SI4

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
C19	C18	sing	0.00Å	1.54Å
C19	N3	sing	0.00Å	1.51Å
C16	C15	doub	0.00Å	1.43Å	Aromatic
C16	C17	sing	0.00Å	1.46Å	Aromatic
C18	C17	sing	0.00Å	1.57Å
C26	N3	sing	0.00Å	1.53Å
C26	C25	sing	0.00Å	1.51Å
C15	C14	sing	0.00Å	1.44Å	Aromatic
C17	N4	doub	0.00Å	1.38Å	Aromatic
N3	C11	sing	0.00Å	1.52Å
N3	CU	sing	0.00Å	2.24Å
C11	C12	sing	0.00Å	1.54Å
C25	C24	sing	0.00Å	1.57Å
C14	C13	doub	0.00Å	1.44Å	Aromatic
N4	C13	sing	0.00Å	1.42Å	Aromatic
N4	CU	sing	0.00Å	2.20Å
C27	C12	sing	0.00Å	1.53Å
C27	N6	sing	0.00Å	1.53Å
O2	C1	doub	0.00Å	1.26Å
C24	C23	doub	0.00Å	1.32Å	Aromatic
C24	N5	sing	0.00Å	1.39Å	Aromatic
CU	N5	sing	0.00Å	2.05Å
C1	N6	sing	0.00Å	1.41Å
C1	C2	sing	0.00Å	1.50Å
C23	C22	sing	0.00Å	1.43Å	Aromatic
N5	C20	doub	0.00Å	1.38Å	Aromatic
C2	C3	sing	0.00Å	1.54Å
C3	C4	sing	0.00Å	1.56Å
C22	C21	doub	0.00Å	1.41Å	Aromatic
C20	C21	sing	0.00Å	1.36Å	Aromatic
C4	C5	sing	0.00Å	1.53Å
C5	C6	sing	0.00Å	1.53Å
C6	C10	sing	0.00Å	1.55Å
C6	S1	sing	0.00Å	1.80Å
N2	C10	sing	0.00Å	1.47Å
N2	C9	sing	0.00Å	1.32Å
C10	C8	sing	0.00Å	1.56Å
S1	C7	sing	0.00Å	1.84Å
C9	O3	doub	0.00Å	1.26Å
C9	N1	sing	0.00Å	1.32Å
C8	N1	sing	0.00Å	1.44Å
C8	C7	sing	0.00Å	1.53Å
N1	H1	sing	0.00Å	1.00Å
N2	H2	sing	0.00Å	1.00Å
C10	H3	sing	0.00Å	1.10Å
C8	H4	sing	0.00Å	1.10Å
C7	H5	sing	0.00Å	1.10Å
C7	H6	sing	0.00Å	1.10Å
C6	H7	sing	0.00Å	1.10Å
C5	H8	sing	0.00Å	1.10Å
C5	H9	sing	0.00Å	1.10Å
C4	H10	sing	0.00Å	1.10Å
C4	H11	sing	0.00Å	1.10Å
C3	H12	sing	0.00Å	1.10Å
C3	H13	sing	0.00Å	1.10Å
C2	H14	sing	0.00Å	1.10Å
C2	H15	sing	0.00Å	1.10Å
N6	H16	sing	0.00Å	1.00Å
C27	H17	sing	0.00Å	1.10Å
C12	H18	sing	0.00Å	1.10Å
C11	H19	sing	0.00Å	1.10Å
C11	H20	sing	0.00Å	1.10Å
C26	H21	sing	0.00Å	1.10Å
C26	H22	sing	0.00Å	1.10Å
C25	H23	sing	0.00Å	1.10Å
C25	H24	sing	0.00Å	1.10Å
C23	H25	sing	0.00Å	1.08Å
C22	H26	sing	0.00Å	1.08Å
C21	H27	sing	0.00Å	1.08Å
C20	H28	sing	0.00Å	1.08Å
C19	H29	sing	0.00Å	1.10Å
C19	H30	sing	0.00Å	1.10Å
C18	H31	sing	0.00Å	1.10Å
C18	H32	sing	0.00Å	1.10Å
C16	H33	sing	0.00Å	1.08Å
C15	H34	sing	0.00Å	1.08Å
C14	H35	sing	0.00Å	1.08Å
C13	H36	sing	0.00Å	1.08Å
C27	H37	sing	0.00Å	1.10Å
C12	H38	sing	0.00Å	1.10Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
C18	C19	N3	117.4°	90.0°
C19	C18	C17	123.0°	90.0°
C18	C19	H29	107.5°	90.0°
C18	C19	H30	107.4°	90.0°
C19	C18	H31	106.0°	90.0°
C19	C18	H32	106.0°	90.0°
C19	N3	C26	92.3°	90.0°
C19	N3	C11	108.2°	90.0°
C19	N3	CU	114.4°	90.0°
N3	C19	H29	107.5°	90.0°
N3	C19	H30	107.5°	90.0°
C15	C16	C17	123.6°	90.0°
C16	C15	C14	119.4°	90.0°
C15	C16	H33	118.2°	90.0°
C16	C15	H34	120.3°	90.0°
C16	C17	C18	123.3°	90.0°
C16	C17	N4	117.5°	90.0°
C17	C16	H33	118.2°	90.0°
C18	C17	N4	119.1°	90.0°
C17	C18	H31	106.0°	90.0°
C17	C18	H32	106.0°	90.0°
N3	C26	C25	113.1°	90.0°
C26	N3	C11	108.3°	90.0°
C26	N3	CU	119.2°	90.0°
N3	C26	H21	108.5°	90.0°
N3	C26	H22	108.6°	90.0°
C26	C25	C24	115.6°	90.0°
C25	C26	H21	108.6°	90.0°
C25	C26	H22	108.5°	90.0°
C26	C25	H23	107.9°	90.0°
C26	C25	H24	107.9°	90.0°
C15	C14	C13	114.1°	90.0°
C14	C15	H34	120.3°	90.0°
C15	C14	H35	122.9°	90.0°
C17	N4	C13	118.5°	90.0°
C17	N4	CU	117.6°	90.0°
C11	N3	CU	112.5°	90.0°
N3	C11	C12	124.0°	90.0°
N3	C11	H19	105.7°	90.0°
N3	C11	H20	105.8°	90.0°
N3	CU	N4	93.5°	90.0°
N3	CU	N5	91.6°	90.0°
C11	C12	C27	117.6°	90.0°
C11	C12	H18	107.4°	90.0°
C12	C11	H19	105.7°	90.0°
C12	C11	H20	105.7°	90.0°
C11	C12	H38	107.4°	90.0°
C25	C24	C23	117.0°	90.0°
C25	C24	N5	131.8°	90.0°
C24	C25	H23	107.9°	90.0°
C24	C25	H24	107.9°	90.0°
C14	C13	N4	126.8°	90.0°
C13	C14	H35	123.0°	90.0°
C14	C13	H36	116.6°	90.0°
C13	N4	CU	123.9°	90.0°
N4	C13	H36	116.6°	90.0°
N4	CU	N5	96.4°	90.0°
C12	C27	N6	124.9°	90.0°
C12	C27	H17	105.5°	90.0°
C27	C12	H18	107.4°	90.0°
C12	C27	H37	105.5°	90.0°
C27	C12	H38	107.4°	90.0°
C27	N6	C1	114.6°	90.0°
C27	N6	H16	122.7°	90.0°
N6	C27	H17	105.5°	90.0°
N6	C27	H37	105.5°	90.0°
O2	C1	N6	120.7°	90.0°
O2	C1	C2	120.0°	90.0°
C23	C24	N5	111.2°	90.0°
C24	C23	C22	120.0°	90.0°
C24	C23	H25	120.0°	90.0°
C24	N5	CU	123.8°	90.0°
C24	N5	C20	131.3°	90.0°
CU	N5	C20	105.0°	90.0°
N6	C1	C2	117.4°	90.0°
C1	N6	H16	122.7°	90.0°
C1	C2	C3	114.2°	90.0°
C1	C2	H14	108.3°	90.0°
C1	C2	H15	108.3°	90.0°
C23	C22	C21	127.4°	90.0°
C22	C23	H25	120.0°	90.0°
C23	C22	H26	116.3°	90.0°
N5	C20	C21	118.2°	90.0°
N5	C20	H28	120.9°	90.0°
C2	C3	C4	104.1°	90.0°
C2	C3	H12	110.8°	90.0°
C2	C3	H13	110.8°	90.0°
C3	C2	H14	108.3°	90.0°
C3	C2	H15	108.3°	90.0°
C3	C4	C5	110.8°	90.0°
C3	C4	H10	109.1°	90.0°
C3	C4	H11	109.2°	90.0°
C4	C3	H12	110.8°	90.0°
C4	C3	H13	110.8°	90.0°
C22	C21	C20	111.8°	90.0°
C21	C22	H26	116.3°	90.0°
C22	C21	H27	124.1°	90.0°
C20	C21	H27	124.1°	90.0°
C21	C20	H28	120.9°	90.0°
C4	C5	C6	117.5°	90.0°
C4	C5	H8	107.4°	90.0°
C4	C5	H9	107.4°	90.0°
C5	C4	H10	109.1°	90.0°
C5	C4	H11	109.1°	90.0°
C5	C6	C10	115.5°	90.0°
C5	C6	S1	120.7°	90.0°
C5	C6	H7	105.0°	90.0°
C6	C5	H8	107.4°	90.0°
C6	C5	H9	107.4°	90.0°
C10	C6	S1	106.2°	90.0°
C6	C10	N2	109.0°	90.0°
C6	C10	C8	108.2°	90.0°
C6	C10	H3	111.1°	90.0°
C10	C6	H7	104.7°	90.0°
C6	S1	C7	89.2°	90.0°
S1	C6	H7	102.7°	90.0°
C10	N2	C9	108.0°	90.0°
N2	C10	C8	105.0°	90.0°
C10	N2	H2	126.0°	90.0°
N2	C10	H3	112.3°	90.0°
N2	C9	O3	123.6°	90.0°
N2	C9	N1	112.4°	90.0°
C9	N2	H2	126.0°	90.0°
C10	C8	N1	99.7°	90.0°
C10	C8	C7	109.6°	90.0°
C8	C10	H3	110.9°	90.0°
C10	C8	H4	113.0°	90.0°
S1	C7	C8	106.1°	90.0°
S1	C7	H5	110.3°	90.0°
S1	C7	H6	110.3°	90.0°
O3	C9	N1	122.8°	90.0°
C9	N1	C8	112.9°	90.0°
C9	N1	H1	123.5°	90.0°
N1	C8	C7	104.9°	90.0°
C8	N1	H1	123.5°	90.0°
N1	C8	H4	115.0°	90.0°
C7	C8	H4	113.5°	90.0°
C8	C7	H5	110.3°	90.0°
C8	C7	H6	110.3°	90.0°
H5	C7	H6	109.5°	90.0°
H8	C5	H9	109.5°	90.0°
H10	C4	H11	109.4°	90.0°
H12	C3	H13	109.5°	90.0°
H14	C2	H15	109.5°	90.0°
H17	C27	H37	109.5°	90.0°
H18	C12	H38	109.5°	90.0°
H19	C11	H20	109.5°	90.0°
H21	C26	H22	109.5°	90.0°
H23	C25	H24	109.5°	90.0°
H29	C19	H30	109.5°	90.0°
H31	C18	H32	109.5°	90.0°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
C18	C19	N3	H29	121.1°	90.0°
C18	C19	N3	H30	121.1°	90.0°
C19	C18	C17	C16	125.8°	90.0°
C19	C18	C17	H31	121.9°	90.0°
C19	C18	C17	H32	121.9°	90.0°
C18	C19	N3	C26	118.7°	90.0°
C19	C18	C17	N4	57.5°	90.0°
C18	C19	N3	C11	131.2°	90.0°
C18	C19	N3	CU	4.9°	90.0°
C18	C19	H29	H30	116.4°	90.0°
C19	C18	H31	H32	113.9°	90.0°
N3	C19	C18	C17	51.4°	90.0°
C19	N3	C26	C11	110.0°	90.0°
C19	N3	C26	CU	119.7°	90.0°
C19	N3	C26	C25	176.6°	90.0°
C19	N3	C11	CU	127.4°	90.0°
C19	N3	C11	C12	124.9°	90.0°
C19	N3	CU	N4	38.4°	90.0°
C19	N3	CU	N5	134.9°	90.0°
C19	N3	C11	H19	113.2°	90.0°
C19	N3	C11	H20	2.9°	90.0°
C19	N3	C26	H21	56.1°	90.0°
C19	N3	C26	H22	62.9°	90.0°
N3	C19	H29	H30	116.4°	90.0°
N3	C19	C18	H31	70.4°	90.0°
N3	C19	C18	H32	173.3°	90.0°
C15	C16	C17	H33	180.0°	90.0°
C15	C16	C17	C18	179.2°	90.0°
C16	C15	C14	H34	180.0°	90.0°
C15	C16	C17	N4	2.4°	90.0°
C16	C15	C14	C13	1.2°	90.0°
C16	C15	C14	H35	178.7°	90.0°
C16	C17	C18	N4	176.7°	90.0°
C17	C16	C15	C14	2.5°	90.0°
C16	C17	N4	C13	1.2°	90.0°
C16	C17	N4	CU	179.0°	90.0°
C16	C17	C18	H31	112.4°	90.0°
C16	C17	C18	H32	3.9°	90.0°
C17	C16	C15	H34	177.5°	90.0°
C18	C17	N4	C13	178.2°	90.0°
C18	C17	N4	CU	2.1°	90.0°
C17	C18	C19	H29	69.7°	90.0°
C17	C18	C19	H30	172.6°	90.0°
C17	C18	H31	H32	113.9°	90.0°
C18	C17	C16	H33	0.8°	90.0°
N3	C26	C25	H21	120.5°	90.0°
N3	C26	C25	H22	120.6°	90.0°
C26	N3	C11	CU	133.9°	90.0°
C26	N3	C11	C12	136.4°	90.0°
N3	C26	C25	C24	55.5°	90.0°
C26	N3	CU	N4	69.3°	90.0°
C26	N3	CU	N5	27.3°	90.0°
C26	N3	C11	H19	14.4°	90.0°
C26	N3	C11	H20	101.7°	90.0°
N3	C26	H21	H22	118.4°	90.0°
N3	C26	C25	H23	176.4°	90.0°
N3	C26	C25	H24	65.3°	90.0°
C26	N3	C19	H29	2.4°	90.0°
C26	N3	C19	H30	120.2°	90.0°
C25	C26	N3	C11	73.4°	90.0°
C25	C26	N3	CU	56.9°	90.0°
C26	C25	C24	H23	120.9°	90.0°
C26	C25	C24	H24	120.9°	90.0°
C26	C25	C24	C23	152.1°	90.0°
C26	C25	C24	N5	28.0°	90.0°
C25	C26	H21	H22	118.3°	90.0°
C26	C25	H23	H24	117.2°	90.0°
C15	C14	C13	H35	180.0°	90.0°
C15	C14	C13	N4	0.2°	90.0°
C14	C15	C16	H33	177.6°	90.0°
C15	C14	C13	H36	179.8°	90.0°
C17	N4	CU	N3	35.4°	90.0°
C17	N4	C13	C14	0.2°	90.0°
C17	N4	C13	CU	179.7°	90.0°
C17	N4	CU	N5	127.5°	90.0°
N4	C17	C18	H31	64.3°	90.0°
N4	C17	C18	H32	179.4°	90.0°
N4	C17	C16	H33	177.6°	90.0°
C17	N4	C13	H36	179.8°	90.0°
N3	C11	C12	H19	122.0°	90.0°
N3	C11	C12	H20	122.0°	90.0°
C11	N3	CU	N4	162.4°	90.0°
N3	C11	C12	C27	121.4°	90.0°
C11	N3	CU	N5	101.1°	90.0°
N3	C11	C12	H18	0.2°	90.0°
N3	C11	H19	H20	113.5°	90.0°
C11	N3	C26	H21	166.1°	90.0°
C11	N3	C26	H22	47.1°	90.0°
C11	N3	C19	H29	107.7°	90.0°
C11	N3	C19	H30	10.1°	90.0°
N3	C11	C12	H38	117.5°	90.0°
CU	N3	C11	C12	2.5°	90.0°
N3	CU	N4	C13	144.3°	90.0°
N3	CU	N4	N5	92.0°	90.0°
N3	CU	N5	C24	0.1°	90.0°
N3	CU	N5	C20	179.5°	90.0°
CU	N3	C11	H19	119.5°	90.0°
CU	N3	C11	H20	124.5°	90.0°
CU	N3	C26	H21	63.6°	90.0°
CU	N3	C26	H22	177.4°	90.0°
CU	N3	C19	H29	126.0°	90.0°
CU	N3	C19	H30	116.2°	90.0°
C11	C12	C27	H18	121.2°	90.0°
C11	C12	C27	H38	121.1°	90.0°
C11	C12	C27	N6	163.4°	90.0°
C11	C12	C27	H17	41.3°	90.0°
C11	C12	H18	H38	116.3°	90.0°
C12	C11	H19	H20	113.5°	90.0°
C11	C12	C27	H37	74.5°	90.0°
C25	C24	C23	N5	179.9°	90.0°
C25	C24	N5	CU	0.5°	90.0°
C25	C24	C23	C22	179.7°	90.0°
C25	C24	N5	C20	178.7°	90.0°
C24	C25	C26	H21	65.0°	90.0°
C24	C25	C26	H22	176.1°	90.0°
C24	C25	H23	H24	117.2°	90.0°
C25	C24	C23	H25	0.4°	90.0°
C14	C13	N4	H36	180.0°	90.0°
C14	C13	N4	CU	179.9°	90.0°
C13	C14	C15	H34	178.8°	90.0°
C13	N4	CU	N5	52.3°	90.0°
N4	C13	C14	H35	179.8°	90.0°
N4	CU	N5	C24	93.8°	90.0°
N4	CU	N5	C20	86.8°	90.0°
CU	N4	C13	H36	0.1°	90.0°
C12	C27	N6	H17	122.1°	90.0°
C12	C27	N6	H37	122.1°	90.0°
C12	C27	N6	C1	95.6°	90.0°
C12	C27	N6	H16	84.4°	90.0°
C12	C27	H17	H37	113.1°	90.0°
C27	C12	H18	H38	116.3°	90.0°
C27	C12	C11	H19	116.7°	90.0°
C27	C12	C11	H20	0.6°	90.0°
C27	N6	C1	O2	32.7°	90.0°
C27	N6	C1	H16	180.0°	90.0°
C27	N6	C1	C2	162.9°	90.0°
N6	C27	H17	H37	113.1°	90.0°
N6	C27	C12	H18	75.4°	90.0°
N6	C27	C12	H38	42.3°	90.0°
O2	C1	N6	C2	164.3°	90.0°
O2	C1	C2	C3	22.3°	90.0°
O2	C1	C2	H14	98.4°	90.0°
O2	C1	C2	H15	143.0°	90.0°
O2	C1	N6	H16	147.3°	90.0°
C23	C24	N5	CU	179.6°	90.0°
C24	C23	C22	H25	180.0°	90.0°
C23	C24	N5	C20	1.2°	90.0°
C24	C23	C22	C21	1.4°	90.0°
C23	C24	C25	H23	31.2°	90.0°
C23	C24	C25	H24	87.0°	90.0°
C24	C23	C22	H26	178.6°	90.0°
C24	N5	CU	C20	179.4°	90.0°
N5	C24	C23	C22	0.3°	90.0°
C24	N5	C20	C21	3.1°	90.0°
N5	C24	C25	H23	148.9°	90.0°
N5	C24	C25	H24	92.9°	90.0°
N5	C24	C23	H25	179.7°	90.0°
C24	N5	C20	H28	176.9°	90.0°
CU	N5	C20	C21	177.6°	90.0°
CU	N5	C20	H28	2.4°	90.0°
N6	C1	C2	C3	142.2°	90.0°
N6	C1	C2	H14	97.1°	90.0°
N6	C1	C2	H15	21.5°	90.0°
C1	N6	C27	H17	26.4°	90.0°
C1	N6	C27	H37	142.3°	90.0°
C1	C2	C3	H14	120.7°	90.0°
C1	C2	C3	H15	120.7°	90.0°
C1	C2	C3	C4	81.5°	90.0°
C1	C2	C3	H12	37.6°	90.0°
C1	C2	C3	H13	159.4°	90.0°
C1	C2	H14	H15	117.8°	90.0°
C2	C1	N6	H16	17.0°	90.0°
C23	C22	C21	H26	180.0°	90.0°
C23	C22	C21	C20	3.0°	90.0°
C23	C22	C21	H27	177.0°	90.0°
N5	C20	C21	C22	3.4°	90.0°
N5	C20	C21	H28	180.0°	90.0°
N5	C20	C21	H27	176.6°	90.0°
C2	C3	C4	H12	119.2°	90.0°
C2	C3	C4	H13	119.2°	90.0°
C2	C3	C4	C5	174.5°	90.0°
C2	C3	C4	H10	65.3°	90.0°
C2	C3	C4	H11	54.3°	90.0°
C2	C3	H12	H13	122.5°	90.0°
C3	C2	H14	H15	117.8°	90.0°
C3	C4	C5	H10	120.2°	90.0°
C3	C4	C5	H11	120.2°	90.0°
C3	C4	C5	C6	175.8°	90.0°
C3	C4	C5	H8	63.1°	90.0°
C3	C4	C5	H9	54.6°	90.0°
C3	C4	H10	H11	119.4°	90.0°
C4	C3	H12	H13	122.4°	90.0°
C4	C3	C2	H14	157.8°	90.0°
C4	C3	C2	H15	39.2°	90.0°
C22	C21	C20	H27	180.0°	90.0°
C21	C22	C23	H25	178.6°	90.0°
C22	C21	C20	H28	176.5°	90.0°
C20	C21	C22	H26	177.0°	90.0°
C4	C5	C6	H8	121.2°	90.0°
C4	C5	C6	H9	121.1°	90.0°
C4	C5	C6	C10	171.9°	90.0°
C4	C5	C6	S1	58.0°	90.0°
C4	C5	C6	H7	57.1°	90.0°
C4	C5	H8	H9	116.4°	90.0°
C5	C4	H10	H11	119.3°	90.0°
C5	C4	C3	H12	55.3°	90.0°
C5	C4	C3	H13	66.3°	90.0°
C5	C6	C10	S1	136.8°	90.0°
C5	C6	C10	H7	115.0°	90.0°
C5	C6	S1	H7	116.3°	90.0°
C5	C6	C10	N2	54.8°	90.0°
C5	C6	C10	C8	168.6°	90.0°
C5	C6	S1	C7	175.4°	90.0°
C5	C6	C10	H3	69.4°	90.0°
C6	C5	H8	H9	116.3°	90.0°
C6	C5	C4	H10	55.6°	90.0°
C6	C5	C4	H11	64.0°	90.0°
C10	C6	S1	H7	109.7°	90.0°
C6	C10	N2	C8	115.8°	90.0°
C6	C10	N2	H3	123.6°	90.0°
C6	C10	N2	C9	119.8°	90.0°
C6	C10	C8	H3	122.1°	90.0°
C10	C6	S1	C7	41.3°	90.0°
C6	C10	C8	N1	112.4°	90.0°
C6	C10	C8	C7	2.7°	90.0°
C6	C10	N2	H2	60.2°	90.0°
C6	C10	C8	H4	125.0°	90.0°
C10	C6	C5	H8	50.8°	90.0°
C10	C6	C5	H9	66.9°	90.0°
S1	C6	C10	N2	82.0°	90.0°
S1	C6	C10	C8	31.8°	90.0°
C6	S1	C7	C8	39.7°	90.0°
S1	C6	C10	H3	153.8°	90.0°
C6	S1	C7	H5	159.2°	90.0°
C6	S1	C7	H6	79.7°	90.0°
S1	C6	C5	H8	179.1°	90.0°
S1	C6	C5	H9	63.2°	90.0°
C10	N2	C9	H2	180.0°	90.0°
N2	C10	C8	H3	121.6°	90.0°
C10	N2	C9	O3	179.3°	90.0°
C10	N2	C9	N1	11.5°	90.0°
N2	C10	C8	N1	3.9°	90.0°
N2	C10	C8	C7	113.6°	90.0°
N2	C10	C8	H4	118.7°	90.0°
N2	C10	C6	H7	169.8°	90.0°
C9	N2	C10	C8	4.0°	90.0°
N2	C9	O3	N1	166.5°	90.0°
N2	C9	N1	C8	15.1°	90.0°
N2	C9	N1	H1	164.9°	90.0°
C9	N2	C10	H3	116.7°	90.0°
C10	C8	C7	S1	26.8°	90.0°
C10	C8	N1	C9	11.0°	90.0°
C10	C8	N1	C7	113.4°	90.0°
C10	C8	N1	H4	121.1°	90.0°
C10	C8	C7	H4	127.3°	90.0°
C10	C8	N1	H1	169.0°	90.0°
C8	C10	N2	H2	176.0°	90.0°
C10	C8	C7	H5	146.2°	90.0°
C10	C8	C7	H6	92.7°	90.0°
C8	C10	C6	H7	76.5°	90.0°
S1	C7	C8	N1	79.5°	90.0°
S1	C7	C8	H5	119.5°	90.0°
S1	C7	C8	H6	119.5°	90.0°
S1	C7	C8	H4	154.1°	90.0°
S1	C7	H5	H6	121.6°	90.0°
C7	S1	C6	H7	68.3°	90.0°
O3	C9	N1	C8	177.0°	90.0°
O3	C9	N1	H1	3.0°	90.0°
O3	C9	N2	H2	0.7°	90.0°
C9	N1	C8	H1	180.0°	90.0°
C9	N1	C8	C7	124.4°	90.0°
N1	C9	N2	H2	168.4°	90.0°
C9	N1	C8	H4	110.1°	90.0°
N1	C8	C7	H4	126.4°	90.0°
N1	C8	C10	H3	125.4°	90.0°
N1	C8	C7	H5	39.9°	90.0°
N1	C8	C7	H6	161.0°	90.0°
C7	C8	N1	H1	55.5°	90.0°
C7	C8	C10	H3	124.8°	90.0°
C8	C7	H5	H6	121.5°	90.0°
H1	N1	C8	H4	69.9°	90.0°
H2	N2	C10	H3	63.4°	90.0°
H3	C10	C8	H4	2.9°	90.0°
H3	C10	C6	H7	45.5°	90.0°
H4	C8	C7	H5	86.5°	90.0°
H4	C8	C7	H6	34.6°	90.0°
H7	C6	C5	H8	64.1°	90.0°
H7	C6	C5	H9	178.3°	90.0°
H8	C5	C4	H10	176.7°	90.0°
H8	C5	C4	H11	57.2°	90.0°
H9	C5	C4	H10	65.6°	90.0°
H9	C5	C4	H11	174.9°	90.0°
H10	C4	C3	H12	175.6°	90.0°
H10	C4	C3	H13	53.9°	90.0°
H11	C4	C3	H12	64.8°	90.0°
H11	C4	C3	H13	173.5°	90.0°
H12	C3	C2	H14	83.1°	90.0°
H12	C3	C2	H15	158.3°	90.0°
H13	C3	C2	H14	38.7°	90.0°
H13	C3	C2	H15	79.9°	90.0°
H16	N6	C27	H17	153.5°	90.0°
H16	N6	C27	H37	37.7°	90.0°
H17	C27	C12	H18	162.5°	90.0°
H17	C27	C12	H38	79.8°	90.0°
H18	C12	C11	H19	122.1°	90.0°
H18	C12	C11	H20	121.8°	90.0°
H18	C12	C27	H37	46.7°	90.0°
H19	C11	C12	H38	4.5°	90.0°
H20	C11	C12	H38	120.5°	90.0°
H21	C26	C25	H23	55.9°	90.0°
H21	C26	C25	H24	174.1°	90.0°
H22	C26	C25	H23	63.0°	90.0°
H22	C26	C25	H24	55.2°	90.0°
H25	C23	C22	H26	1.4°	90.0°
H26	C22	C21	H27	3.0°	90.0°
H27	C21	C20	H28	3.5°	90.0°
H29	C19	C18	H31	168.4°	90.0°
H29	C19	C18	H32	52.1°	90.0°
H30	C19	C18	H31	50.7°	90.0°
H30	C19	C18	H32	65.6°	90.0°
H33	C16	C15	H34	2.5°	90.0°
H34	C15	C14	H35	1.3°	90.0°
H35	C14	C13	H36	0.2°	90.0°
H37	C27	C12	H38	164.4°	90.0°

Release date:	2016-07-20
Definition date:	2016-05-26
Last modified:	2016-07-15
Release status:	REL
Processing site:	EBI
Derived from:	5K67