SIK

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
O6	C13	doub	0.00Å	1.22Å
C13	C11	sing	0.00Å	1.52Å
C13	N3	sing	0.00Å	1.35Å
C11	C12	sing	0.00Å	1.54Å
C11	N2	sing	0.00Å	1.47Å
C12	S2	sing	0.00Å	1.67Å
S2	O5	doub	0.00Å	1.47Å
S2	O2	doub	0.00Å	1.47Å
S2	O1	sing	0.00Å	1.46Å
N2	C3	sing	0.00Å	1.34Å
C3	O3	doub	0.00Å	1.21Å
C3	C2	sing	0.00Å	1.51Å
C2	C1	sing	0.00Å	1.53Å
C1	C6	sing	0.00Å	1.53Å
C6	C5	sing	0.00Å	1.53Å
C5	C7	sing	0.00Å	1.53Å
C7	C4	sing	0.00Å	1.52Å
C7	S1	sing	0.00Å	1.76Å
C4	C9	sing	0.00Å	1.52Å
C4	N5	sing	0.00Å	1.45Å
C9	C8	sing	0.00Å	1.51Å
C9	N1	sing	0.00Å	1.44Å
C8	S1	sing	0.00Å	1.76Å
N5	C10	sing	0.00Å	1.33Å
C10	O4	doub	0.00Å	1.21Å
C10	N1	sing	0.00Å	1.32Å
N3	C14	sing	0.00Å	1.46Å
C14	C15	sing	0.00Å	1.53Å
C15	C34	doub	0.00Å	1.50Å
C15	C16	sing	0.00Å	1.48Å
C34	N4	sing	0.00Å	1.36Å
C34	C33	sing	0.00Å	1.40Å
N4	FE1	sing	0.00Å	2.09Å
N4	C31	sing	0.00Å	1.33Å
FE1	N8	doub	0.00Å	2.09Å
FE1	N7	sing	0.00Å	2.09Å
FE1	N6	sing	0.00Å	2.08Å
N8	C29	sing	0.00Å	1.33Å	Aromatic
N8	C26	sing	0.00Å	1.35Å	Aromatic
N7	C22	sing	0.00Å	1.35Å
N7	C21	sing	0.00Å	1.32Å
N6	C17	sing	0.00Å	1.32Å	Aromatic
N6	C16	sing	0.00Å	1.35Å	Aromatic
C33	C32	doub	0.00Å	1.38Å
C32	C31	sing	0.00Å	1.37Å
C31	C30	doub	0.00Å	1.49Å
C30	C29	sing	0.00Å	1.49Å
C29	C28	doub	0.00Å	1.37Å	Aromatic
C28	C27	sing	0.00Å	1.38Å	Aromatic
C27	C26	doub	0.00Å	1.40Å	Aromatic
C26	C25	sing	0.00Å	1.49Å
C25	C22	doub	0.00Å	1.49Å
C25	C35	sing	0.00Å	1.52Å
C22	C23	sing	0.00Å	1.40Å
C23	C24	doub	0.00Å	1.37Å
C24	C21	sing	0.00Å	1.36Å
C21	C20	doub	0.00Å	1.46Å
C20	C17	sing	0.00Å	1.47Å
C17	C18	doub	0.00Å	1.36Å	Aromatic
C18	C19	sing	0.00Å	1.37Å	Aromatic
C19	C16	doub	0.00Å	1.39Å	Aromatic
C35	N9	sing	0.00Å	1.45Å
N9	C36	sing	0.00Å	1.32Å
C36	O7	doub	0.00Å	1.22Å
C36	C37	sing	0.00Å	1.51Å
C37	C38	sing	0.00Å	1.55Å
C37	N10	sing	0.00Å	1.47Å
C38	S3	sing	0.00Å	1.67Å
S3	O10	doub	0.00Å	1.47Å
S3	O9	doub	0.00Å	1.47Å
S3	O8	sing	0.00Å	1.48Å
N10	C39	sing	0.00Å	1.33Å
C39	O11	doub	0.00Å	1.21Å
C39	C40	sing	0.00Å	1.51Å
C40	C41	sing	0.00Å	1.53Å
C41	C42	sing	0.00Å	1.52Å
C42	C43	sing	0.00Å	1.53Å
C43	C44	sing	0.00Å	1.52Å
C44	C47	sing	0.00Å	1.52Å
C44	S4	sing	0.00Å	1.76Å
C47	C46	sing	0.00Å	1.52Å
C47	N11	sing	0.00Å	1.45Å
C46	C45	sing	0.00Å	1.52Å
C46	N12	sing	0.00Å	1.43Å
C45	S4	sing	0.00Å	1.76Å
N11	C48	sing	0.00Å	1.33Å
C48	O12	doub	0.00Å	1.21Å
C48	N12	sing	0.00Å	1.32Å
N1	H1	sing	0.00Å	1.00Å
C2	H4	sing	0.00Å	1.10Å
C2	H5	sing	0.00Å	1.10Å
C4	H7	sing	0.00Å	1.10Å
C5	H8	sing	0.00Å	1.10Å
C5	H9	sing	0.00Å	1.10Å
C6	H11	sing	0.00Å	1.10Å
C6	H10	sing	0.00Å	1.10Å
C1	H3	sing	0.00Å	1.10Å
C1	H2	sing	0.00Å	1.10Å
C11	H110	sing	0.00Å	1.10Å
C12	H19	sing	0.00Å	1.10Å
C12	H20	sing	0.00Å	1.10Å
C14	H22	sing	0.00Å	1.10Å
C14	H21	sing	0.00Å	1.10Å
C18	H23	sing	0.00Å	1.08Å
C19	H24	sing	0.00Å	1.08Å
C20	H25	sing	0.00Å	1.08Å
C23	H26	sing	0.00Å	1.08Å
C24	H27	sing	0.00Å	1.08Å
C27	H28	sing	0.00Å	1.08Å
C28	H29	sing	0.00Å	1.08Å
C30	H30	sing	0.00Å	1.08Å
C32	H31	sing	0.00Å	1.08Å
C33	H32	sing	0.00Å	1.08Å
C35	H34	sing	0.00Å	1.10Å
C35	H33	sing	0.00Å	1.10Å
C37	H38	sing	0.00Å	1.10Å
C38	H37	sing	0.00Å	1.10Å
C38	H36	sing	0.00Å	1.10Å
C40	H40	sing	0.00Å	1.10Å
C40	H41	sing	0.00Å	1.10Å
C41	H43	sing	0.00Å	1.10Å
C41	H42	sing	0.00Å	1.10Å
C42	H45	sing	0.00Å	1.10Å
C42	H44	sing	0.00Å	1.10Å
C43	H46	sing	0.00Å	1.10Å
C43	H47	sing	0.00Å	1.10Å
C44	H48	sing	0.00Å	1.10Å
C45	H50	sing	0.00Å	1.10Å
C45	H49	sing	0.00Å	1.10Å
C46	H52	sing	0.00Å	1.10Å
C47	H51	sing	0.00Å	1.10Å
C7	H13	sing	0.00Å	1.10Å
C8	H15	sing	0.00Å	1.10Å
C8	H14	sing	0.00Å	1.10Å
C9	H16	sing	0.00Å	1.10Å
N10	H39	sing	0.00Å	1.00Å
N11	H54	sing	0.00Å	1.00Å
N12	H53	sing	0.00Å	1.00Å
N2	H6	sing	0.00Å	1.00Å
N3	H12	sing	0.00Å	1.00Å
N5	H17	sing	0.00Å	1.00Å
N9	H35	sing	0.00Å	1.00Å
O1	H18	sing	0.00Å	0.95Å
O8	H55	sing	0.00Å	0.95Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
O6	C13	C11	119.9°	90.0°
O6	C13	N3	123.0°	90.0°
C11	C13	N3	117.1°	90.0°
C13	C11	C12	108.0°	90.0°
C13	C11	N2	114.3°	90.0°
C13	C11	H110	107.1°	90.0°
C13	N3	C14	123.0°	90.0°
C13	N3	H12	118.5°	90.0°
C12	C11	N2	112.7°	90.0°
C11	C12	S2	115.3°	90.0°
C12	C11	H110	106.8°	90.0°
C11	C12	H19	108.0°	90.0°
C11	C12	H20	108.0°	90.0°
C11	N2	C3	122.0°	90.0°
N2	C11	H110	107.6°	90.0°
C11	N2	H6	119.0°	90.0°
C12	S2	O5	107.5°	90.0°
C12	S2	O2	112.9°	90.0°
C12	S2	O1	110.0°	90.0°
S2	C12	H19	108.0°	90.0°
S2	C12	H20	108.0°	90.0°
O5	S2	O2	107.2°	90.0°
O5	S2	O1	109.3°	90.0°
O2	S2	O1	109.8°	90.0°
S2	O1	H18	109.5°	90.0°
N2	C3	O3	121.9°	90.0°
N2	C3	C2	121.1°	90.0°
C3	N2	H6	119.0°	90.0°
O3	C3	C2	117.1°	90.0°
C3	C2	C1	112.0°	90.0°
C3	C2	H4	108.8°	90.0°
C3	C2	H5	108.8°	90.0°
C2	C1	C6	113.3°	90.0°
C1	C2	H4	108.8°	90.0°
C1	C2	H5	108.9°	90.0°
C2	C1	H3	108.5°	90.0°
C2	C1	H2	108.5°	90.0°
C1	C6	C5	113.5°	90.0°
C1	C6	H11	108.5°	90.0°
C1	C6	H10	108.4°	90.0°
C6	C1	H3	108.5°	90.0°
C6	C1	H2	108.5°	90.0°
C6	C5	C7	111.7°	90.0°
C6	C5	H8	108.9°	90.0°
C6	C5	H9	108.9°	90.0°
C5	C6	H11	108.4°	90.0°
C5	C6	H10	108.5°	90.0°
C5	C7	C4	115.0°	90.0°
C5	C7	S1	113.3°	90.0°
C7	C5	H8	108.9°	90.0°
C7	C5	H9	108.9°	90.0°
C5	C7	H13	109.9°	90.0°
C4	C7	S1	101.1°	90.0°
C7	C4	C9	110.9°	90.0°
C7	C4	N5	114.1°	90.0°
C7	C4	H7	109.5°	90.0°
C4	C7	H13	109.9°	90.0°
C7	S1	C8	97.3°	90.0°
S1	C7	H13	107.1°	90.0°
C9	C4	N5	101.9°	90.0°
C4	C9	C8	112.1°	90.0°
C4	C9	N1	103.2°	90.0°
C9	C4	H7	109.5°	90.0°
C4	C9	H16	110.0°	90.0°
C4	N5	C10	113.1°	90.0°
N5	C4	H7	110.6°	90.0°
C4	N5	H17	123.5°	90.0°
C8	C9	N1	109.9°	90.0°
C9	C8	S1	102.5°	90.0°
C9	C8	H15	111.2°	90.0°
C9	C8	H14	111.2°	90.0°
C8	C9	H16	110.2°	90.0°
C9	N1	C10	112.8°	90.0°
C9	N1	H1	123.6°	90.0°
N1	C9	H16	111.3°	90.0°
S1	C8	H15	111.2°	90.0°
S1	C8	H14	111.2°	90.0°
N5	C10	O4	126.5°	90.0°
N5	C10	N1	108.8°	90.0°
C10	N5	H17	123.5°	90.0°
O4	C10	N1	124.7°	90.0°
C10	N1	H1	123.6°	90.0°
N3	C14	C15	115.5°	90.0°
N3	C14	H22	108.0°	90.0°
N3	C14	H21	107.9°	90.0°
C14	N3	H12	118.5°	90.0°
C14	C15	C34	122.8°	90.0°
C14	C15	C16	116.7°	90.0°
C15	C14	H22	107.9°	90.0°
C15	C14	H21	107.9°	90.0°
C34	C15	C16	120.4°	90.0°
C15	C34	N4	126.5°	90.0°
C15	C34	C33	125.0°	90.0°
C15	C16	N6	126.6°	90.0°
C15	C16	C19	123.5°	90.0°
N4	C34	C33	108.5°	90.0°
C34	N4	FE1	128.5°	90.0°
C34	N4	C31	105.7°	90.0°
C34	C33	C32	108.2°	90.0°
C34	C33	H32	125.9°	90.0°
FE1	N4	C31	125.8°	90.0°
N4	FE1	N8	91.8°	90.0°
N4	FE1	N7	178.6°	90.0°
N4	FE1	N6	88.4°	90.0°
N4	C31	C32	113.7°	90.0°
N4	C31	C30	126.0°	90.0°
N8	FE1	N7	89.1°	90.0°
N8	FE1	N6	179.1°	90.0°
FE1	N8	C29	126.4°	90.0°
FE1	N8	C26	127.7°	90.0°
N7	FE1	N6	90.7°	90.0°
FE1	N7	C22	129.0°	90.0°
FE1	N7	C21	126.8°	90.0°
FE1	N6	C17	126.1°	90.0°
FE1	N6	C16	129.3°	90.0°
C29	N8	C26	105.9°	90.0°
N8	C29	C30	125.5°	90.0°
N8	C29	C28	113.5°	90.0°
N8	C26	C27	108.7°	90.0°
N8	C26	C25	126.4°	90.0°
C22	N7	C21	104.2°	90.0°
N7	C22	C25	125.1°	90.0°
N7	C22	C23	109.1°	90.0°
N7	C21	C24	115.7°	90.0°
N7	C21	C20	125.3°	90.0°
C17	N6	C16	104.6°	90.0°
N6	C17	C20	126.4°	90.0°
N6	C17	C18	114.2°	90.0°
N6	C16	C19	109.9°	90.0°
C33	C32	C31	103.8°	90.0°
C33	C32	H31	128.1°	90.0°
C32	C33	H32	125.9°	90.0°
C32	C31	C30	120.3°	90.0°
C31	C32	H31	128.1°	90.0°
C31	C30	C29	124.4°	90.0°
C31	C30	H30	117.8°	90.0°
C30	C29	C28	121.0°	90.0°
C29	C30	H30	117.8°	90.0°
C29	C28	C27	103.8°	90.0°
C29	C28	H29	128.1°	90.0°
C28	C27	C26	108.0°	90.0°
C28	C27	H28	126.0°	90.0°
C27	C28	H29	128.1°	90.0°
C27	C26	C25	124.8°	90.0°
C26	C27	H28	126.0°	90.0°
C26	C25	C22	121.8°	90.0°
C26	C25	C35	119.7°	90.0°
C22	C25	C35	118.2°	90.0°
C25	C22	C23	125.7°	90.0°
C25	C35	N9	114.5°	90.0°
C25	C35	H34	108.2°	90.0°
C25	C35	H33	108.2°	90.0°
C22	C23	C24	108.2°	90.0°
C22	C23	H26	125.9°	90.0°
C23	C24	C21	102.7°	90.0°
C24	C23	H26	125.9°	90.0°
C23	C24	H27	128.6°	90.0°
C24	C21	C20	119.0°	90.0°
C21	C24	H27	128.7°	90.0°
C21	C20	C17	124.5°	90.0°
C21	C20	H25	117.7°	90.0°
C20	C17	C18	119.4°	90.0°
C17	C20	H25	117.8°	90.0°
C17	C18	C19	104.7°	90.0°
C17	C18	H23	127.6°	90.0°
C18	C19	C16	106.6°	90.0°
C19	C18	H23	127.6°	90.0°
C18	C19	H24	126.7°	90.0°
C16	C19	H24	126.7°	90.0°
C35	N9	C36	124.1°	90.0°
N9	C35	H34	108.2°	90.0°
N9	C35	H33	108.2°	90.0°
C35	N9	H35	117.9°	90.0°
N9	C36	O7	123.4°	90.0°
N9	C36	C37	112.5°	90.0°
C36	N9	H35	118.0°	90.0°
O7	C36	C37	124.1°	90.0°
C36	C37	C38	114.5°	90.0°
C36	C37	N10	114.7°	90.0°
C36	C37	H38	106.2°	90.0°
C38	C37	N10	108.4°	90.0°
C37	C38	S3	121.3°	90.0°
C38	C37	H38	105.8°	90.0°
C37	C38	H37	106.4°	90.0°
C37	C38	H36	106.5°	90.0°
C37	N10	C39	127.7°	90.0°
N10	C37	H38	106.6°	90.0°
C37	N10	H39	116.1°	90.0°
C38	S3	O10	109.6°	90.0°
C38	S3	O9	106.5°	90.0°
C38	S3	O8	113.3°	90.0°
S3	C38	H37	106.4°	90.0°
S3	C38	H36	106.4°	90.0°
O10	S3	O9	108.4°	90.0°
O10	S3	O8	111.0°	90.0°
O9	S3	O8	107.8°	90.0°
S3	O8	H55	109.5°	90.0°
N10	C39	O11	125.8°	90.0°
N10	C39	C40	114.2°	90.0°
C39	N10	H39	116.2°	90.0°
O11	C39	C40	120.0°	90.0°
C39	C40	C41	112.3°	90.0°
C39	C40	H40	108.8°	90.0°
C39	C40	H41	108.8°	90.0°
C40	C41	C42	111.6°	90.0°
C41	C40	H40	108.8°	90.0°
C41	C40	H41	108.8°	90.0°
C40	C41	H43	108.9°	90.0°
C40	C41	H42	108.9°	90.0°
C41	C42	C43	111.5°	90.0°
C42	C41	H43	108.9°	90.0°
C42	C41	H42	108.9°	90.0°
C41	C42	H45	109.0°	90.0°
C41	C42	H44	109.0°	90.0°
C42	C43	C44	110.2°	90.0°
C43	C42	H45	108.9°	90.0°
C43	C42	H44	108.9°	90.0°
C42	C43	H46	109.3°	90.0°
C42	C43	H47	109.3°	90.0°
C43	C44	C47	115.3°	90.0°
C43	C44	S4	112.2°	90.0°
C44	C43	H46	109.3°	90.0°
C44	C43	H47	109.3°	90.0°
C43	C44	H48	110.0°	90.0°
C47	C44	S4	101.5°	90.0°
C44	C47	C46	110.4°	90.0°
C44	C47	N11	114.6°	90.0°
C47	C44	H48	110.1°	90.0°
C44	C47	H51	109.6°	90.0°
C44	S4	C45	96.9°	90.0°
S4	C44	H48	107.2°	90.0°
C46	C47	N11	101.9°	90.0°
C47	C46	C45	112.2°	90.0°
C47	C46	N12	103.1°	90.0°
C47	C46	H52	110.1°	90.0°
C46	C47	H51	109.5°	90.0°
C47	N11	C48	113.1°	90.0°
N11	C47	H51	110.6°	90.0°
C47	N11	H54	123.4°	90.0°
C45	C46	N12	109.8°	90.0°
C46	C45	S4	102.8°	90.0°
C46	C45	H50	111.1°	90.0°
C46	C45	H49	111.1°	90.0°
C45	C46	H52	110.2°	90.0°
C46	N12	C48	112.9°	90.0°
N12	C46	H52	111.3°	90.0°
C46	N12	H53	123.6°	90.0°
S4	C45	H50	111.1°	90.0°
S4	C45	H49	111.1°	90.0°
N11	C48	O12	126.4°	90.0°
N11	C48	N12	108.7°	90.0°
C48	N11	H54	123.4°	90.0°
O12	C48	N12	124.9°	90.0°
C48	N12	H53	123.5°	90.0°
H4	C2	H5	109.4°	90.0°
H8	C5	H9	109.4°	90.0°
H11	C6	H10	109.4°	90.0°
H3	C1	H2	109.5°	90.0°
H19	C12	H20	109.5°	90.0°
H22	C14	H21	109.5°	90.0°
H34	C35	H33	109.5°	90.0°
H37	C38	H36	109.5°	90.0°
H40	C40	H41	109.4°	90.0°
H43	C41	H42	109.5°	90.0°
H45	C42	H44	109.5°	90.0°
H46	C43	H47	109.5°	90.0°
H50	C45	H49	109.5°	90.0°
H15	C8	H14	109.5°	90.0°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
O6	C13	C11	N3	177.5°	90.0°
O6	C13	C11	C12	113.4°	90.0°
O6	C13	C11	N2	12.9°	90.0°
O6	C13	N3	C14	4.8°	90.0°
O6	C13	C11	H110	132.0°	90.0°
O6	C13	N3	H12	175.2°	90.0°
C13	C11	C12	N2	127.2°	90.0°
C13	C11	C12	H110	114.9°	90.0°
C13	C11	N2	H110	118.7°	90.0°
C13	C11	C12	S2	36.5°	90.0°
C13	C11	N2	C3	173.4°	90.0°
C11	C13	N3	C14	172.6°	90.0°
C13	C11	C12	H19	84.4°	90.0°
C13	C11	C12	H20	157.3°	90.0°
C13	C11	N2	H6	6.6°	90.0°
C11	C13	N3	H12	7.3°	90.0°
N3	C13	C11	C12	64.1°	90.0°
N3	C13	C11	N2	169.5°	90.0°
C13	N3	C14	H12	180.0°	90.0°
C13	N3	C14	C15	160.1°	90.0°
N3	C13	C11	H110	50.5°	90.0°
C13	N3	C14	H22	79.0°	90.0°
C13	N3	C14	H21	39.2°	90.0°
C12	C11	N2	H110	117.5°	90.0°
C11	C12	S2	H19	120.8°	90.0°
C11	C12	S2	H20	120.8°	90.0°
C11	C12	S2	O5	172.4°	90.0°
C11	C12	S2	O2	69.6°	90.0°
C11	C12	S2	O1	53.5°	90.0°
C12	C11	N2	C3	62.8°	90.0°
C11	C12	H19	H20	117.3°	90.0°
C12	C11	N2	H6	117.2°	90.0°
N2	C11	C12	S2	90.8°	90.0°
C11	N2	C3	H6	180.0°	90.0°
C11	N2	C3	O3	4.6°	90.0°
C11	N2	C3	C2	174.6°	90.0°
N2	C11	C12	H19	148.4°	90.0°
N2	C11	C12	H20	30.1°	90.0°
C12	S2	O5	O2	121.6°	90.0°
C12	S2	O5	O1	119.4°	90.0°
C12	S2	O2	O1	123.2°	90.0°
S2	C12	C11	H110	151.3°	90.0°
S2	C12	H19	H20	117.4°	90.0°
C12	S2	O1	H18	117.8°	90.0°
O5	S2	O2	O1	118.7°	90.0°
O5	S2	C12	H19	66.8°	90.0°
O5	S2	C12	H20	51.6°	90.0°
O5	S2	O1	H18	0.0°	90.0°
O2	S2	C12	H19	51.2°	90.0°
O2	S2	C12	H20	169.6°	90.0°
O2	S2	O1	H18	117.4°	90.0°
O1	S2	C12	H19	174.3°	90.0°
O1	S2	C12	H20	67.4°	90.0°
N2	C3	O3	C2	179.1°	90.0°
N2	C3	C2	C1	77.5°	90.0°
N2	C3	C2	H4	42.9°	90.0°
N2	C3	C2	H5	162.1°	90.0°
C3	N2	C11	H110	54.6°	90.0°
O3	C3	C2	C1	101.6°	90.0°
O3	C3	C2	H4	138.0°	90.0°
O3	C3	C2	H5	18.7°	90.0°
O3	C3	N2	H6	175.4°	90.0°
C3	C2	C1	H4	120.4°	90.0°
C3	C2	C1	H5	120.4°	90.0°
C3	C2	C1	C6	99.3°	90.0°
C3	C2	H4	H5	118.8°	90.0°
C3	C2	C1	H3	21.3°	90.0°
C3	C2	C1	H2	140.2°	90.0°
C2	C3	N2	H6	5.5°	90.0°
C2	C1	C6	H3	120.6°	90.0°
C2	C1	C6	H2	120.6°	90.0°
C2	C1	C6	C5	158.1°	90.0°
C1	C2	H4	H5	118.9°	90.0°
C2	C1	C6	H11	37.5°	90.0°
C2	C1	C6	H10	81.3°	90.0°
C2	C1	H3	H2	118.3°	90.0°
C1	C6	C5	H11	120.6°	90.0°
C1	C6	C5	H10	120.6°	90.0°
C1	C6	C5	C7	126.0°	90.0°
C6	C1	C2	H4	140.4°	90.0°
C6	C1	C2	H5	21.1°	90.0°
C1	C6	C5	H8	5.7°	90.0°
C1	C6	C5	H9	113.6°	90.0°
C1	C6	H11	H10	118.1°	90.0°
C6	C1	H3	H2	118.3°	90.0°
C6	C5	C7	H8	120.3°	90.0°
C6	C5	C7	H9	120.4°	90.0°
C6	C5	C7	C4	165.5°	90.0°
C6	C5	C7	S1	79.0°	90.0°
C6	C5	H8	H9	119.0°	90.0°
C5	C6	H11	H10	118.1°	90.0°
C5	C6	C1	H3	81.3°	90.0°
C5	C6	C1	H2	37.5°	90.0°
C6	C5	C7	H13	40.8°	90.0°
C5	C7	C4	S1	122.4°	90.0°
C5	C7	C4	H13	124.6°	90.0°
C5	C7	S1	H13	121.4°	90.0°
C5	C7	C4	C9	152.8°	90.0°
C5	C7	C4	N5	38.4°	90.0°
C5	C7	S1	C8	161.6°	90.0°
C5	C7	C4	H7	86.2°	90.0°
C7	C5	H8	H9	119.0°	90.0°
C7	C5	C6	H11	113.3°	90.0°
C7	C5	C6	H10	5.4°	90.0°
C4	C7	S1	H13	115.1°	90.0°
C7	C4	C9	N5	121.8°	90.0°
C7	C4	C9	H7	121.0°	90.0°
C7	C4	N5	H7	124.1°	90.0°
C7	C4	C9	C8	7.8°	90.0°
C7	C4	C9	N1	126.0°	90.0°
C4	C7	S1	C8	38.0°	90.0°
C7	C4	N5	C10	121.7°	90.0°
C4	C7	C5	H8	45.1°	90.0°
C4	C7	C5	H9	74.1°	90.0°
C7	C4	C9	H16	115.2°	90.0°
C7	C4	N5	H17	58.3°	90.0°
S1	C7	C4	C9	30.4°	90.0°
S1	C7	C4	N5	84.0°	90.0°
C7	S1	C8	C9	33.9°	90.0°
S1	C7	C4	H7	151.3°	90.0°
S1	C7	C5	H8	160.7°	90.0°
S1	C7	C5	H9	41.4°	90.0°
C7	S1	C8	H15	85.0°	90.0°
C7	S1	C8	H14	152.8°	90.0°
C9	C4	N5	H7	116.4°	90.0°
C4	C9	C8	N1	114.1°	90.0°
C4	C9	C8	H16	122.9°	90.0°
C4	C9	N1	H16	118.0°	90.0°
C4	C9	C8	S1	18.9°	90.0°
C9	C4	N5	C10	2.2°	90.0°
C4	C9	N1	C10	5.2°	90.0°
C4	C9	N1	H1	174.8°	90.0°
C9	C4	C7	H13	82.6°	90.0°
C4	C9	C8	H15	100.0°	90.0°
C4	C9	C8	H14	137.8°	90.0°
C9	C4	N5	H17	177.8°	90.0°
N5	C4	C9	C8	114.0°	90.0°
N5	C4	C9	N1	4.1°	90.0°
C4	N5	C10	H17	180.0°	90.0°
C4	N5	C10	O4	177.2°	90.0°
C4	N5	C10	N1	1.0°	90.0°
N5	C4	C7	H13	163.1°	90.0°
N5	C4	C9	H16	123.0°	90.0°
C8	C9	N1	H16	122.3°	90.0°
C9	C8	S1	H15	118.9°	90.0°
C9	C8	S1	H14	118.9°	90.0°
C8	C9	N1	C10	114.5°	90.0°
C8	C9	N1	H1	65.5°	90.0°
C8	C9	C4	H7	128.8°	90.0°
C9	C8	H15	H14	123.3°	90.0°
N1	C9	C8	S1	95.2°	90.0°
C9	N1	C10	N5	4.1°	90.0°
C9	N1	C10	O4	174.2°	90.0°
C9	N1	C10	H1	180.0°	90.0°
N1	C9	C4	H7	113.0°	90.0°
N1	C9	C8	H15	145.9°	90.0°
N1	C9	C8	H14	23.7°	90.0°
C8	S1	C7	H13	77.1°	90.0°
S1	C8	H15	H14	123.2°	90.0°
S1	C8	C9	H16	141.8°	90.0°
N5	C10	O4	N1	177.9°	90.0°
N5	C10	N1	H1	175.9°	90.0°
C10	N5	C4	H7	114.2°	90.0°
O4	C10	N1	H1	5.9°	90.0°
O4	C10	N5	H17	2.8°	90.0°
C10	N1	C9	H16	123.2°	90.0°
N1	C10	N5	H17	179.0°	90.0°
N3	C14	C15	H22	120.9°	90.0°
N3	C14	C15	H21	120.9°	90.0°
N3	C14	C15	C34	127.4°	90.0°
N3	C14	C15	C16	56.0°	90.0°
N3	C14	H22	H21	117.3°	90.0°
C14	C15	C34	C16	176.5°	90.0°
C14	C15	C34	N4	178.1°	90.0°
C14	C15	C34	C33	3.2°	90.0°
C14	C15	C16	N6	178.0°	90.0°
C14	C15	C16	C19	3.0°	90.0°
C15	C14	H22	H21	117.2°	90.0°
C15	C14	N3	H12	19.9°	90.0°
C15	C34	N4	C33	178.9°	90.0°
C15	C34	N4	FE1	0.7°	90.0°
C15	C34	N4	C31	179.0°	90.0°
C34	C15	C16	N6	5.3°	90.0°
C15	C34	C33	C32	179.4°	90.0°
C34	C15	C16	C19	173.7°	90.0°
C34	C15	C14	H22	6.5°	90.0°
C34	C15	C14	H21	111.7°	90.0°
C15	C34	C33	H32	0.7°	90.0°
C16	C15	C34	N4	5.4°	90.0°
C16	C15	C34	C33	173.3°	90.0°
C15	C16	N6	FE1	1.0°	90.0°
C15	C16	N6	C17	179.1°	90.0°
C15	C16	N6	C19	179.0°	90.0°
C15	C16	C19	C18	179.5°	90.0°
C16	C15	C14	H22	176.9°	90.0°
C16	C15	C14	H21	64.9°	90.0°
C15	C16	C19	H24	0.4°	90.0°
C34	N4	FE1	C31	179.6°	90.0°
C34	N4	FE1	N8	176.1°	90.0°
C34	N4	FE1	N7	51.1°	90.0°
C34	N4	FE1	N6	4.8°	90.0°
N4	C34	C33	C32	0.4°	90.0°
C34	N4	C31	C32	0.3°	90.0°
C34	N4	C31	C30	178.9°	90.0°
N4	C34	C33	H32	179.6°	90.0°
C33	C34	N4	FE1	179.6°	90.0°
C33	C34	N4	C31	0.1°	90.0°
C34	C33	C32	H32	180.0°	90.0°
C34	C33	C32	C31	0.6°	90.0°
C34	C33	C32	H31	179.4°	90.0°
N4	FE1	N8	N7	179.0°	90.0°
N4	FE1	N8	N6	101.8°	90.0°
N4	FE1	N7	N6	46.3°	90.0°
N4	FE1	N8	C29	4.4°	90.0°
N4	FE1	N8	C26	177.1°	90.0°
N4	FE1	N7	C22	136.7°	90.0°
N4	FE1	N7	C21	42.0°	90.0°
N4	FE1	N6	C17	175.1°	90.0°
N4	FE1	N6	C16	5.0°	90.0°
FE1	N4	C31	C32	180.0°	90.0°
FE1	N4	C31	C30	1.4°	90.0°
C31	N4	FE1	N8	4.3°	90.0°
C31	N4	FE1	N7	128.5°	90.0°
C31	N4	FE1	N6	174.8°	90.0°
N4	C31	C32	C33	0.6°	90.0°
N4	C31	C32	C30	178.7°	90.0°
N4	C31	C30	C29	3.4°	90.0°
N4	C31	C30	H30	176.5°	90.0°
N4	C31	C32	H31	179.4°	90.0°
N8	FE1	N7	N6	179.1°	90.0°
FE1	N8	C29	C26	178.8°	90.0°
N8	FE1	N7	C22	3.8°	90.0°
N8	FE1	N7	C21	174.8°	90.0°
N8	FE1	N6	C17	73.3°	90.0°
N8	FE1	N6	C16	106.9°	90.0°
FE1	N8	C29	C30	1.5°	90.0°
FE1	N8	C29	C28	179.9°	90.0°
FE1	N8	C26	C27	180.0°	90.0°
FE1	N8	C26	C25	1.9°	90.0°
N7	FE1	N8	C29	174.6°	90.0°
N7	FE1	N8	C26	3.9°	90.0°
FE1	N7	C22	C21	178.9°	90.0°
N7	FE1	N6	C17	3.9°	90.0°
N7	FE1	N6	C16	176.0°	90.0°
FE1	N7	C22	C25	2.2°	90.0°
FE1	N7	C22	C23	179.7°	90.0°
FE1	N7	C21	C24	179.9°	90.0°
FE1	N7	C21	C20	1.7°	90.0°
N6	FE1	N8	C29	97.5°	90.0°
N6	FE1	N8	C26	81.1°	90.0°
N6	FE1	N7	C22	177.0°	90.0°
N6	FE1	N7	C21	4.3°	90.0°
FE1	N6	C17	C16	179.9°	90.0°
FE1	N6	C17	C20	0.8°	90.0°
FE1	N6	C17	C18	179.5°	90.0°
FE1	N6	C16	C19	179.9°	90.0°
N8	C29	C30	C31	3.4°	90.0°
N8	C29	C30	C28	178.5°	90.0°
N8	C29	C28	C27	0.5°	90.0°
C29	N8	C26	C27	1.2°	90.0°
C29	N8	C26	C25	179.3°	90.0°
N8	C29	C28	H29	179.5°	90.0°
N8	C29	C30	H30	176.6°	90.0°
C26	N8	C29	C30	179.7°	90.0°
C26	N8	C29	C28	1.1°	90.0°
N8	C26	C27	C28	0.9°	90.0°
N8	C26	C27	C25	178.1°	90.0°
N8	C26	C25	C22	10.0°	90.0°
N8	C26	C25	C35	163.9°	90.0°
N8	C26	C27	H28	179.1°	90.0°
N7	C22	C25	C26	10.0°	90.0°
N7	C22	C25	C23	177.7°	90.0°
N7	C22	C25	C35	163.9°	90.0°
N7	C22	C23	C24	0.4°	90.0°
C22	N7	C21	C24	1.0°	90.0°
C22	N7	C21	C20	179.4°	90.0°
N7	C22	C23	H26	179.6°	90.0°
C21	N7	C22	C25	178.9°	90.0°
C21	N7	C22	C23	0.8°	90.0°
N7	C21	C24	C23	0.8°	90.0°
N7	C21	C24	C20	178.5°	90.0°
N7	C21	C20	C17	3.3°	90.0°
N7	C21	C20	H25	176.8°	90.0°
N7	C21	C24	H27	179.2°	90.0°
N6	C17	C20	C21	3.8°	90.0°
N6	C17	C20	C18	178.6°	90.0°
N6	C17	C18	C19	0.7°	90.0°
C17	N6	C16	C19	0.0°	90.0°
N6	C17	C18	H23	179.3°	90.0°
N6	C17	C20	H25	176.3°	90.0°
C16	N6	C17	C20	179.1°	90.0°
C16	N6	C17	C18	0.4°	90.0°
N6	C16	C19	C18	0.5°	90.0°
N6	C16	C19	H24	179.5°	90.0°
C33	C32	C31	H31	180.0°	90.0°
C33	C32	C31	C30	179.3°	90.0°
C32	C31	C30	C29	175.1°	90.0°
C32	C31	C30	H30	4.9°	90.0°
C31	C32	C33	H32	179.4°	90.0°
C31	C30	C29	H30	180.0°	90.0°
C31	C30	C29	C28	175.2°	90.0°
C30	C31	C32	H31	0.7°	90.0°
C30	C29	C28	C27	179.2°	90.0°
C30	C29	C28	H29	0.8°	90.0°
C29	C28	C27	H29	180.0°	90.0°
C29	C28	C27	C26	0.3°	90.0°
C29	C28	C27	H28	179.8°	90.0°
C28	C29	C30	H30	4.9°	90.0°
C28	C27	C26	H28	180.0°	90.0°
C28	C27	C26	C25	179.0°	90.0°
C27	C26	C25	C22	172.2°	90.0°
C27	C26	C25	C35	13.9°	90.0°
C26	C27	C28	H29	179.7°	90.0°
C26	C25	C22	C35	174.0°	90.0°
C26	C25	C22	C23	172.3°	90.0°
C26	C25	C35	N9	120.8°	90.0°
C25	C26	C27	H28	1.0°	90.0°
C26	C25	C35	H34	118.5°	90.0°
C26	C25	C35	H33	0.0°	90.0°
C25	C22	C23	C24	178.4°	90.0°
C22	C25	C35	N9	65.2°	90.0°
C25	C22	C23	H26	1.5°	90.0°
C22	C25	C35	H34	55.6°	90.0°
C22	C25	C35	H33	174.1°	90.0°
C35	C25	C22	C23	13.8°	90.0°
C25	C35	N9	H34	120.8°	90.0°
C25	C35	N9	H33	120.7°	90.0°
C25	C35	N9	C36	89.3°	90.0°
C25	C35	H34	H33	117.7°	90.0°
C25	C35	N9	H35	90.7°	90.0°
C22	C23	C24	H26	180.0°	90.0°
C22	C23	C24	C21	0.2°	90.0°
C22	C23	C24	H27	179.8°	90.0°
C23	C24	C21	H27	180.0°	90.0°
C23	C24	C21	C20	179.2°	90.0°
C24	C21	C20	C17	175.1°	90.0°
C24	C21	C20	H25	4.9°	90.0°
C21	C24	C23	H26	179.9°	90.0°
C21	C20	C17	H25	180.0°	90.0°
C21	C20	C17	C18	174.8°	90.0°
C20	C21	C24	H27	0.7°	90.0°
C20	C17	C18	C19	179.5°	90.0°
C20	C17	C18	H23	0.5°	90.0°
C17	C18	C19	H23	180.0°	90.0°
C17	C18	C19	C16	0.7°	90.0°
C17	C18	C19	H24	179.3°	90.0°
C18	C17	C20	H25	5.2°	90.0°
C18	C19	C16	H24	180.0°	90.0°
C16	C19	C18	H23	179.3°	90.0°
C35	N9	C36	H35	180.0°	90.0°
C35	N9	C36	O7	3.5°	90.0°
C35	N9	C36	C37	175.8°	90.0°
N9	C35	H34	H33	117.7°	90.0°
N9	C36	O7	C37	179.3°	90.0°
N9	C36	C37	C38	128.1°	90.0°
N9	C36	C37	N10	105.7°	90.0°
C36	N9	C35	H34	150.0°	90.0°
C36	N9	C35	H33	31.5°	90.0°
N9	C36	C37	H38	11.8°	90.0°
O7	C36	C37	C38	51.2°	90.0°
O7	C36	C37	N10	75.0°	90.0°
O7	C36	C37	H38	167.6°	90.0°
O7	C36	N9	H35	176.5°	90.0°
C36	C37	C38	N10	129.4°	90.0°
C36	C37	C38	H38	116.6°	90.0°
C36	C37	N10	H38	117.2°	90.0°
C36	C37	C38	S3	9.9°	90.0°
C36	C37	N10	C39	5.9°	90.0°
C36	C37	C38	H37	111.7°	90.0°
C36	C37	C38	H36	131.6°	90.0°
C36	C37	N10	H39	174.1°	90.0°
C37	C36	N9	H35	4.2°	90.0°
C38	C37	N10	H38	113.5°	90.0°
C37	C38	S3	H37	121.7°	90.0°
C37	C38	S3	H36	121.7°	90.0°
C37	C38	S3	O10	78.4°	90.0°
C37	C38	S3	O9	164.6°	90.0°
C37	C38	S3	O8	46.2°	90.0°
C38	C37	N10	C39	123.4°	90.0°
C37	C38	H37	H36	114.7°	90.0°
C38	C37	N10	H39	56.6°	90.0°
N10	C37	C38	S3	119.4°	90.0°
C37	N10	C39	H39	180.0°	90.0°
C37	N10	C39	O11	3.6°	90.0°
C37	N10	C39	C40	175.2°	90.0°
N10	C37	C38	H37	118.9°	90.0°
N10	C37	C38	H36	2.2°	90.0°
C38	S3	O10	O9	115.8°	90.0°
C38	S3	O10	O8	125.9°	90.0°
C38	S3	O9	O8	121.9°	90.0°
S3	C38	C37	H38	126.5°	90.0°
S3	C38	H37	H36	114.6°	90.0°
C38	S3	O8	H55	117.6°	90.0°
O10	S3	O9	O8	120.2°	90.0°
O10	S3	C38	H37	160.0°	90.0°
O10	S3	C38	H36	43.3°	90.0°
O10	S3	O8	H55	118.6°	90.0°
O9	S3	C38	H37	42.9°	90.0°
O9	S3	C38	H36	73.8°	90.0°
O9	S3	O8	H55	0.0°	90.0°
O8	S3	C38	H37	75.5°	90.0°
O8	S3	C38	H36	167.9°	90.0°
N10	C39	O11	C40	178.8°	90.0°
N10	C39	C40	C41	148.0°	90.0°
C39	N10	C37	H38	123.1°	90.0°
N10	C39	C40	H40	91.5°	90.0°
N10	C39	C40	H41	27.6°	90.0°
O11	C39	C40	C41	30.9°	90.0°
O11	C39	C40	H40	89.5°	90.0°
O11	C39	C40	H41	151.3°	90.0°
O11	C39	N10	H39	176.4°	90.0°
C39	C40	C41	H40	120.4°	90.0°
C39	C40	C41	H41	120.4°	90.0°
C39	C40	C41	C42	69.0°	90.0°
C39	C40	H40	H41	118.7°	90.0°
C39	C40	C41	H43	51.3°	90.0°
C39	C40	C41	H42	170.7°	90.0°
C40	C39	N10	H39	4.8°	90.0°
C40	C41	C42	H43	120.3°	90.0°
C40	C41	C42	H42	120.3°	90.0°
C40	C41	C42	C43	173.7°	90.0°
C41	C40	H40	H41	118.7°	90.0°
C40	C41	H43	H42	119.0°	90.0°
C40	C41	C42	H45	53.4°	90.0°
C40	C41	C42	H44	66.0°	90.0°
C41	C42	C43	H45	120.3°	90.0°
C41	C42	C43	H44	120.3°	90.0°
C41	C42	C43	C44	179.5°	90.0°
C42	C41	C40	H40	170.6°	90.0°
C42	C41	C40	H41	51.5°	90.0°
C42	C41	H43	H42	119.0°	90.0°
C41	C42	H45	H44	119.1°	90.0°
C41	C42	C43	H46	59.4°	90.0°
C41	C42	C43	H47	60.4°	90.0°
C42	C43	C44	H46	120.1°	90.0°
C42	C43	C44	H47	120.1°	90.0°
C42	C43	C44	C47	159.3°	90.0°
C42	C43	C44	S4	85.1°	90.0°
C43	C42	C41	H43	66.0°	90.0°
C43	C42	C41	H42	53.4°	90.0°
C43	C42	H45	H44	119.0°	90.0°
C42	C43	H46	H47	119.7°	90.0°
C42	C43	C44	H48	34.2°	90.0°
C43	C44	C47	S4	121.5°	90.0°
C43	C44	C47	H48	125.2°	90.0°
C43	C44	S4	H48	120.9°	90.0°
C43	C44	C47	C46	152.7°	90.0°
C43	C44	C47	N11	38.4°	90.0°
C43	C44	S4	C45	161.9°	90.0°
C44	C43	C42	H45	60.2°	90.0°
C44	C43	C42	H44	59.2°	90.0°
C44	C43	H46	H47	119.7°	90.0°
C43	C44	C47	H51	86.6°	90.0°
C47	C44	S4	H48	115.4°	90.0°
C44	C47	C46	N11	122.1°	90.0°
C44	C47	C46	H51	120.7°	90.0°
C44	C47	N11	H51	124.4°	90.0°
C44	C47	C46	C45	9.0°	90.0°
C44	C47	C46	N12	127.1°	90.0°
C47	C44	S4	C45	38.2°	90.0°
C44	C47	N11	C48	122.4°	90.0°
C47	C44	C43	H46	39.2°	90.0°
C47	C44	C43	H47	80.6°	90.0°
C44	C47	C46	H52	114.1°	90.0°
C44	C47	N11	H54	57.6°	90.0°
S4	C44	C47	C46	31.2°	90.0°
S4	C44	C47	N11	83.1°	90.0°
C44	S4	C45	C46	33.3°	90.0°
S4	C44	C43	H46	154.8°	90.0°
S4	C44	C43	H47	35.0°	90.0°
C44	S4	C45	H50	85.6°	90.0°
C44	S4	C45	H49	152.3°	90.0°
S4	C44	C47	H51	151.9°	90.0°
C46	C47	N11	H51	116.4°	90.0°
C47	C46	C45	N12	114.1°	90.0°
C47	C46	C45	H52	123.0°	90.0°
C47	C46	N12	H52	118.0°	90.0°
C47	C46	C45	S4	17.9°	90.0°
C46	C47	N11	C48	3.2°	90.0°
C47	C46	N12	C48	5.6°	90.0°
C46	C47	C44	H48	82.1°	90.0°
C47	C46	C45	H50	101.0°	90.0°
C47	C46	C45	H49	136.9°	90.0°
C46	C47	N11	H54	176.8°	90.0°
C47	C46	N12	H53	174.4°	90.0°
N11	C47	C46	C45	113.2°	90.0°
N11	C47	C46	N12	4.9°	90.0°
C47	N11	C48	H54	180.0°	90.0°
C47	N11	C48	O12	178.6°	90.0°
C47	N11	C48	N12	0.1°	90.0°
N11	C47	C44	H48	163.5°	90.0°
N11	C47	C46	H52	123.8°	90.0°
C45	C46	N12	H52	122.3°	90.0°
C46	C45	S4	H50	118.9°	90.0°
C46	C45	S4	H49	118.9°	90.0°
C45	C46	N12	C48	114.2°	90.0°
C46	C45	H50	H49	123.1°	90.0°
C45	C46	C47	H51	129.7°	90.0°
C45	C46	N12	H53	65.8°	90.0°
N12	C46	C45	S4	96.1°	90.0°
C46	N12	C48	N11	3.8°	90.0°
C46	N12	C48	O12	174.9°	90.0°
C46	N12	C48	H53	180.0°	90.0°
N12	C46	C45	H50	145.0°	90.0°
N12	C46	C45	H49	22.8°	90.0°
N12	C46	C47	H51	112.2°	90.0°
C45	S4	C44	H48	77.3°	90.0°
S4	C45	H50	H49	123.1°	90.0°
S4	C45	C46	H52	140.9°	90.0°
N11	C48	O12	N12	178.5°	90.0°
C48	N11	C47	H51	113.1°	90.0°
N11	C48	N12	H53	176.2°	90.0°
O12	C48	N11	H54	1.4°	90.0°
O12	C48	N12	H53	5.1°	90.0°
C48	N12	C46	H52	123.6°	90.0°
N12	C48	N11	H54	179.9°	90.0°
H1	N1	C9	H16	56.8°	90.0°
H4	C2	C1	H3	99.1°	90.0°
H4	C2	C1	H2	19.8°	90.0°
H5	C2	C1	H3	141.7°	90.0°
H5	C2	C1	H2	99.4°	90.0°
H7	C4	C7	H13	38.4°	90.0°
H7	C4	C9	H16	5.8°	90.0°
H7	C4	N5	H17	65.8°	90.0°
H8	C5	C6	H11	126.3°	90.0°
H8	C5	C6	H10	114.9°	90.0°
H8	C5	C7	H13	79.5°	90.0°
H9	C5	C6	H11	7.0°	90.0°
H9	C5	C6	H10	125.8°	90.0°
H9	C5	C7	H13	161.2°	90.0°
H11	C6	C1	H3	158.0°	90.0°
H11	C6	C1	H2	83.1°	90.0°
H10	C6	C1	H3	39.3°	90.0°
H10	C6	C1	H2	158.1°	90.0°
H110	C11	C12	H19	30.5°	90.0°
H110	C11	C12	H20	87.8°	90.0°
H110	C11	N2	H6	125.4°	90.0°
H22	C14	N3	H12	100.9°	90.0°
H21	C14	N3	H12	140.8°	90.0°
H23	C18	C19	H24	0.7°	90.0°
H26	C23	C24	H27	0.2°	90.0°
H28	C27	C28	H29	0.2°	90.0°
H31	C32	C33	H32	0.6°	90.0°
H34	C35	N9	H35	30.0°	90.0°
H33	C35	N9	H35	148.5°	90.0°
H38	C37	C38	H37	4.8°	90.0°
H38	C37	C38	H36	111.9°	90.0°
H38	C37	N10	H39	56.9°	90.0°
H40	C40	C41	H43	69.1°	90.0°
H40	C40	C41	H42	50.2°	90.0°
H41	C40	C41	H43	171.8°	90.0°
H41	C40	C41	H42	68.9°	90.0°
H43	C41	C42	H45	173.7°	90.0°
H43	C41	C42	H44	54.3°	90.0°
H42	C41	C42	H45	66.9°	90.0°
H42	C41	C42	H44	173.7°	90.0°
H45	C42	C43	H46	179.7°	90.0°
H45	C42	C43	H47	59.9°	90.0°
H44	C42	C43	H46	60.9°	90.0°
H44	C42	C43	H47	179.3°	90.0°
H46	C43	C44	H48	86.0°	90.0°
H47	C43	C44	H48	154.3°	90.0°
H48	C44	C47	H51	38.6°	90.0°
H50	C45	C46	H52	22.0°	90.0°
H49	C45	C46	H52	100.1°	90.0°
H52	C46	C47	H51	6.7°	90.0°
H52	C46	N12	H53	56.4°	90.0°
H51	C47	N11	H54	66.9°	90.0°
H15	C8	C9	H16	22.9°	90.0°
H14	C8	C9	H16	99.3°	90.0°

Release date:	2024-09-11
Definition date:	2023-08-28
Last modified:	2024-09-06
Release status:	REL
Processing site:	RCSB
Derived from:	8TY0