8	CC9	H217	H216	119.4°	90.0°
CC8	CC9	CD1	H219	151.7°	90.0°
CC8	CC9	CD1	H218	31.8°	90.0°
CF6	CF5	CF4	H813	120.0°	90.0°
CF6	CF5	CF4	H812	120.1°	90.0°
CF6	CF5	CF4	C89	175.2°	90.0°
CF6	CF5	CF4	H811	55.2°	90.0°
CF6	CF5	CF4	H810	64.9°	90.0°
CF6	CF5	H813	H812	119.8°	90.0°
CF5	CF6	H815	H814	120.2°	90.0°
CF5	CF6	CF7	H817	72.4°	90.0°
CF5	CF6	CF7	H816	47.5°	90.0°
CE5	C69	C68	H69S	119.9°	90.0°
CE5	C69	C68	H69R	119.9°	90.0°
CE5	C69	C68	C67	179.1°	90.0°
CE5	C69	C68	H68S	58.9°	90.0°
CE5	C69	C68	H68R	60.7°	90.0°
CE5	C69	H69S	H69R	120.3°	90.0°
C69	CE5	H611	H610	119.5°	90.0°
C69	CE5	CE6	H613	43.4°	90.0°
C69	CE5	CE6	H612	76.6°	90.0°
CC5	CC4	CC3	H117	120.1°	90.0°
CC5	CC4	CC3	H116	120.1°	90.0°
CC5	CC4	CC3	CC2	162.7°	90.0°
CC5	CC4	CC3	H115	77.4°	90.0°
CC5	CC4	CC3	H114	42.9°	90.0°
CC5	CC4	H117	H116	119.8°	90.0°
CC4	CC5	H119	H120	120.0°	90.0°
CC4	CC5	H119	H118	120.0°	90.0°
CC4	CC5	H120	H118	120.0°	90.0°
CF5	CF4	C89	H811	120.0°	90.0°
CF5	CF4	C89	H810	120.0°	90.0°
CF5	CF4	C89	C88	175.2°	90.0°
CF5	CF4	C89	H89S	64.8°	90.0°
CF5	CF4	C89	H89R	55.2°	90.0°
CF5	CF4	H811	H810	120.1°	90.0°
CF4	CF5	H813	H812	119.8°	90.0°
CF4	CF5	CF6	H815	91.7°	90.0°
CF4	CF5	CF6	H814	28.4°	90.0°
CC8	CC7	CC6	H213	120.2°	90.0°
CC8	CC7	CC6	H212	120.2°	90.0°
CC8	CC7	CC6	C29	55.8°	90.0°
CC8	CC7	CC6	H211	64.3°	90.0°
CC8	CC7	CC6	H210	176.0°	90.0°
CC8	CC7	H213	H212	119.3°	90.0°
CC7	CC8	H215	H214	120.2°	90.0°
CC7	CC8	CC9	H217	70.4°	90.0°
CC7	CC8	CC9	H216	49.2°	90.0°
C69	C68	C67	H68S	120.2°	90.0°
C69	C68	C67	H68R	120.2°	90.0°
C69	C68	C67	C66	165.2°	90.0°
C69	C68	C67	H67S	45.4°	90.0°
C69	C68	C67	H67R	74.9°	90.0°
C69	C68	H68S	H68R	119.5°	90.0°
C68	C69	H69S	H69R	120.4°	90.0°
C68	C69	CE5	H611	111.5°	90.0°
C68	C69	CE5	H610	8.2°	90.0°
CC4	CC3	CC2	H115	119.9°	90.0°
CC4	CC3	CC2	H114	119.8°	90.0°
CC4	CC3	CC2	CC1	164.1°	90.0°
CC4	CC3	CC2	H113	75.9°	90.0°
CC4	CC3	CC2	H112	44.1°	90.0°
CC4	CC3	H115	H114	120.5°	90.0°
CC3	CC4	H117	H116	119.8°	90.0°
CC3	CC4	CC5	H119	180.0°	90.0°
CC3	CC4	CC5	H120	60.0°	90.0°
CC3	CC4	CC5	H118	60.0°	90.0°
CC7	CC6	C29	H211	120.2°	90.0°
CC7	CC6	C29	H210	120.2°	90.0°
CC7	CC6	C29	C28	150.2°	90.0°
CC7	CC6	C29	H29S	30.1°	90.0°
CC7	CC6	C29	H29R	89.7°	90.0°
CC7	CC6	H211	H210	119.5°	90.0°
CC6	CC7	H213	H212	119.4°	90.0°
CC6	CC7	CC8	H215	90.9°	90.0°
CC6	CC7	CC8	H214	29.3°	90.0°
CF3	CF2	CF1	H718	120.0°	90.0°
CF3	CF2	CF1	H717	120.0°	90.0°
CF3	CF2	CF1	CE9	157.6°	90.0°
CF3	CF2	CF1	H716	37.5°	90.0°
CF3	CF2	CF1	H715	82.4°	90.0°
CF3	CF2	H718	H717	119.9°	90.0°
CF2	CF3	H721	H719	120.0°	90.0°
CF2	CF3	H721	H720	120.0°	90.0°
CF2	CF3	H719	H720	120.0°	90.0°
CF4	C89	C88	H89S	120.1°	90.0°
CF4	C89	C88	H89R	120.0°	90.0°
CF4	C89	C88	C87	95.5°	90.0°
CF4	C89	C88	H88S	24.5°	90.0°
CF4	C89	C88	H88R	144.5°	90.0°
CF4	C89	H89S	H89R	119.9°	90.0°
C89	CF4	H811	H810	120.0°	90.0°
C89	CF4	CF5	H813	64.8°	90.0°
C89	CF4	CF5	H812	55.1°	90.0°
C89	C88	C87	H88S	120.0°	90.0°
C89	C88	C87	H88R	120.0°	90.0°
C89	C88	C87	C86	177.4°	90.0°
C89	C88	C87	H87S	57.4°	90.0°
C89	C88	C87	H87R	62.6°	90.0°
C89	C88	H88S	H88R	120.0°	90.0°
C88	C89	H89S	H89R	119.9°	90.0°
C88	C89	CF4	H811	55.2°	90.0°
C88	C89	CF4	H810	64.8°	90.0°
C68	C67	C66	H67S	119.8°	90.0°
C68	C67	C66	H67R	119.8°	90.0°
C68	C67	C66	C65	163.3°	90.0°
C68	C67	C66	H66S	43.0°	90.0°
C68	C67	C66	H66R	76.5°	90.0°
C68	C67	H67S	H67R	120.5°	90.0°
C67	C68	H68S	H68R	119.4°	90.0°
C67	C68	C69	H69S	61.0°	90.0°
C67	C68	C69	H69R	59.2°	90.0°
CF2	CF1	CE9	H716	120.0°	90.0°
CF2	CF1	CE9	H715	120.0°	90.0°
CF2	CF1	CE9	CE8	145.6°	90.0°
CF2	CF1	CE9	H714	25.6°	90.0°
CF2	CF1	CE9	H713	94.4°	90.0°
CF2	CF1	H716	H715	119.9°	90.0°
CF1	CF2	H718	H717	120.0°	90.0°
CF1	CF2	CF3	H721	180.0°	90.0°
CF1	CF2	CF3	H719	60.0°	90.0°
CF1	CF2	CF3	H720	60.0°	90.0°
CC3	CC2	CC1	H113	120.0°	90.0°
CC3	CC2	CC1	H112	119.9°	90.0°
CC3	CC2	CC1	C19	85.7°	90.0°
CC3	CC2	CC1	H111	34.5°	90.0°
CC3	CC2	CC1	H110	154.0°	90.0°
CC3	CC2	H113	H112	120.1°	90.0°
CC2	CC3	H115	H114	120.5°	90.0°
CC2	CC3	CC4	H117	42.6°	90.0°
CC2	CC3	CC4	H116	77.2°	90.0°
CC6	C29	C28	H29S	120.1°	90.0°
CC6	C29	C28	H29R	120.1°	90.0°
CC6	C29	C28	C27	74.7°	90.0°
CC6	C29	C28	H28S	45.4°	90.0°
CC6	C29	C28	H28R	165.2°	90.0°
CC6	C29	H29S	H29R	119.7°	90.0°
C29	CC6	H211	H210	119.5°	90.0°
C29	CC6	CC7	H213	176.1°	90.0°
C29	CC6	CC7	H212	64.3°	90.0°
C29	C28	C27	H28S	120.1°	90.0°
C29	C28	C27	H28R	120.1°	90.0°
C29	C28	C27	C26	161.8°	90.0°
C29	C28	C27	H27S	78.0°	90.0°
C29	C28	C27	H27R	41.7°	90.0°
C29	C28	H28S	H28R	119.7°	90.0°
C28	C29	H29S	H29R	119.7°	90.0°
C28	C29	CC6	H211	89.6°	90.0°
C28	C29	CC6	H210	30.0°	90.0°
CC2	CC1	C19	H111	120.2°	90.0°
CC2	CC1	C19	H110	120.2°	90.0°
CC2	CC1	C19	C18	139.7°	90.0°
CC2	CC1	C19	H19S	20.0°	90.0°
CC2	CC1	C19	H19R	100.6°	90.0°
CC2	CC1	H111	H110	119.3°	90.0°
CC1	CC2	H113	H112	120.1°	90.0°
CC1	CC2	CC3	H115	44.2°	90.0°
CC1	CC2	CC3	H114	76.1°	90.0°
C67	C66	C65	H66S	120.3°	90.0°
C67	C66	C65	H66R	120.3°	90.0°
C67	C66	C65	C64	156.2°	90.0°
C67	C66	C65	H65S	84.0°	90.0°
C67	C66	C65	H65R	36.4°	90.0°
C67	C66	H66S	H66R	119.1°	90.0°
C66	C67	H67S	H67R	120.6°	90.0°
C66	C67	C68	H68S	74.6°	90.0°
C66	C67	C68	H68R	45.1°	90.0°
CD7	CD6	CD5	H315	120.2°	90.0°
CD7	CD6	CD5	H314	120.2°	90.0°
CD6	CD7	CD8	H316	120.0°	90.0°
CD6	CD7	CD8	H317	120.0°	90.0°
CD7	CD6	CD5	CD4	153.1°	90.0°
CD7	CD6	CD5	H313	86.9°	90.0°
CD7	CD6	CD5	H312	33.1°	90.0°
CD7	CD6	H315	H314	119.5°	90.0°
CD6	CD7	H316	H317	119.9°	90.0°
CD6	CD7	CD8	H319	180.0°	90.0°
CD6	CD7	CD8	H320	60.0°	90.0°
CD6	CD7	CD8	H318	60.0°	90.0°
CD5	CD6	CD7	CD8	85.1°	90.0°
CD6	CD5	CD4	H313	120.0°	90.0°
CD6	CD5	CD4	H312	119.9°	90.0°
CD6	CD5	CD4	C39	152.1°	90.0°
CD6	CD5	CD4	H311	87.8°	90.0°
CD6	CD5	CD4	H310	32.1°	90.0°
CD6	CD5	H313	H312	120.0°	90.0°
CD5	CD6	H315	H314	119.5°	90.0°
CD5	CD6	CD7	H316	154.9°	90.0°
CD5	CD6	CD7	H317	34.9°	90.0°
C88	C87	C86	H87S	120.0°	90.0°
C88	C87	C86	H87R	120.1°	90.0°
C88	C87	C86	C85	112.9°	90.0°
C88	C87	C86	H86S	7.2°	90.0°
C88	C87	C86	H86R	127.1°	90.0°
C88	C87	H87S	H87R	119.9°	90.0°
C87	C88	H88S	H88R	120.0°	90.0°
C87	C88	C89	H89S	144.5°	90.0°
C87	C88	C89	H89R	24.5°	90.0°
CF1	CE9	CE8	H714	120.0°	90.0°
CF1	CE9	CE8	H713	120.0°	90.0°
CF1	CE9	CE8	C79	163.3°	90.0°
CF1	CE9	CE8	H711	43.3°	90.0°
CF1	CE9	CE8	H710	76.6°	90.0°
CF1	CE9	H714	H713	120.0°	90.0°
CE9	CF1	H716	H715	119.9°	90.0°
CE9	CF1	CF2	H718	82.4°	90.0°
CE9	CF1	CF2	H717	37.6°	90.0°
CD8	CD7	CD6	H315	154.7°	90.0°
CD8	CD7	CD6	H314	35.0°	90.0°
CD8	CD7	H316	H317	119.9°	90.0°
CD7	CD8	H319	H320	120.0°	90.0°
CD7	CD8	H319	H318	120.0°	90.0°
CD7	CD8	H320	H318	120.0°	90.0°
C87	C86	C85	H86S	120.0°	90.0°
C87	C86	C85	H86R	120.0°	90.0°
C87	C86	C85	C84	168.1°	90.0°
C87	C86	C85	H85S	48.1°	90.0°
C87	C86	C85	H85R	71.8°	90.0°
C87	C86	H86S	H86R	119.9°	90.0°
C86	C87	H87S	H87R	119.9°	90.0°
C86	C87	C88	H88S	62.6°	90.0°
C86	C87	C88	H88R	57.4°	90.0°
CE9	CE8	C79	H711	120.0°	90.0°
CE9	CE8	C79	H710	120.0°	90.0°
CE9	CE8	C79	C78	178.3°	90.0°
CE9	CE8	C79	H79S	61.7°	90.0°
CE9	CE8	C79	H79R	58.2°	90.0°
CE9	CE8	H711	H710	119.9°	90.0°
CE8	CE9	H714	H713	120.0°	90.0°
CE8	CE9	CF1	H716	94.3°	90.0°
CE8	CE9	CF1	H715	25.6°	90.0°
C66	C65	C64	H65S	119.8°	90.0°
C66	C65	C64	H65R	119.8°	90.0°
C66	C65	C64	C63	158.2°	90.0°
C66	C65	C64	H64S	81.6°	90.0°
C66	C65	C64	H64R	37.9°	90.0°
C66	C65	H65S	H65R	120.7°	90.0°
C65	C66	H66S	H66R	119.1°	90.0°
C65	C66	C67	H67S	76.9°	90.0°
C65	C66	C67	H67R	43.4°	90.0°
CC1	C19	C18	H19S	119.7°	90.0°
CC1	C19	C18	H19R	119.7°	90.0°
CC1	C19	C18	C17	179.3°	90.0°
CC1	C19	C18	H18S	59.1°	90.0°
CC1	C19	C18	H18R	60.6°	90.0°
CC1	C19	H19S	H19R	120.9°	90.0°
C19	CC1	H111	H110	119.4°	90.0°
C19	CC1	CC2	H113	154.3°	90.0°
C19	CC1	CC2	H112	34.2°	90.0°
C28	C27	C26	H27S	120.1°	90.0°
C28	C27	C26	H27R	120.1°	90.0°
C28	C27	C26	C25	75.0°	90.0°
C28	C27	C26	H26S	164.9°	90.0°
C28	C27	C26	H26R	45.1°	90.0°
C28	C27	H27S	H27R	119.7°	90.0°
C27	C28	H28S	H28R	119.7°	90.0°
C27	C28	C29	H29S	165.2°	90.0°
C27	C28	C29	H29R	45.4°	90.0°
C27	C26	C25	H26S	120.1°	90.0°
C27	C26	C25	H26R	120.1°	90.0°
C27	C26	C25	C24	123.2°	90.0°
C27	C26	C25	H25S	2.8°	90.0°
C27	C26	C25	H25R	116.4°	90.0°
C27	C26	H26S	H26R	119.6°	90.0°
C26	C27	H27S	H27R	119.7°	90.0°
C26	C27	C28	H28S	41.8°	90.0°
C26	C27	C28	H28R	78.1°	90.0°
CD5	CD4	C39	H311	120.0°	90.0°
CD5	CD4	C39	H310	120.0°	90.0°
CD5	CD4	C39	C38	175.0°	90.0°
CD5	CD4	C39	H39S	65.1°	90.0°
CD5	CD4	C39	H39R	55.0°	90.0°
CD5	CD4	H311	H310	119.8°	90.0°
CD4	CD5	H313	H312	120.1°	90.0°
CD4	CD5	CD6	H315	32.9°	90.0°
CD4	CD5	CD6	H314	86.7°	90.0°
CD4	C39	C38	H39S	119.9°	90.0°
CD4	C39	C38	H39R	120.0°	90.0°
CD4	C39	C38	C37	99.4°	90.0°
CD4	C39	C38	H38S	20.7°	90.0°
CD4	C39	C38	H38R	140.6°	90.0°
CD4	C39	H39S	H39R	120.2°	90.0°
C39	CD4	H311	H310	119.8°	90.0°
C39	CD4	CD5	H313	32.1°	90.0°
C39	CD4	CD5	H312	87.9°	90.0°
CE4	CE3	CE2	H517	120.1°	90.0°
CE4	CE3	CE2	H516	120.1°	90.0°
CE4	CE3	CE2	CE1	160.8°	90.0°
CE4	CE3	CE2	H515	79.4°	90.0°
CE4	CE3	CE2	H514	40.9°	90.0°
CE4	CE3	H517	H516	119.8°	90.0°
CE3	CE4	H518	H519	120.0°	90.0°
CE3	CE4	H518	H520	120.0°	90.0°
CE3	CE4	H519	H520	120.0°	90.0°
C39	C38	C37	H38S	120.1°	90.0°
C39	C38	C37	H38R	120.1°	90.0°
C39	C38	C37	C36	89.3°	90.0°
C39	C38	C37	H37S	30.7°	90.0°
C39	C38	C37	H37R	150.7°	90.0°
C39	C38	H38S	H38R	119.8°	90.0°
C38	C39	H39S	H39R	120.2°	90.0°
C38	C39	CD4	H311	54.9°	90.0°
C38	C39	CD4	H310	65.0°	90.0°
C38	C37	C36	H37S	120.0°	90.0°
C38	C37	C36	H37R	120.0°	90.0°
C38	C37	C36	C35	149.1°	90.0°
C38	C37	C36	H36S	90.8°	90.0°
C38	C37	C36	H36R	29.1°	90.0°
C38	C37	H37S	H37R	120.0°	90.0°
C37	C38	H38S	H38R	119.8°	90.0°
C37	C38	C39	H39S	140.7°	90.0°
C37	C38	C39	H39R	20.6°	90.0°
C19	C18	C17	H18S	120.2°	90.0°
C19	C18	C17	H18R	120.2°	90.0°
C19	C18	C17	C16	147.6°	90.0°
C19	C18	C17	H17S	92.5°	90.0°
C19	C18	C17	H17R	27.7°	90.0°
C19	C18	H18S	H18R	119.4°	90.0°
C18	C19	H19S	H19R	120.9°	90.0°
C18	C19	CC1	H111	100.1°	90.0°
C18	C19	CC1	H110	19.5°	90.0°
C65	C64	C63	H64S	120.2°	90.0°
C65	C64	C63	H64R	120.2°	90.0°
C65	C64	C63	C62	177.4°	90.0°
C65	C64	C63	H63S	62.7°	90.0°
C65	C64	C63	H63R	57.5°	90.0°
C65	C64	H64S	H64R	119.3°	90.0°
C64	C65	H65S	H65R	120.7°	90.0°
C64	C65	C66	H66S	36.0°	90.0°
C64	C65	C66	H66R	83.5°	90.0°
CE8	C79	C78	H79S	120.0°	90.0°
CE8	C79	C78	H79R	120.0°	90.0°
CE8	C79	C78	C77	165.3°	90.0°
CE8	C79	C78	H78S	74.7°	90.0°
CE8	C79	C78	H78R	45.3°	90.0°
CE8	C79	H79S	H79R	120.0°	90.0°
C79	CE8	H711	H710	120.0°	90.0°
C79	CE8	CE9	H714	76.7°	90.0°
C79	CE8	CE9	H713	43.3°	90.0°
C26	C25	C24	H25S	120.4°	90.0°
C26	C25	C24	H25R	120.4°	90.0°
C26	C25	C24	C23	123.6°	90.0°
C26	C25	C24	H24S	3.5°	90.0°
C26	C25	C24	H24R	116.5°	90.0°
C26	C25	H25S	H25R	118.8°	90.0°
C25	C26	H26S	H26R	119.7°	90.0°
C25	C26	C27	H27S	45.1°	90.0°
C25	C26	C27	H27R	164.8°	90.0°
C86	C85	C84	H85S	120.0°	90.0°
C86	C85	C84	H85R	120.0°	90.0°
C86	C85	C84	C83	177.9°	90.0°
C86	C85	C84	H84S	58.0°	90.0°
C86	C85	C84	H84R	62.2°	90.0°
C86	C85	H85S	H85R	119.9°	90.0°
C85	C86	H86S	H86R	119.9°	90.0°
C85	C86	C87	H87S	127.1°	90.0°
C85	C86	C87	H87R	7.2°	90.0°
CE3	CE2	CE1	H515	119.9°	90.0°
CE3	CE2	CE1	H514	119.9°	90.0°
CE3	CE2	CE1	CD9	156.8°	90.0°
CE3	CE2	CE1	H513	82.9°	90.0°
CE3	CE2	CE1	H512	36.6°	90.0°
CE3	CE2	H515	H514	120.4°	90.0°
CE2	CE3	H517	H516	119.8°	90.0°
CE2	CE3	CE4	H518	180.0°	90.0°
CE2	CE3	CE4	H519	60.0°	90.0°
CE2	CE3	CE4	H520	60.0°	90.0°
C85	C84	C83	H84S	119.9°	90.0°
C85	C84	C83	H84R	119.9°	90.0°
C85	C84	C83	C82	155.6°	90.0°
C85	C84	C83	H83S	35.4°	90.0°
C85	C84	C83	H83R	84.2°	90.0°
C85	C84	H84S	H84R	120.4°	90.0°
C84	C85	H85S	H85R	119.9°	90.0°
C84	C85	C86	H86S	71.8°	90.0°
C84	C85	C86	H86R	48.1°	90.0°
C37	C36	C35	H36S	120.0°	90.0°
C37	C36	C35	H36R	120.1°	90.0°
C37	C36	C35	C34	168.2°	90.0°
C37	C36	C35	H35S	71.8°	90.0°
C37	C36	C35	H35R	48.3°	90.0°
C37	C36	H36S	H36R	119.8°	90.0°
C36	C37	H37S	H37R	120.0°	90.0°
C36	C37	C38	H38S	150.6°	90.0°
C36	C37	C38	H38R	30.7°	90.0°
C79	C78	C77	H78S	120.0°	90.0°
C79	C78	C77	H78R	120.0°	90.0°
C79	C78	C77	C76	161.9°	90.0°
C79	C78	C77	H77S	77.9°	90.0°
C79	C78	C77	H77R	41.8°	90.0°
C79	C78	H78S	H78R	120.0°	90.0°
C78	C79	H79S	H79R	120.0°	90.0°
C78	C79	CE8	H711	58.2°	90.0°
C78	C79	CE8	H710	61.7°	90.0°
CE2	CE1	CD9	H513	120.3°	90.0°
CE2	CE1	CD9	H512	120.3°	90.0°
CE2	CE1	CD9	C59	19.3°	90.0°
CE2	CE1	CD9	H510	103.8°	90.0°
CE2	CE1	CD9	H511	142.3°	90.0°
CE2	CE1	H513	H512	119.1°	90.0°
CE1	CE2	H515	H514	120.3°	90.0°
CE1	CE2	CE3	H517	40.7°	90.0°
CE1	CE2	CE3	H516	79.2°	90.0°
C18	C17	C16	H17S	119.9°	90.0°
C18	C17	C16	H17R	119.9°	90.0°
C18	C17	C16	C15	138.2°	90.0°
C18	C17	C16	H16S	101.7°	90.0°
C18	C17	C16	H16R	18.2°	90.0°
C18	C17	H17S	H17R	120.3°	90.0°
C17	C18	H18S	H18R	119.4°	90.0°
C17	C18	C19	H19S	61.1°	90.0°
C17	C18	C19	H19R	59.5°	90.0°
C64	C63	C62	H63S	119.9°	90.0°
C64	C63	C62	H63R	119.9°	90.0°
C64	C63	C62	C61	176.4°	90.0°
C64	C63	C62	H62S	56.3°	90.0°
C64	C63	C62	H62R	63.4°	90.0°
C64	C63	H63S	H63R	120.3°	90.0°
C63	C64	H64S	H64R	119.3°	90.0°
C63	C64	C65	H65S	38.4°	90.0°
C63	C64	C65	H65R	82.0°	90.0°
C25	C24	C23	H24S	120.0°	90.0°
C25	C24	C23	H24R	120.0°	90.0°
C25	C24	C23	C22	171.1°	90.0°
C25	C24	C23	H23S	68.8°	90.0°
C25	C24	C23	H23R	51.0°	90.0°
C25	C24	H24S	H24R	120.0°	90.0°
C24	C25	H25S	H25R	118.8°	90.0°
C24	C25	C26	H26S	116.7°	90.0°
C24	C25	C26	H26R	3.1°	90.0°
CE1	CD9	C59	H510	123.0°	90.0°
CE1	CD9	C59	H511	123.0°	90.0°
CE1	CD9	C59	C58	173.9°	90.0°
CE1	CD9	C59	H59S	66.2°	90.0°
CE1	CD9	C59	H59R	54.1°	90.0°
CE1	CD9	H510	H511	109.2°	90.0°
CD9	CE1	H513	H512	119.1°	90.0°
CD9	CE1	CE2	H515	36.9°	90.0°
CD9	CE1	CE2	H514	83.3°	90.0°
C36	C35	C34	H35S	120.0°	90.0°
C36	C35	C34	H35R	120.0°	90.0°
C36	C35	C34	C33	162.0°	90.0°
C36	C35	C34	H34S	78.0°	90.0°
C36	C35	C34	H34R	42.0°	90.0°
C36	C35	H35S	H35R	120.1°	90.0°
C35	C36	H36S	H36R	119.8°	90.0°
C35	C36	C37	H37S	29.1°	90.0°
C35	C36	C37	H37R	90.9°	90.0°
C17	C16	C15	H16S	120.1°	90.0°
C17	C16	C15	H16R	120.0°	90.0°
C17	C16	C15	C14	152.5°	90.0°
C17	C16	C15	H15S	87.4°	90.0°
C17	C16	C15	H15R	32.5°	90.0°
C17	C16	H16S	H16R	119.8°	90.0°
C16	C17	H17S	H17R	120.2°	90.0°
C16	C17	C18	H18S	27.4°	90.0°
C16	C17	C18	H18R	92.2°	90.0°
C78	C77	C76	H77S	120.1°	90.0°
C78	C77	C76	H77R	120.1°	90.0°
C78	C77	C76	C75	85.1°	90.0°
C78	C77	C76	H76S	35.0°	90.0°
C78	C77	C76	H76R	154.8°	90.0°
C78	C77	H77S	H77R	119.6°	90.0°
C77	C78	H78S	H78R	120.0°	90.0°
C77	C78	C79	H79S	45.4°	90.0°
C77	C78	C79	H79R	74.6°	90.0°
C63	C62	C61	H62S	120.1°	90.0°
C63	C62	C61	H62R	120.1°	90.0°
C63	C62	C61	O61	27.0°	90.0°
C63	C62	C61	O53	153.0°	90.0°
C63	C62	H62S	H62R	119.6°	90.0°
C62	C63	H63S	H63R	120.3°	90.0°
C62	C63	C64	H64S	57.2°	90.0°
C62	C63	C64	H64R	62.4°	90.0°
C84	C83	C82	H83S	120.2°	90.0°
C84	C83	C82	H83R	120.2°	90.0°
C84	C83	C82	C81	91.5°	90.0°
C84	C83	C82	H82S	28.6°	90.0°
C84	C83	C82	H82R	148.4°	90.0°
C84	C83	H83S	H83R	119.3°	90.0°
C83	C84	H84S	H84R	120.4°	90.0°
C83	C84	C85	H85S	62.0°	90.0°
C83	C84	C85	H85R	57.9°	90.0°
C24	C23	C22	H23S	120.1°	90.0°
C24	C23	C22	H23R	120.1°	90.0°
C24	C23	C22	C21	57.5°	90.0°
C24	C23	C22	H22R	177.7°	90.0°
C24	C23	C22	H22S	62.7°	90.0°
C24	C23	H23S	H23R	119.6°	90.0°
C23	C24	H24S	H24R	120.0°	90.0°
C23	C24	C25	H25S	116.1°	90.0°
C23	C24	C25	H25R	3.1°	90.0°
CD9	C59	C58	H59S	119.9°	90.0°
CD9	C59	C58	H59R	119.9°	90.0°
CD9	C59	C58	C57	175.6°	90.0°
CD9	C59	C58	H58S	55.4°	90.0°
CD9	C59	C58	H58R	64.2°	90.0°
CD9	C59	H59S	H59R	120.4°	90.0°
C59	CD9	H510	H511	109.2°	90.0°
C59	CD9	CE1	H513	139.5°	90.0°
C59	CD9	CE1	H512	101.0°	90.0°
C83	C82	C81	H82S	120.1°	90.0°
C83	C82	C81	H82R	120.1°	90.0°
C83	C82	C81	O81	24.4°	90.0°
C83	C82	C81	O73	156.0°	90.0°
C83	C82	H82S	H82R	119.7°	90.0°
C82	C83	H83S	H83R	119.3°	90.0°
C82	C83	C84	H84S	84.5°	90.0°
C82	C83	C84	H84R	35.7°	90.0°
C77	C76	C75	H76S	120.1°	90.0°
C77	C76	C75	H76R	120.1°	90.0°
C77	C76	C75	C74	135.6°	90.0°
C77	C76	C75	H75S	104.3°	90.0°
C77	C76	C75	H75R	15.6°	90.0°
C77	C76	H76S	H76R	119.7°	90.0°
C76	C77	H77S	H77R	119.6°	90.0°
C76	C77	C78	H78S	42.0°	90.0°
C76	C77	C78	H78R	78.1°	90.0°
C35	C34	C33	H34S	120.1°	90.0°
C35	C34	C33	H34R	120.1°	90.0°
C35	C34	C33	C32	94.5°	90.0°
C35	C34	C33	O33	145.5°	90.0°
C35	C34	C33	H33R	24.6°	90.0°
C35	C34	H34S	H34R	119.9°	90.0°
C34	C35	H35S	H35R	120.1°	90.0°
C34	C35	C36	H36S	48.2°	90.0°
C34	C35	C36	H36R	71.7°	90.0°
C16	C15	C14	H15S	120.0°	90.0°
C16	C15	C14	H15R	120.1°	90.0°
C16	C15	C14	C13	99.4°	90.0°
C16	C15	C14	H14S	20.5°	90.0°
C16	C15	C14	H14R	140.7°	90.0°
C16	C15	H15S	H15R	119.9°	90.0°
C15	C16	H16S	H16R	119.8°	90.0°
C15	C16	C17	H17S	18.3°	90.0°
C15	C16	C17	H17R	101.9°	90.0°
C62	C61	O61	O53	180.0°	90.0°
C62	C61	O53	C53	71.7°	90.0°
C61	C62	H62S	H62R	119.6°	90.0°
C61	C62	C63	H63S	63.7°	90.0°
C61	C62	C63	H63R	56.5°	90.0°
C59	C58	C57	H58S	120.1°	90.0°
C59	C58	C57	H58R	120.2°	90.0°
C59	C58	C57	C56	69.0°	90.0°
C59	C58	C57	H57S	51.1°	90.0°
C59	C58	C57	H57R	170.9°	90.0°
C59	C58	H58S	H58R	119.5°	90.0°
C58	C59	H59S	H59R	120.4°	90.0°
C58	C59	CD9	H510	50.9°	90.0°
C58	C59	CD9	H511	63.1°	90.0°
C23	C22	C21	H22R	120.2°	90.0°
C23	C22	C21	H22S	120.2°	90.0°
C23	C22	C21	O13	44.1°	90.0°
C23	C22	C21	O21	136.1°	90.0°
C23	C22	H22R	H22S	119.5°	90.0°
C22	C23	H23S	H23R	119.7°	90.0°
C22	C23	C24	H24S	51.1°	90.0°
C22	C23	C24	H24R	68.9°	90.0°
C82	C81	O81	O73	179.6°	90.0°
C82	C81	O73	C73	115.3°	90.0°
C81	C82	H82S	H82R	119.7°	90.0°
C81	C82	C83	H83S	148.3°	90.0°
C81	C82	C83	H83R	28.7°	90.0°
C34	C33	C32	O33	120.0°	90.0°
C34	C33	C32	H33R	119.2°	90.0°
C34	C33	O33	H33R	119.9°	90.0°
C34	C33	C32	C31	167.2°	90.0°
C34	C33	C32	H32S	47.1°	90.0°
C34	C33	C32	H32R	72.8°	90.0°
C33	C34	H34S	H34R	119.9°	90.0°
C33	C34	C35	H35S	42.0°	90.0°
C33	C34	C35	H35R	78.0°	90.0°
C34	C33	O33	HO33	170.4°	90.0°
C15	C14	C13	O13	49.3°	90.0°
C15	C14	C13	H14S	119.9°	90.0°
C15	C14	C13	H14R	119.9°	90.0°
C15	C14	C13	C12	169.9°	90.0°
C15	C14	C13	H13R	71.5°	90.0°
C15	C14	H14S	H14R	120.3°	90.0°
C14	C15	H15S	H15R	119.9°	90.0°
C14	C15	C16	H16S	32.5°	90.0°
C14	C15	C16	H16R	87.4°	90.0°
C76	C75	C74	H75S	120.0°	90.0°
C76	C75	C74	H75R	120.1°	90.0°
C76	C75	C74	C73	172.6°	90.0°
C76	C75	C74	H74S	67.3°	90.0°
C76	C75	C74	H74R	52.6°	90.0°
C76	C75	H75S	H75R	119.9°	90.0°
C75	C76	H76S	H76R	119.7°	90.0°
C75	C76	C77	H77S	154.7°	90.0°
C75	C76	C77	H77R	35.0°	90.0°
C58	C57	C56	H57S	120.1°	90.0°
C58	C57	C56	H57R	120.1°	90.0°
C58	C57	C56	C55	99.9°	90.0°
C58	C57	C56	H56S	140.0°	90.0°
C58	C57	C56	H56R	20.2°	90.0°
C58	C57	H57S	H57R	119.6°	90.0°
C57	C58	H58S	H58R	119.5°	90.0°
C57	C58	C59	H59S	64.5°	90.0°
C57	C58	C59	H59R	55.7°	90.0°
O61	C61	O53	C53	108.3°	90.0°
O61	C61	C62	H62S	147.1°	90.0°
O61	C61	C62	H62R	93.2°	90.0°
C61	O53	C53	C54	137.0°	90.0°
C61	O53	C53	C52	100.1°	90.0°
C61	O53	C53	H53R	18.2°	90.0°
O53	C61	C62	H62S	32.9°	90.0°
O53	C61	C62	H62R	86.9°	90.0°
C22	C21	O13	O21	179.8°	90.0°
C22	C21	O13	C13	72.4°	90.0°
C21	C22	H22R	H22S	119.4°	90.0°
C21	C22	C23	H23S	62.7°	90.0°
C21	C22	C23	H23R	177.6°	90.0°
C21	O13	C13	C14	172.9°	90.0°
C21	O13	C13	C12	66.8°	90.0°
C21	O13	C13	H13R	53.0°	90.0°
O13	C21	C22	H22R	76.1°	90.0°
O13	C21	C22	H22S	164.2°	90.0°
C13	O13	C21	O21	107.5°	90.0°
O13	C13	C14	C12	120.5°	90.0°
O13	C13	C14	H13R	120.9°	90.0°
O13	C13	C12	H13R	120.8°	90.0°
O13	C13	C12	C11	103.3°	90.0°
O13	C13	C12	H12S	16.5°	90.0°
O13	C13	C12	H12R	136.9°	90.0°
O13	C13	C14	H14S	70.5°	90.0°
O13	C13	C14	H14R	169.2°	90.0°
O81	C81	O73	C73	65.1°	90.0°
O81	C81	C82	H82S	95.7°	90.0°
O81	C81	C82	H82R	144.5°	90.0°
O21	C21	C22	H22R	103.7°	90.0°
O21	C21	C22	H22S	15.9°	90.0°
C75	C74	C73	H74S	120.1°	90.0°
C75	C74	C73	H74R	120.1°	90.0°
C75	C74	C73	O73	101.7°	90.0°
C75	C74	C73	C72	139.5°	90.0°
C75	C74	C73	H73R	20.4°	90.0°
C75	C74	H74S	H74R	119.8°	90.0°
C74	C75	H75S	H75R	119.9°	90.0°
C74	C75	C76	H76S	15.6°	90.0°
C74	C75	C76	H76R	104.2°	90.0°
C81	O73	C73	C74	61.9°	90.0°
C81	O73	C73	C72	177.5°	90.0°
C81	O73	C73	H73R	58.9°	90.0°
O73	C81	C82	H82S	83.9°	90.0°
O73	C81	C82	H82R	35.9°	90.0°
C57	C56	C55	H56S	120.1°	90.0°
C57	C56	C55	H56R	120.1°	90.0°
C57	C56	C55	C54	98.6°	90.0°
C57	C56	C55	H55S	141.4°	90.0°
C57	C56	C55	H55R	21.5°	90.0°
C57	C56	H56S	H56R	119.7°	90.0°
C56	C57	H57S	H57R	119.6°	90.0°
C56	C57	C58	H58S	170.9°	90.0°
C56	C57	C58	H58R	51.2°	90.0°
C32	C33	O33	H33R	119.8°	90.0°
C33	C32	C31	H32S	120.0°	90.0°
C33	C32	C31	H32R	120.0°	90.0°
C33	C32	C31	O31	41.6°	90.0°
C33	C32	C31	OA3	138.2°	90.0°
C33	C32	H32S	H32R	119.9°	90.0°
C32	C33	C34	H34S	145.4°	90.0°
C32	C33	C34	H34R	25.5°	90.0°
C32	C33	O33	HO33	50.0°	90.0°
O33	C33	C32	C31	47.1°	90.0°
O33	C33	C32	H32S	72.9°	90.0°
O33	C33	C32	H32R	167.2°	90.0°
O33	C33	C34	H34S	25.5°	90.0°
O33	C33	C34	H34R	94.4°	90.0°
C14	C13	C12	H13R	118.7°	90.0°
C14	C13	C12	C11	136.2°	90.0°
C14	C13	C12	H12S	104.0°	90.0°
C14	C13	C12	H12R	16.4°	90.0°
C13	C14	H14S	H14R	120.3°	90.0°
C13	C14	C15	H15S	140.6°	90.0°
C13	C14	C15	H15R	20.7°	90.0°
C32	C31	O31	OA3	179.8°	90.0°
C32	C31	OA3	CA3	176.0°	90.0°
C31	C32	H32S	H32R	119.9°	90.0°
C31	C32	C33	H33R	73.7°	90.0°
C13	C12	C11	H12S	119.8°	90.0°
C13	C12	C11	H12R	119.8°	90.0°
C13	C12	C11	O11	105.8°	90.0°
C13	C12	C11	NA2	74.1°	90.0°
C13	C12	H12S	H12R	120.6°	90.0°
C12	C13	C14	H14S	50.0°	90.0°
C12	C13	C14	H14R	70.2°	90.0°
O53	C53	C54	C55	92.4°	90.0°
O53	C53	C54	C52	121.2°	90.0°
O53	C53	C54	H53R	120.0°	90.0°
O53	C53	C52	H53R	119.6°	90.0°
O53	C53	C52	C51	88.6°	90.0°
O53	C53	C52	H52S	150.9°	90.0°
O53	C53	C52	H52R	31.9°	90.0°
O53	C53	C54	H54S	27.6°	90.0°
O53	C53	C54	H54R	147.7°	90.0°
C74	C73	O73	C72	120.6°	90.0°
C74	C73	O73	H73R	120.8°	90.0°
C74	C73	C72	H73R	119.2°	90.0°
C74	C73	C72	C71	85.8°	90.0°
C74	C73	C72	H72S	34.1°	90.0°
C74	C73	C72	H72R	154.3°	90.0°
C73	C74	H74S	H74R	119.7°	90.0°
C73	C74	C75	H75S	52.6°	90.0°
C73	C74	C75	H75R	67.3°	90.0°
C56	C55	C54	H55S	120.0°	90.0°
C56	C55	C54	H55R	120.1°	90.0°
C56	C55	C54	C53	151.9°	90.0°
C56	C55	C54	H54S	31.9°	90.0°
C56	C55	C54	H54R	88.2°	90.0°
C56	C55	H55S	H55R	119.8°	90.0°
C55	C56	H56S	H56R	119.7°	90.0°
C55	C56	C57	H57S	20.2°	90.0°
C55	C56	C57	H57R	139.9°	90.0°
C55	C54	C53	H54S	119.9°	90.0°
C55	C54	C53	H54R	119.9°	90.0°
C55	C54	C53	C52	146.5°	90.0°
C55	C54	C53	H53R	27.7°	90.0°
C55	C54	H54S	H54R	120.3°	90.0°
C54	C55	H55S	H55R	119.9°	90.0°
C54	C55	C56	H56S	21.5°	90.0°
C54	C55	C56	H56R	141.4°	90.0°
O73	C73	C72	H73R	120.1°	90.0°
O73	C73	C72	C71	34.8°	90.0°
O73	C73	C72	H72S	154.7°	90.0°
O73	C73	C72	H72R	85.0°	90.0°
O73	C73	C74	H74S	18.4°	90.0°
O73	C73	C74	H74R	138.2°	90.0°
C54	C53	C52	H53R	118.9°	90.0°
C54	C53	C52	C51	32.9°	90.0°
C54	C53	C52	H52S	87.7°	90.0°
C54	C53	C52	H52R	153.4°	90.0°
C53	C54	H54S	H54R	120.2°	90.0°
C53	C54	C55	H55S	88.1°	90.0°
C53	C54	C55	H55R	31.8°	90.0°
C53	C52	C51	H52S	120.5°	90.0°
C53	C52	C51	H52R	120.5°	90.0°
C53	C52	C51	NB2	90.5°	90.0°
C53	C52	C51	O51	90.2°	90.0°
C53	C52	H52S	H52R	118.4°	90.0°
C52	C53	C54	H54S	93.6°	90.0°
C52	C53	C54	H54R	26.5°	90.0°
C73	C72	C71	O71	39.2°	90.0°
C73	C72	C71	H72S	119.9°	90.0°
C73	C72	C71	H72R	119.9°	90.0°
C73	C72	C71	OB3	140.5°	90.0°
C73	C72	H72S	H72R	120.4°	90.0°
C72	C73	C74	H74S	100.4°	90.0°
C72	C73	C74	H74R	19.4°	90.0°
C12	C11	O11	NA2	179.9°	90.0°
C12	C11	NA2	CA2	179.7°	90.0°
C11	C12	H12S	H12R	120.5°	90.0°
C11	C12	C13	H13R	17.5°	90.0°
C12	C11	NA2	HNA2	0.3°	90.0°
O31	C31	OA3	CA3	4.2°	90.0°
O31	C31	C32	H32S	161.6°	90.0°
O31	C31	C32	H32R	78.4°	90.0°
C31	OA3	CA3	CA2	155.4°	90.0°
C31	OA3	CA3	CA4	84.6°	90.0°
OA3	C31	C32	H32S	18.2°	90.0°
OA3	C31	C32	H32R	101.8°	90.0°
C31	OA3	CA3	HA3	35.5°	90.0°
C52	C51	NB2	O51	179.3°	90.0°
C52	C51	NB2	CB2	179.5°	90.0°
C52	C51	NB2	HNB2	0.4°	90.0°
C51	C52	H52S	H52R	118.4°	90.0°
C51	C52	C53	H53R	151.8°	90.0°
O71	C71	C72	OB3	179.7°	90.0°
O71	C71	OB3	CB3	48.8°	90.0°
O71	C71	C72	H72S	80.7°	90.0°
O71	C71	C72	H72R	159.1°	90.0°
OA3	CA3	CA2	NA2	63.6°	90.0°
OA3	CA3	CA2	CA4	119.3°	90.0°
OA3	CA3	CA2	HA3	120.9°	90.0°
OA3	CA3	CA4	HA3	121.3°	90.0°
OA3	CA3	CA2	CA1	175.7°	90.0°
OA3	CA3	CA4	OA4	76.9°	90.0°
OA3	CA3	CA4	CA5	163.2°	90.0°
OA3	CA3	CA2	HA2	55.5°	90.0°
OA3	CA3	CA4	HA4	43.3°	90.0°
O11	C11	NA2	CA2	0.2°	90.0°
O11	C11	C12	H12S	14.0°	90.0°
O11	C11	C12	H12R	134.4°	90.0°
O11	C11	NA2	HNA2	179.8°	90.0°
C11	NA2	CA2	HNA2	180.0°	90.0°
C11	NA2	CA2	CA3	126.2°	90.0°
C11	NA2	CA2	CA1	113.9°	90.0°
NA2	C11	C12	H12S	166.1°	90.0°
NA2	C11	C12	H12R	45.7°	90.0°
C11	NA2	CA2	HA2	6.9°	90.0°
C72	C71	OB3	CB3	131.5°	90.0°
C71	C72	H72S	H72R	120.3°	90.0°
C71	C72	C73	H73R	154.9°	90.0°
C71	OB3	CB3	CB2	129.2°	90.0°
C71	OB3	CB3	CB4	109.5°	90.0°
C71	OB3	CB3	HB3	9.6°	90.0°
OB3	C71	C72	H72S	99.6°	90.0°
OB3	C71	C72	H72R	20.6°	90.0°
NA2	CA2	CA3	CA1	120.7°	90.0°
NA2	CA2	CA3	HA2	119.1°	90.0°
NA2	CA2	CA3	CA4	177.0°	90.0°
NA2	CA2	CA1	HA2	120.4°	90.0°
NA2	CA2	CA1	OA1	66.0°	90.0°
NA2	CA2	CA1	OA5	174.5°	90.0°
NA2	CA2	CA1	HA1	55.3°	90.0°
NA2	CA2	CA3	HA3	57.2°	90.0°
C51	NB2	CB2	HNB2	180.0°	90.0°
C51	NB2	CB2	CB3	143.2°	90.0°
C51	NB2	CB2	CB1	95.7°	90.0°
C51	NB2	CB2	HB2	23.5°	90.0°
NB2	C51	C52	H52S	149.0°	90.0°
NB2	C51	C52	H52R	30.1°	90.0°
O51	C51	NB2	CB2	0.2°	90.0°
O51	C51	NB2	HNB2	179.8°	90.0°
O51	C51	C52	H52S	30.3°	90.0°
O51	C51	C52	H52R	149.3°	90.0°
NB2	CB2	CB3	OB3	71.4°	90.0°
NB2	CB2	CB3	CB1	119.1°	90.0°
NB2	CB2	CB3	HB2	119.7°	90.0°
NB2	CB2	CB3	CB4	168.8°	90.0°
NB2	CB2	CB1	HB2	119.4°	90.0°
NB2	CB2	CB1	OA6	68.0°	90.0°
NB2	CB2	CB1	OB5	172.2°	90.0°
NB2	CB2	CB1	HB1	51.6°	90.0°
NB2	CB2	CB3	HB3	48.9°	90.0°
CA2	CA3	CA4	HA3	120.2°	90.0°
CA3	CA2	CA1	HA2	120.0°	90.0°
CA2	CA3	CA4	OA4	164.5°	90.0°
CA2	CA3	CA4	CA5	44.7°	90.0°
CA3	CA2	CA1	OA1	53.7°	90.0°
CA3	CA2	CA1	OA5	65.8°	90.0°
CA3	CA2	CA1	HA1	174.9°	90.0°
CA2	CA3	CA4	HA4	75.2°	90.0°
CA3	CA2	NA2	HNA2	53.8°	90.0°
CA4	CA3	CA2	CA1	56.4°	90.0°
CA3	CA4	OA4	CA5	122.2°	90.0°
CA3	CA4	OA4	HA4	118.9°	90.0°
CA3	CA4	CA5	HA4	119.9°	90.0°
CA3	CA4	CA5	OA5	43.3°	90.0°
CA3	CA4	CA5	CA6	162.8°	90.0°
CA4	CA3	CA2	HA2	63.8°	90.0°
CA3	CA4	CA5	HA5	79.2°	90.0°
CA3	CA4	OA4	HOA4	19.1°	90.0°
CA2	CA1	OA1	OA5	118.4°	90.0°
CA2	CA1	OA1	HA1	120.6°	90.0°
CA2	CA1	OA5	HA1	118.9°	90.0°
CA2	CA1	OA1	PA	149.5°	90.0°
CA2	CA1	OA5	CA5	66.3°	90.0°
CA1	CA2	CA3	HA3	63.4°	90.0°
CA1	CA2	NA2	HNA2	66.1°	90.0°
OB3	CB3	CB2	CB4	119.8°	90.0°
OB3	CB3	CB2	HB3	120.4°	90.0°
OB3	CB3	CB4	HB3	120.0°	90.0°
OB3	CB3	CB2	CB1	169.4°	90.0°
OB3	CB3	CB4	OB4	67.5°	90.0°
OB3	CB3	CB4	CB5	172.7°	90.0°
OB3	CB3	CB2	HB2	48.3°	90.0°
OB3	CB3	CB4	HB4	53.8°	90.0°
OA4	CA4	CA5	HA4	120.2°	90.0°
OA4	CA4	CA5	OA5	163.2°	90.0°
OA4	CA4	CA5	CA6	77.3°	90.0°
OA4	CA4	CA3	HA3	44.3°	90.0°
OA4	CA4	CA5	HA5	40.7°	90.0°
CA4	CA5	OA5	CA1	54.6°	90.0°
CA4	CA5	OA5	CA6	119.8°	90.0°
CA4	CA5	OA5	HA5	121.4°	90.0°
CA4	CA5	CA6	HA5	118.0°	90.0°
CA4	CA5	CA6	OA6	56.3°	90.0°
CA5	CA4	CA3	HA3	75.5°	90.0°
CA4	CA5	CA6	HA6S	176.3°	90.0°
CA4	CA5	CA6	HA6R	63.7°	90.0°
CA5	CA4	OA4	HOA4	141.4°	90.0°
CB2	CB3	CB4	HB3	120.1°	90.0°
CB3	CB2	CB1	HB2	121.3°	90.0°
CB2	CB3	CB4	OB4	172.6°	90.0°
CB3	CB2	CB1	OA6	172.8°	90.0°
CB3	CB2	CB1	OB5	52.9°	90.0°
CB2	CB3	CB4	CB5	52.8°	90.0°
CB3	CB2	CB1	HB1	67.7°	90.0°
CB3	CB2	NB2	HNB2	36.8°	90.0°
CB2	CB3	CB4	HB4	66.1°	90.0°
CB4	CB3	CB2	CB1	49.7°	90.0°
CB3	CB4	OB4	CB5	119.5°	90.0°
CB3	CB4	OB4	HB4	120.1°	90.0°
CB3	CB4	OB4	PB	136.7°	90.0°
CB3	CB4	CB5	HB4	119.0°	90.0°
CB3	CB4	CB5	OB5	58.3°	90.0°
CB3	CB4	CB5	CB6	178.4°	90.0°
CB4	CB3	CB2	HB2	71.5°	90.0°
CB3	CB4	CB5	HB5	61.7°	90.0°
CB2	CB1	OA6	OB5	121.3°	90.0°
CB2	CB1	OA6	HB1	118.6°	90.0°
CB2	CB1	OB5	HB1	119.6°	90.0°
CB2	CB1	OA6	CA6	169.0°	90.0°
CB2	CB1	OB5	CB5	61.4°	90.0°
CB1	CB2	NB2	HNB2	84.3°	90.0°
CB1	CB2	CB3	HB3	70.2°	90.0°
OA1	CA1	OA5	HA1	121.3°	90.0°
OA1	CA1	OA5	CA5	53.5°	90.0°
CA1	OA1	PA	OP5	87.3°	90.0°
CA1	OA1	PA	OP6	152.5°	90.0°
CA1	OA1	PA	OP7	32.6°	90.0°
OA1	CA1	CA2	HA2	173.7°	90.0°
OA5	CA1	OA1	PA	92.1°	90.0°
CA1	OA5	CA5	CA6	174.4°	90.0°
OA5	CA1	CA2	HA2	54.1°	90.0°
CA1	OA5	CA5	HA5	66.8°	90.0°
CB4	OB4	PB	OP4	138.0°	90.0°
OB4	CB4	CB5	HB4	121.7°	90.0°
CB4	OB4	PB	OP2	17.9°	90.0°
CB4	OB4	PB	OP3	102.5°	90.0°
OB4	CB4	CB5	OB5	177.7°	90.0°
OB4	CB4	CB5	CB6	62.3°	90.0°
OB4	CB4	CB3	HB3	52.5°	90.0°
OB4	CB4	CB5	HB5	57.7°	90.0°
OB4	PB	OP4	OP2	125.8°	90.0°
OB4	PB	OP4	OP3	124.9°	90.0°
PB	OB4	CB4	CB5	103.8°	90.0°
OB4	PB	OP2	OP3	125.5°	90.0°
PB	OB4	CB4	HB4	16.6°	90.0°
OB4	PB	OP2	H2	125.4°	90.0°
OB4	PB	OP3	H3	124.8°	90.0°
OA1	PA	OP5	OP6	125.4°	90.0°
OA1	PA	OP5	OP7	125.3°	90.0°
OA1	PA	OP6	OP7	125.3°	90.0°
PA	OA1	CA1	HA1	28.9°	90.0°
OA1	PA	OP6	H4	125.4°	90.0°
OA1	PA	OP7	H5	125.2°	90.0°
OP4	PB	OP2	OP3	109.1°	90.0°
OP4	PB	OP2	H2	0.0°	90.0°
OP4	PB	OP3	H3	0.0°	90.0°
OA6	CB1	OB5	HB1	120.0°	90.0°
CB1	OA6	CA6	CA5	127.9°	90.0°
OA6	CB1	OB5	CB5	178.2°	90.0°
OA6	CB1	CB2	HB2	51.5°	90.0°
CB1	OA6	CA6	HA6S	112.2°	90.0°
CB1	OA6	CA6	HA6R	7.8°	90.0°
CB1	OB5	CB5	CB4	64.4°	90.0°
OB5	CB1	OA6	CA6	69.7°	90.0°
CB1	OB5	CB5	CB6	175.3°	90.0°
OB5	CB1	CB2	HB2	68.4°	90.0°
CB1	OB5	CB5	HB5	54.7°	90.0°
CB4	CB5	OB5	CB6	120.3°	90.0°
CB4	CB5	OB5	HB5	119.2°	90.0°
CB4	CB5	CB6	HB5	119.7°	90.0°
CB4	CB5	CB6	OB6	166.6°	90.0°
CB5	CB4	CB3	HB3	67.3°	90.0°
CB4	CB5	CB6	HB6R	73.2°	90.0°
CB4	CB5	CB6	HB6S	46.3°	90.0°
OA5	CA5	CA6	HA5	120.0°	90.0°
OA5	CA5	CA6	OA6	65.7°	90.0°
CA5	OA5	CA1	HA1	174.8°	90.0°
OA5	CA5	CA4	HA4	76.6°	90.0°
OA5	CA5	CA6	HA6S	54.3°	90.0°
OA5	CA5	CA6	HA6R	174.3°	90.0°
CA5	CA6	OA6	HA6S	120.0°	90.0°
CA5	CA6	OA6	HA6R	120.0°	90.0°
CA6	CA5	CA4	HA4	43.0°	90.0°
CA5	CA6	HA6S	HA6R	120.0°	90.0°
CA6	OA6	CB1	HB1	50.4°	90.0°
OA6	CA6	CA5	HA5	174.3°	90.0°
OA6	CA6	HA6S	HA6R	120.0°	90.0°
OP5	PA	OP6	OP7	109.3°	90.0°
OP5	PA	OP6	H4	0.0°	90.0°
OP5	PA	OP7	H5	0.0°	90.0°
OP2	PB	OP3	H3	109.3°	90.0°
OP3	PB	OP2	H2	109.1°	90.0°
OB5	CB5	CB6	HB5	121.0°	90.0°
OB5	CB5	CB6	OB6	47.3°	90.0°
CB5	OB5	CB1	HB1	58.2°	90.0°
OB5	CB5	CB4	HB4	60.7°	90.0°
OB5	CB5	CB6	HB6R	167.5°	90.0°
OB5	CB5	CB6	HB6S	73.0°	90.0°
CB5	CB6	OB6	HB6R	120.3°	90.0°
CB5	CB6	OB6	HB6S	120.3°	90.0°
CB6	CB5	CB4	HB4	59.4°	90.0°
CB5	CB6	HB6R	HB6S	119.2°	90.0°
CB5	CB6	OB6	H1	180.0°	90.0°
OP6	PA	OP7	H5	109.5°	90.0°
OP7	PA	OP6	H4	109.3°	90.0°
OB6	CB6	CB5	HB5	73.7°	90.0°
OB6	CB6	HB6R	HB6S	119.3°	90.0°
HB1	CB1	CB2	HB2	171.0°	90.0°
HB2	CB2	NB2	HNB2	156.5°	90.0°
HB2	CB2	CB3	HB3	168.7°	90.0°
HB3	CB3	CB4	HB4	173.8°	90.0°
H12S	C12	C13	H13R	137.3°	90.0°
H12R	C12	C13	H13R	102.3°	90.0°
H13R	C13	C14	H14S	168.6°	90.0°
H13R	C13	C14	H14R	48.4°	90.0°
H14S	C14	C15	H15S	99.5°	90.0°
H14S	C14	C15	H15R	140.6°	90.0°
H14R	C14	C15	H15S	20.7°	90.0°
H14R	C14	C15	H15R	99.2°	90.0°
H15S	C15	C16	H16S	152.5°	90.0°
H15S	C15	C16	H16R	32.6°	90.0°
H15R	C15	C16	H16S	87.6°	90.0°
H15R	C15	C16	H16R	152.6°	90.0°
H16S	C16	C17	H17S	138.4°	90.0°
H16S	C16	C17	H17R	18.2°	90.0°
H16R	C16	C17	H17S	101.7°	90.0°
H16R	C16	C17	H17R	138.1°	90.0°
H17S	C17	C18	H18S	147.3°	90.0°
H17S	C17	C18	H18R	27.7°	90.0°
H17R	C17	C18	H18S	92.5°	90.0°
H17R	C17	C18	H18R	147.9°	90.0°
H18S	C18	C19	H19S	178.8°	90.0°
H18S	C18	C19	H19R	60.6°	90.0°
H18R	C18	C19	H19S	59.1°	90.0°
H18R	C18	C19	H19R	179.7°	90.0°
H19S	C19	CC1	H111	140.2°	90.0°
H19S	C19	CC1	H110	100.2°	90.0°
H19R	C19	CC1	H111	19.6°	90.0°
H19R	C19	CC1	H110	139.2°	90.0°
H22R	C22	C23	H23S	57.5°	90.0°
H22R	C22	C23	H23R	62.2°	90.0°
H22S	C22	C23	H23S	177.2°	90.0°
H22S	C22	C23	H23R	57.4°	90.0°
H23S	C23	C24	H24S	171.2°	90.0°
H23S	C23	C24	H24R	51.2°	90.0°
H23R	C23	C24	H24S	69.1°	90.0°
H23R	C23	C24	H24R	171.0°	90.0°
H24S	C24	C25	H25S	123.9°	90.0°
H24S	C24	C25	H25R	116.9°	90.0°
H24R	C24	C25	H25S	3.9°	90.0°
H24R	C24	C25	H25R	123.1°	90.0°
H25S	C25	C26	H26S	122.9°	90.0°
H25S	C25	C26	H26R	117.3°	90.0°
H25R	C25	C26	H26S	3.8°	90.0°
H25R	C25	C26	H26R	123.5°	90.0°
H26S	C26	C27	H27S	75.0°	90.0°
H26S	C26	C27	H27R	44.7°	90.0°
H26R	C26	C27	H27S	165.2°	90.0°
H26R	C26	C27	H27R	75.0°	90.0°
H27S	C27	C28	H28S	161.9°	90.0°
H27S	C27	C28	H28R	42.1°	90.0°
H27R	C27	C28	H28S	78.3°	90.0°
H27R	C27	C28	H28R	161.8°	90.0°
H28S	C28	C29	H29S	74.7°	90.0°
H28S	C28	C29	H29R	165.5°	90.0°
H28R	C28	C29	H29S	45.1°	90.0°
H28R	C28	C29	H29R	74.7°	90.0°
H29S	C29	CC6	H211	150.3°	90.0°
H29S	C29	CC6	H210	90.1°	90.0°
H29R	C29	CC6	H211	30.5°	90.0°
H29R	C29	CC6	H210	150.1°	90.0°
H32S	C32	C33	H33R	166.3°	90.0°
H32R	C32	C33	H33R	46.4°	90.0°
H33R	C33	C34	H34S	95.4°	90.0°
H33R	C33	C34	H34R	144.7°	90.0°
H33R	C33	O33	HO33	69.8°	90.0°
H34S	C34	C35	H35S	162.1°	90.0°
H34S	C34	C35	H35R	42.0°	90.0°
H34R	C34	C35	H35S	78.0°	90.0°
H34R	C34	C35	H35R	161.9°	90.0°
H35S	C35	C36	H36S	168.1°	90.0°
H35S	C35	C36	H36R	48.2°	90.0°
H35R	C35	C36	H36S	71.8°	90.0°
H35R	C35	C36	H36R	168.3°	90.0°
H36S	C36	C37	H37S	149.2°	90.0°
H36S	C36	C37	H37R	29.2°	90.0°
H36R	C36	C37	H37S	90.9°	90.0°
H36R	C36	C37	H37R	149.1°	90.0°
H37S	C37	C38	H38S	89.4°	90.0°
H37S	C37	C38	H38R	150.7°	90.0°
H37R	C37	C38	H38S	30.6°	90.0°
H37R	C37	C38	H38R	89.2°	90.0°
H38S	C38	C39	H39S	99.2°	90.0°
H38S	C38	C39	H39R	140.7°	90.0°
H38R	C38	C39	H39S	20.6°	90.0°
H38R	C38	C39	H39R	99.5°	90.0°
H39S	C39	CD4	H311	174.9°	90.0°
H39S	C39	CD4	H310	55.0°	90.0°
H39R	C39	CD4	H311	65.0°	90.0°
H39R	C39	CD4	H310	175.1°	90.0°
H52S	C52	C53	H53R	31.3°	90.0°
H52R	C52	C53	H53R	87.6°	90.0°
H53R	C53	C54	H54S	147.6°	90.0°
H53R	C53	C54	H54R	92.3°	90.0°
H54S	C54	C55	H55S	152.0°	90.0°
H54S	C54	C55	H55R	88.1°	90.0°
H54R	C54	C55	H55S	31.8°	90.0°
H54R	C54	C55	H55R	151.7°	90.0°
H55S	C55	C56	H56S	98.5°	90.0°
H55S	C55	C56	H56R	21.3°	90.0°
H55R	C55	C56	H56S	141.6°	90.0°
H55R	C55	C56	H56R	98.5°	90.0°
H56S	C56	C57	H57S	99.9°	90.0°
H56S	C56	C57	H57R	19.9°	90.0°
H56R	C56	C57	H57S	140.3°	90.0°
H56R	C56	C57	H57R	100.0°	90.0°
H57S	C57	C58	H58S	69.0°	90.0°
H57S	C57	C58	H58R	171.3°	90.0°
H57R	C57	C58	H58S	50.7°	90.0°
H57R	C57	C58	H58R	69.0°	90.0°
H58S	C58	C59	H59S	175.3°	90.0°
H58S	C58	C59	H59R	64.5°	90.0°
H58R	C58	C59	H59S	55.6°	90.0°
H58R	C58	C59	H59R	175.9°	90.0°
H59S	C59	CD9	H510	170.7°	90.0°
H59S	C59	CD9	H511	56.8°	90.0°
H59R	C59	CD9	H510	69.0°	90.0°
H59R	C59	CD9	H511	177.1°	90.0°
H62S	C62	C63	H63S	176.2°	90.0°
H62S	C62	C63	H63R	63.7°	90.0°
H62R	C62	C63	H63S	56.5°	90.0°
H62R	C62	C63	H63R	176.6°	90.0°
H63S	C63	C64	H64S	177.1°	90.0°
H63S	C63	C64	H64R	57.5°	90.0°
H63R	C63	C64	H64S	62.7°	90.0°
H63R	C63	C64	H64R	177.7°	90.0°
H64S	C64	C65	H65S	158.7°	90.0°
H64S	C64	C65	H65R	38.2°	90.0°
H64R	C64	C65	H65S	81.8°	90.0°
H64R	C64	C65	H65R	157.7°	90.0°
H65S	C65	C66	H66S	155.8°	90.0°
H65S	C65	C66	H66R	36.3°	90.0°
H65R	C65	C66	H66S	83.8°	90.0°
H65R	C65	C66	H66R	156.8°	90.0°
H66S	C66	C67	H67S	162.8°	90.0°
H66S	C66	C67	H67R	76.8°	90.0°
H66R	C66	C67	H67S	43.3°	90.0°
H66R	C66	C67	H67R	163.7°	90.0°
H67S	C67	C68	H68S	165.6°	90.0°
H67S	C67	C68	H68R	74.7°	90.0°
H67R	C67	C68	H68S	45.3°	90.0°
H67R	C67	C68	H68R	164.9°	90.0°
H68S	C68	C69	H69S	178.8°	90.0°
H68S	C68	C69	H69R	61.0°	90.0°
H68R	C68	C69	H69S	59.1°	90.0°
H68R	C68	C69	H69R	179.4°	90.0°
H69S	C69	CE5	H611	128.7°	90.0°
H69S	C69	CE5	H610	111.7°	90.0°
H69R	C69	CE5	H611	8.5°	90.0°
H69R	C69	CE5	H610	128.1°	90.0°
H72S	C72	C73	H73R	85.2°	90.0°
H72R	C72	C73	H73R	35.1°	90.0°
H73R	C73	C74	H74S	140.5°	90.0°
H73R	C73	C74	H74R	99.7°	90.0°
H74S	C74	C75	H75S	172.7°	90.0°
H74S	C74	C75	H75R	52.8°	90.0°
H74R	C74	C75	H75S	67.5°	90.0°
H74R	C74	C75	H75R	172.6°	90.0°
H75S	C75	C76	H76S	135.6°	90.0°
H75S	C75	C76	H76R	15.8°	90.0°
H75R	C75	C76	H76S	104.5°	90.0°
H75R	C75	C76	H76R	135.7°	90.0°
H76S	C76	C77	H77S	85.2°	90.0°
H76S	C76	C77	H77R	155.1°	90.0°
H76R	C76	C77	H77S	34.6°	90.0°
H76R	C76	C77	H77R	85.1°	90.0°
H77S	C77	C78	H78S	162.1°	90.0°
H77S	C77	C78	H78R	42.0°	90.0°
H77R	C77	C78	H78S	78.2°	90.0°
H77R	C77	C78	H78R	161.7°	90.0°
H78S	C78	C79	H79S	165.3°	90.0°
H78S	C78	C79	H79R	45.3°	90.0°
H78R	C78	C79	H79S	74.6°	90.0°
H78R	C78	C79	H79R	165.4°	90.0°
H79S	C79	CE8	H711	178.2°	90.0°
H79S	C79	CE8	H710	58.3°	90.0°
H79R	C79	CE8	H711	61.8°	90.0°
H79R	C79	CE8	H710	178.3°	90.0°
H82S	C82	C83	H83S	91.6°	90.0°
H82S	C82	C83	H83R	148.8°	90.0°
H82R	C82	C83	H83S	28.2°	90.0°
H82R	C82	C83	H83R	91.4°	90.0°
H83S	C83	C84	H84S	155.2°	90.0°
H83S	C83	C84	H84R	84.5°	90.0°
H83R	C83	C84	H84S	35.7°	90.0°
H83R	C83	C84	H84R	155.9°	90.0°
H84S	C84	C85	H85S	178.1°	90.0°
H84S	C84	C85	H85R	62.0°	90.0°
H84R	C84	C85	H85S	57.8°	90.0°
H84R	C84	C85	H85R	177.7°	90.0°
H85S	C85	C86	H86S	168.1°	90.0°
H85S	C85	C86	H86R	71.9°	90.0°
H85R	C85	C86	H86S	48.2°	90.0°
H85R	C85	C86	H86R	168.2°	90.0°
H86S	C86	C87	H87S	112.9°	90.0°
H86S	C86	C87	H87R	127.2°	90.0°
H86R	C86	C87	H87S	7.1°	90.0°
H86R	C86	C87	H87R	112.8°	90.0°
H87S	C87	C88	H88S	177.4°	90.0°
H87S	C87	C88	H88R	62.6°	90.0°
H87R	C87	C88	H88S	57.4°	90.0°
H87R	C87	C88	H88R	177.5°	90.0°
H88S	C88	C89	H89S	95.5°	90.0°
H88S	C88	C89	H89R	144.6°	90.0°
H88R	C88	C89	H89S	24.5°	90.0°
H88R	C88	C89	H89R	95.4°	90.0°
H89S	C89	CF4	H811	175.3°	90.0°
H89S	C89	CF4	H810	55.2°	90.0°
H89R	C89	CF4	H811	64.8°	90.0°
H89R	C89	CF4	H810	175.1°	90.0°
HA1	CA1	CA2	HA2	65.1°	90.0°
HA2	CA2	CA3	HA3	176.4°	90.0°
HA2	CA2	NA2	HNA2	173.1°	90.0°
HA3	CA3	CA4	HA4	164.6°	90.0°
HA4	CA4	CA5	HA5	161.0°	90.0°
HA4	CA4	OA4	HOA4	99.8°	90.0°
HA5	CA5	CA6	HA6S	65.7°	90.0°
HA5	CA5	CA6	HA6R	54.3°	90.0°
HB4	CB4	CB5	HB5	179.4°	90.0°
HB5	CB5	CB6	HB6R	46.5°	90.0°
HB5	CB5	CB6	HB6S	166.0°	90.0°
HB6R	CB6	OB6	H1	59.7°	90.0°
HB6S	CB6	OB6	H1	59.8°	90.0°
H111	CC1	CC2	H113	85.5°	90.0°
H111	CC1	CC2	H112	154.4°	90.0°
H110	CC1	CC2	H113	34.0°	90.0°
H110	CC1	CC2	H112	86.0°	90.0°
H113	CC2	CC3	H115	164.2°	90.0°
H113	CC2	CC3	H114	43.9°	90.0°
H112	CC2	CC3	H115	75.7°	90.0°
H112	CC2	CC3	H114	164.0°	90.0°
H115	CC3	CC4	H117	162.5°	90.0°
H115	CC3	CC4	H116	42.6°	90.0°
H114	CC3	CC4	H117	77.2°	90.0°
H114	CC3	CC4	H116	163.0°	90.0°
H117	CC4	CC5	H119	60.0°	90.0°
H117	CC4	CC5	H120	60.1°	90.0°
H117	CC4	CC5	H118	180.0°	90.0°
H116	CC4	CC5	H119	59.9°	90.0°
H116	CC4	CC5	H120	180.0°	90.0°
H116	CC4	CC5	H118	60.1°	90.0°
H119	CC5	H120	H118	120.0°	90.0°
H211	CC6	CC7	H213	55.9°	90.0°
H211	CC6	CC7	H212	175.5°	90.0°
H210	CC6	CC7	H213	63.7°	90.0°
H210	CC6	CC7	H212	55.9°	90.0°
H213	CC7	CC8	H215	148.9°	90.0°
H213	CC7	CC8	H214	91.0°	90.0°
H212	CC7	CC8	H215	29.3°	90.0°
H212	CC7	CC8	H214	149.5°	90.0°
H215	CC8	CC9	H217	169.7°	90.0°
H215	CC8	CC9	H216	70.7°	90.0°
H214	CC8	CC9	H217	49.5°	90.0°
H214	CC8	CC9	H216	169.1°	90.0°
H217	CC9	CD1	H219	88.2°	90.0°
H217	CC9	CD1	H218	151.9°	90.0°
H216	CC9	CD1	H219	31.5°	90.0°
H216	CC9	CD1	H218	88.4°	90.0°
H219	CD1	CD2	H221	161.3°	90.0°
H219	CD1	CD2	H220	41.4°	90.0°
H218	CD1	CD2	H221	78.8°	90.0°
H218	CD1	CD2	H220	161.3°	90.0°
H221	CD2	CD3	H222	60.0°	90.0°
H221	CD2	CD3	H223	60.1°	90.0°
H221	CD2	CD3	H224	180.0°	90.0°
H220	CD2	CD3	H222	59.9°	90.0°
H220	CD2	CD3	H223	180.0°	90.0°
H220	CD2	CD3	H224	60.1°	90.0°
H222	CD3	H223	H224	120.0°	90.0°
H311	CD4	CD5	H313	152.2°	90.0°
H311	CD4	CD5	H312	32.1°	90.0°
H310	CD4	CD5	H313	87.9°	90.0°
H310	CD4	CD5	H312	152.0°	90.0°
H313	CD5	CD6	H315	152.9°	90.0°
H313	CD5	CD6	H314	33.3°	90.0°
H312	CD5	CD6	H315	87.1°	90.0°
H312	CD5	CD6	H314	153.3°	90.0°
H315	CD6	CD7	H316	34.7°	90.0°
H315	CD6	CD7	H317	85.3°	90.0°
H314	CD6	CD7	H316	85.0°	90.0°
H314	CD6	CD7	H317	155.1°	90.0°
H316	CD7	CD8	H319	60.0°	90.0°
H316	CD7	CD8	H320	180.0°	90.0°
H316	CD7	CD8	H318	60.0°	90.0°
H317	CD7	CD8	H319	60.0°	90.0°
H317	CD7	CD8	H320	60.0°	90.0°
H317	CD7	CD8	H318	180.0°	90.0°
H319	CD8	H320	H318	120.0°	90.0°
H510	CD9	CE1	H513	16.5°	90.0°
H510	CD9	CE1	H512	135.9°	90.0°
H511	CD9	CE1	H513	97.5°	90.0°
H511	CD9	CE1	H512	22.0°	90.0°
H513	CE1	CE2	H515	157.2°	90.0°
H513	CE1	CE2	H514	37.0°	90.0°
H512	CE1	CE2	H515	83.3°	90.0°
H512	CE1	CE2	H514	156.4°	90.0°
H515	CE2	CE3	H517	160.6°	90.0°
H515	CE2	CE3	H516	40.7°	90.0°
H514	CE2	CE3	H517	79.2°	90.0°
H514	CE2	CE3	H516	160.9°	90.0°
H517	CE3	CE4	H518	59.9°	90.0°
H517	CE3	CE4	H519	60.1°	90.0°
H517	CE3	CE4	H520	179.9°	90.0°
H516	CE3	CE4	H518	60.0°	90.0°
H516	CE3	CE4	H519	180.0°	90.0°
H516	CE3	CE4	H520	60.1°	90.0°
H518	CE4	H519	H520	120.0°	90.0°
H611	CE5	CE6	H613	163.5°	90.0°
H611	CE5	CE6	H612	43.5°	90.0°
H610	CE5	CE6	H613	76.8°	90.0°
H610	CE5	CE6	H612	163.2°	90.0°
H613	CE6	CE7	H614	60.0°	90.0°
H613	CE6	CE7	H615	60.0°	90.0°
H613	CE6	CE7	H616	180.0°	90.0°
H612	CE6	CE7	H614	60.0°	90.0°
H612	CE6	CE7	H615	180.0°	90.0°
H612	CE6	CE7	H616	60.0°	90.0°
H614	CE7	H615	H616	120.0°	90.0°
H711	CE8	CE9	H714	163.3°	90.0°
H711	CE8	CE9	H713	76.7°	90.0°
H710	CE8	CE9	H714	43.4°	90.0°
H710	CE8	CE9	H713	163.4°	90.0°
H714	CE9	CF1	H716	145.7°	90.0°
H714	CE9	CF1	H715	94.4°	90.0°
H713	CE9	CF1	H716	25.7°	90.0°
H713	CE9	CF1	H715	145.6°	90.0°
H716	CF1	CF2	H718	157.5°	90.0°
H716	CF1	CF2	H717	82.5°	90.0°
H715	CF1	CF2	H718	37.6°	90.0°
H715	CF1	CF2	H717	157.6°	90.0°
H718	CF2	CF3	H721	60.0°	90.0°
H718	CF2	CF3	H719	60.0°	90.0°
H718	CF2	CF3	H720	180.0°	90.0°
H717	CF2	CF3	H721	60.0°	90.0°
H717	CF2	CF3	H719	180.0°	90.0°
H717	CF2	CF3	H720	60.1°	90.0°
H721	CF3	H719	H720	120.0°	90.0°
H811	CF4	CF5	H813	175.2°	90.0°
H811	CF4	CF5	H812	64.8°	90.0°
H810	CF4	CF5	H813	55.2°	90.0°
H810	CF4	CF5	H812	175.1°	90.0°
H813	CF5	CF6	H815	148.2°	90.0°
H813	CF5	CF6	H814	91.7°	90.0°
H812	CF5	CF6	H815	28.3°	90.0°
H812	CF5	CF6	H814	148.4°	90.0°
H815	CF6	CF7	H817	167.6°	90.0°
H815	CF6	CF7	H816	72.5°	90.0°
H814	CF6	CF7	H817	47.5°	90.0°
H814	CF6	CF7	H816	167.4°	90.0°
H817	CF7	CF8	H818	59.9°	90.0°
H817	CF7	CF8	H819	60.1°	90.0°
H817	CF7	CF8	H820	180.0°	90.0°
H816	CF7	CF8	H818	60.0°	90.0°
H816	CF7	CF8	H819	180.0°	90.0°
H816	CF7	CF8	H820	60.1°	90.0°
H818	CF8	H819	H820	120.0°	90.0°

Release date:	2021-05-05
Definition date:	2021-01-11
Last modified:	2021-04-30
Release status:	REL
Processing site:	PDBE
Derived from:	7BGL