RKM

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
C23	C24	doub	0.00Å	1.36Å	Aromatic
C23	C22	sing	0.00Å	1.41Å	Aromatic
C24	C25	sing	0.00Å	1.41Å	Aromatic
N6	C22	sing	0.00Å	1.34Å	Aromatic
N6	C21	doub	0.00Å	1.31Å	Aromatic
C22	C19	doub	0.00Å	1.44Å	Aromatic
C25	N7	sing	0.00Å	1.38Å	Aromatic
C25	C26	doub	0.00Å	1.43Å	Aromatic
N7	C27	doub	0.00Å	1.33Å	Aromatic
C21	C20	sing	0.00Å	1.41Å	Aromatic
C19	C26	sing	0.00Å	1.40Å	Aromatic
C19	N5	sing	0.00Å	1.38Å	Aromatic
C26	N8	sing	0.00Å	1.38Å	Aromatic
C27	C28	sing	0.00Å	1.42Å	Aromatic
C20	N5	doub	0.00Å	1.33Å	Aromatic
N5	RU	sing	0.00Å	2.00Å
N8	C28	doub	0.00Å	1.31Å	Aromatic
N8	RU	sing	0.00Å	2.02Å
C38	C37	sing	0.00Å	1.40Å	Aromatic
C38	N12	doub	0.00Å	1.31Å	Aromatic
C37	N11	doub	0.00Å	1.32Å	Aromatic
C12	C11	sing	0.00Å	1.37Å	Aromatic
C12	N1	doub	0.00Å	1.36Å	Aromatic
N12	RU	sing	0.00Å	2.06Å
N12	C36	sing	0.00Å	1.39Å	Aromatic
RU	N1	sing	0.00Å	2.05Å
RU	N2	sing	0.00Å	2.04Å
RU	N9	sing	0.00Å	2.02Å
N11	C35	sing	0.00Å	1.37Å	Aromatic
C11	C9	doub	0.00Å	1.39Å	Aromatic
N1	C10	sing	0.00Å	1.38Å	Aromatic
C36	C35	doub	0.00Å	1.38Å	Aromatic
C36	C29	sing	0.00Å	1.42Å	Aromatic
C35	C34	sing	0.00Å	1.41Å	Aromatic
C9	C8	sing	0.00Å	1.40Å	Aromatic
C10	C8	doub	0.00Å	1.41Å	Aromatic
C10	C1	sing	0.00Å	1.41Å	Aromatic
N2	C1	sing	0.00Å	1.39Å	Aromatic
N2	C2	doub	0.00Å	1.36Å	Aromatic
C8	C7	sing	0.00Å	1.42Å	Aromatic
C1	C5	doub	0.00Å	1.40Å	Aromatic
C2	C3	sing	0.00Å	1.37Å	Aromatic
N9	C29	sing	0.00Å	1.39Å	Aromatic
N9	C30	doub	0.00Å	1.32Å	Aromatic
C29	C32	doub	0.00Å	1.43Å	Aromatic
C34	C33	doub	0.00Å	1.38Å	Aromatic
C3	C4	doub	0.00Å	1.40Å	Aromatic
C7	N4	sing	0.00Å	1.36Å	Aromatic
C7	C6	doub	0.00Å	1.43Å	Aromatic
C5	C4	sing	0.00Å	1.38Å	Aromatic
C5	C6	sing	0.00Å	1.46Å	Aromatic
C30	C31	sing	0.00Å	1.40Å	Aromatic
N4	C13	doub	0.00Å	1.33Å	Aromatic
C6	N3	sing	0.00Å	1.33Å	Aromatic
C32	C33	sing	0.00Å	1.42Å	Aromatic
C32	N10	sing	0.00Å	1.35Å	Aromatic
C31	N10	doub	0.00Å	1.33Å	Aromatic
C13	C14	sing	0.00Å	1.38Å	Aromatic
C13	C15	sing	0.00Å	1.44Å	Aromatic
N3	C15	doub	0.00Å	1.35Å	Aromatic
C14	C18	doub	0.00Å	1.38Å	Aromatic
C15	C16	sing	0.00Å	1.40Å	Aromatic
C18	C17	sing	0.00Å	1.39Å	Aromatic
C16	C17	doub	0.00Å	1.36Å	Aromatic
C17	C39	sing	0.00Å	1.54Å
C14	H14	sing	0.00Å	1.08Å
C9	H9	sing	0.00Å	1.08Å
C11	H11	sing	0.00Å	1.08Å
C12	H12	sing	0.00Å	1.08Å
C18	H18	sing	0.00Å	1.08Å
C16	H16	sing	0.00Å	1.08Å
C4	H4	sing	0.00Å	1.08Å
C3	H3	sing	0.00Å	1.08Å
C2	H2	sing	0.00Å	1.08Å
C38	H38	sing	0.00Å	1.08Å
C20	H20	sing	0.00Å	1.08Å
C21	H21	sing	0.00Å	1.08Å
C23	H23	sing	0.00Å	1.08Å
C24	H24	sing	0.00Å	1.08Å
C27	H27	sing	0.00Å	1.08Å
C28	H28	sing	0.00Å	1.08Å
C30	H30	sing	0.00Å	1.08Å
C31	H31	sing	0.00Å	1.08Å
C33	H33	sing	0.00Å	1.08Å
C34	H34	sing	0.00Å	1.08Å
C37	H37	sing	0.00Å	1.08Å
C39	H391	sing	0.00Å	1.10Å
C39	H39	sing	0.00Å	1.10Å
C39	H392	sing	0.00Å	1.10Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
C24	C23	C22	122.6°	90.0°
C23	C24	C25	118.5°	90.0°
C24	C23	H23	118.7°	90.0°
C23	C24	H24	120.8°	90.0°
C23	C22	N6	122.0°	90.0°
C23	C22	C19	119.3°	90.0°
C22	C23	H23	118.7°	90.0°
C24	C25	N7	119.1°	90.0°
C24	C25	C26	121.4°	90.0°
C25	C24	H24	120.8°	90.0°
C22	N6	C21	117.4°	90.0°
N6	C22	C19	118.6°	90.0°
N6	C21	C20	122.6°	90.0°
N6	C21	H21	118.7°	90.0°
C22	C19	C26	118.4°	90.0°
C22	C19	N5	125.0°	90.0°
N7	C25	C26	119.5°	90.0°
C25	N7	C27	117.9°	90.0°
C25	C26	C19	119.6°	90.0°
C25	C26	N8	121.8°	90.0°
N7	C27	C28	120.8°	90.0°
N7	C27	H27	119.6°	90.0°
C21	C20	N5	125.0°	90.0°
C21	C20	H20	117.5°	90.0°
C20	C21	H21	118.7°	90.0°
C26	C19	N5	116.3°	90.0°
C19	C26	N8	118.3°	90.0°
C19	N5	C20	110.5°	90.0°
C19	N5	RU	111.9°	90.0°
C26	N8	C28	115.5°	90.0°
C26	N8	RU	110.1°	90.0°
C27	C28	N8	124.1°	90.0°
C28	C27	H27	119.6°	90.0°
C27	C28	H28	117.9°	90.0°
C20	N5	RU	137.0°	90.0°
N5	C20	H20	117.5°	90.0°
N5	RU	N8	83.2°	90.0°
N5	RU	N12	94.3°	90.0°
N5	RU	N1	91.4°	90.0°
N5	RU	N2	92.8°	90.0°
N5	RU	N9	174.9°	90.0°
C28	N8	RU	133.9°	90.0°
N8	C28	H28	117.9°	90.0°
N8	RU	N12	88.5°	90.0°
N8	RU	N1	94.9°	90.0°
N8	RU	N2	174.0°	90.0°
N8	RU	N9	93.1°	90.0°
C37	C38	N12	121.7°	90.0°
C38	C37	N11	124.1°	90.0°
C37	C38	H38	119.2°	90.0°
C38	C37	H37	117.9°	90.0°
C38	N12	RU	133.5°	90.0°
C38	N12	C36	114.6°	90.0°
N12	C38	H38	119.2°	90.0°
C37	N11	C35	115.9°	90.0°
N11	C37	H37	118.0°	90.0°
C11	C12	N1	121.8°	90.0°
C12	C11	C9	121.4°	90.0°
C12	C11	H11	119.3°	90.0°
C11	C12	H12	119.1°	90.0°
C12	N1	RU	128.8°	90.0°
C12	N1	C10	117.8°	90.0°
N1	C12	H12	119.1°	90.0°
RU	N12	C36	111.9°	90.0°
N12	RU	N1	173.7°	90.0°
N12	RU	N2	96.2°	90.0°
N12	RU	N9	82.0°	90.0°
N12	C36	C35	123.7°	90.0°
N12	C36	C29	116.0°	90.0°
N1	RU	N2	80.8°	90.0°
N1	RU	N9	92.5°	90.0°
RU	N1	C10	112.3°	90.0°
N2	RU	N9	91.2°	90.0°
RU	N2	C1	113.7°	90.0°
RU	N2	C2	129.9°	90.0°
RU	N9	C29	112.1°	90.0°
RU	N9	C30	132.6°	90.0°
N11	C35	C36	119.9°	90.0°
N11	C35	C34	121.6°	90.0°
C11	C9	C8	118.3°	90.0°
C11	C9	H9	120.8°	90.0°
C9	C11	H11	119.3°	90.0°
N1	C10	C8	121.8°	90.0°
N1	C10	C1	117.3°	90.0°
C35	C36	C29	120.3°	90.0°
C36	C35	C34	118.5°	90.0°
C36	C29	N9	117.8°	90.0°
C36	C29	C32	121.1°	90.0°
C35	C34	C33	122.5°	90.0°
C35	C34	H34	118.7°	90.0°
C9	C8	C10	118.5°	90.0°
C9	C8	C7	121.8°	90.0°
C8	C9	H9	120.8°	90.0°
C8	C10	C1	120.6°	90.0°
C10	C8	C7	119.7°	90.0°
C10	C1	N2	115.1°	90.0°
C10	C1	C5	121.6°	90.0°
C1	N2	C2	115.8°	90.0°
N2	C1	C5	123.1°	90.0°
N2	C2	C3	124.0°	90.0°
N2	C2	H2	118.0°	90.0°
C8	C7	N4	120.2°	90.0°
C8	C7	C6	119.9°	90.0°
C1	C5	C4	118.2°	90.0°
C1	C5	C6	118.4°	90.0°
C2	C3	C4	118.9°	90.0°
C2	C3	H3	120.5°	90.0°
C3	C2	H2	118.0°	90.0°
C29	N9	C30	114.9°	90.0°
N9	C29	C32	121.1°	90.0°
N9	C30	C31	123.3°	90.0°
N9	C30	H30	118.3°	90.0°
C29	C32	C33	117.1°	90.0°
C29	C32	N10	122.0°	90.0°
C34	C33	C32	120.4°	90.0°
C34	C33	H33	119.8°	90.0°
C33	C34	H34	118.7°	90.0°
C3	C4	C5	119.7°	90.0°
C3	C4	H4	120.2°	90.0°
C4	C3	H3	120.6°	90.0°
N4	C7	C6	119.9°	90.0°
C7	N4	C13	118.5°	90.0°
C7	C6	C5	119.7°	90.0°
C7	C6	N3	120.8°	90.0°
C4	C5	C6	123.4°	90.0°
C5	C4	H4	120.1°	90.0°
C5	C6	N3	119.5°	90.0°
C30	C31	N10	123.3°	90.0°
C31	C30	H30	118.3°	90.0°
C30	C31	H31	118.3°	90.0°
N4	C13	C14	120.4°	90.0°
N4	C13	C15	122.4°	90.0°
C6	N3	C15	120.4°	90.0°
C33	C32	N10	120.9°	90.0°
C32	C33	H33	119.8°	90.0°
C32	N10	C31	115.3°	90.0°
N10	C31	H31	118.3°	90.0°
C14	C13	C15	117.2°	90.0°
C13	C14	C18	119.0°	90.0°
C13	C14	H14	120.5°	90.0°
C13	C15	N3	118.0°	90.0°
C13	C15	C16	122.5°	90.0°
N3	C15	C16	119.4°	90.0°
C14	C18	C17	123.7°	90.0°
C18	C14	H14	120.5°	90.0°
C14	C18	H18	118.2°	90.0°
C15	C16	C17	118.2°	90.0°
C15	C16	H16	120.9°	90.0°
C18	C17	C16	119.3°	90.0°
C18	C17	C39	123.6°	90.0°
C17	C18	H18	118.1°	90.0°
C16	C17	C39	116.9°	90.0°
C17	C16	H16	120.9°	90.0°
C17	C39	H391	109.5°	90.0°
C17	C39	H39	109.5°	90.0°
C17	C39	H392	109.5°	90.0°
H391	C39	H39	109.4°	90.0°
H391	C39	H392	109.5°	90.0°
H39	C39	H392	109.5°	90.0°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
C24	C23	C22	H23	180.0°	90.0°
C23	C24	C25	H24	180.0°	90.0°
C24	C23	C22	N6	175.8°	90.0°
C24	C23	C22	C19	0.5°	90.0°
C23	C24	C25	N7	179.8°	90.0°
C23	C24	C25	C26	3.5°	90.0°
C22	C23	C24	C25	0.5°	90.0°
C23	C22	N6	C19	176.3°	90.0°
C23	C22	N6	C21	179.6°	90.0°
C23	C22	C19	C26	1.4°	90.0°
C23	C22	C19	N5	176.0°	90.0°
C22	C23	C24	H24	179.5°	90.0°
C24	C25	N7	C26	176.3°	90.0°
C24	C25	N7	C27	176.9°	90.0°
C24	C25	C26	C19	5.5°	90.0°
C24	C25	C26	N8	179.9°	90.0°
C25	C24	C23	H23	179.5°	90.0°
C22	N6	C21	C20	3.2°	90.0°
N6	C22	C19	C26	177.8°	90.0°
N6	C22	C19	N5	7.6°	90.0°
C22	N6	C21	H21	176.8°	90.0°
N6	C22	C23	H23	4.2°	90.0°
C21	N6	C22	C19	3.3°	90.0°
N6	C21	C20	H21	180.0°	90.0°
N6	C21	C20	N5	7.4°	90.0°
N6	C21	C20	H20	172.7°	90.0°
C22	C19	C26	C25	4.3°	90.0°
C22	C19	C26	N5	175.1°	90.0°
C22	C19	C26	N8	178.9°	90.0°
C22	C19	N5	C20	10.3°	90.0°
C22	C19	N5	RU	177.6°	90.0°
C19	C22	C23	H23	179.4°	90.0°
N7	C25	C26	C19	178.3°	90.0°
N7	C25	C26	N8	3.9°	90.0°
C25	N7	C27	C28	0.6°	90.0°
N7	C25	C24	H24	0.2°	90.0°
C25	N7	C27	H27	179.4°	90.0°
C26	C25	N7	C27	0.6°	90.0°
C25	C26	C19	N8	174.6°	90.0°
C25	C26	C19	N5	179.4°	90.0°
C25	C26	N8	C28	6.9°	90.0°
C25	C26	N8	RU	179.7°	90.0°
C26	C25	C24	H24	176.4°	90.0°
N7	C27	C28	H27	180.0°	90.0°
N7	C27	C28	N8	4.2°	90.0°
N7	C27	C28	H28	175.8°	90.0°
C21	C20	N5	C19	10.1°	90.0°
C21	C20	N5	H20	180.0°	90.0°
C21	C20	N5	RU	179.2°	90.0°
C26	C19	N5	C20	175.0°	90.0°
C26	C19	N5	RU	2.9°	90.0°
C19	C26	N8	C28	178.6°	90.0°
C19	C26	N8	RU	5.9°	90.0°
N5	C19	C26	N8	6.1°	90.0°
C19	N5	C20	RU	169.2°	90.0°
C19	N5	RU	N8	0.2°	90.0°
C19	N5	RU	N12	88.2°	90.0°
C19	N5	RU	N1	94.5°	90.0°
C19	N5	RU	N2	175.3°	90.0°
C19	N5	RU	N9	44.6°	90.0°
C19	N5	C20	H20	169.9°	90.0°
C26	N8	C28	C27	7.1°	90.0°
C26	N8	RU	N5	3.2°	90.0°
C26	N8	C28	RU	170.5°	90.0°
C26	N8	RU	N12	97.7°	90.0°
C26	N8	RU	N1	87.6°	90.0°
C26	N8	RU	N2	44.6°	90.0°
C26	N8	RU	N9	179.6°	90.0°
C26	N8	C28	H28	172.9°	90.0°
C27	C28	N8	H28	180.0°	90.0°
C27	C28	N8	RU	177.6°	90.0°
C20	N5	RU	N8	168.8°	90.0°
C20	N5	RU	N12	80.9°	90.0°
C20	N5	RU	N1	96.4°	90.0°
C20	N5	RU	N2	15.6°	90.0°
C20	N5	RU	N9	124.5°	90.0°
N5	C20	C21	H21	172.6°	90.0°
N5	RU	N8	C28	174.1°	90.0°
N5	RU	N8	N12	94.5°	90.0°
N5	RU	N8	N1	90.8°	90.0°
N5	RU	N8	N2	47.8°	90.0°
N5	RU	N8	N9	176.4°	90.0°
N5	RU	N12	C38	8.0°	90.0°
N5	RU	N1	C12	95.7°	90.0°
N5	RU	N12	N1	154.6°	90.0°
N5	RU	N12	N2	93.3°	90.0°
N5	RU	N12	N9	176.4°	90.0°
N5	RU	N12	C36	173.7°	90.0°
N5	RU	N1	N2	92.6°	90.0°
N5	RU	N1	N9	176.6°	90.0°
N5	RU	N2	N9	176.7°	90.0°
N5	RU	N1	C10	96.5°	90.0°
N5	RU	N2	C1	89.6°	90.0°
N5	RU	N2	C2	81.2°	90.0°
N5	RU	N9	C29	39.9°	90.0°
N5	RU	N9	C30	132.3°	90.0°
RU	N5	C20	H20	0.8°	90.0°
C28	N8	RU	N12	91.4°	90.0°
C28	N8	RU	N1	83.3°	90.0°
C28	N8	RU	N2	126.2°	90.0°
C28	N8	RU	N9	9.5°	90.0°
N8	C28	C27	H27	175.8°	90.0°
N8	RU	N12	C38	91.1°	90.0°
N8	RU	N1	C12	12.4°	90.0°
N8	RU	N12	N1	122.4°	90.0°
N8	RU	N12	N2	176.3°	90.0°
N8	RU	N12	N9	93.4°	90.0°
N8	RU	N12	C36	90.6°	90.0°
N8	RU	N1	N2	175.9°	90.0°
N8	RU	N1	N9	93.4°	90.0°
N8	RU	N2	N9	135.8°	90.0°
N8	RU	N1	C10	179.8°	90.0°
N8	RU	N2	C1	42.1°	90.0°
N8	RU	N2	C2	128.7°	90.0°
N8	RU	N9	C29	84.0°	90.0°
N8	RU	N9	C30	88.2°	90.0°
RU	N8	C28	H28	2.4°	90.0°
C37	C38	N12	H38	180.0°	90.0°
C38	C37	N11	H37	180.0°	90.0°
C37	C38	N12	RU	178.2°	90.0°
C37	C38	N12	C36	3.5°	90.0°
C38	C37	N11	C35	0.2°	90.0°
N12	C38	C37	N11	2.2°	90.0°
C38	N12	RU	C36	178.3°	90.0°
C38	N12	RU	N1	146.5°	90.0°
C38	N12	RU	N2	85.3°	90.0°
C38	N12	RU	N9	175.5°	90.0°
C38	N12	C36	C35	2.9°	90.0°
C38	N12	C36	C29	177.6°	90.0°
N12	C38	C37	H37	177.8°	90.0°
C37	N11	C35	C36	0.8°	90.0°
C37	N11	C35	C34	178.4°	90.0°
N11	C37	C38	H38	177.8°	90.0°
C11	C12	N1	H12	180.0°	90.0°
C11	C12	N1	RU	173.4°	90.0°
C12	C11	C9	H11	180.0°	90.0°
C11	C12	N1	C10	6.2°	90.0°
C12	C11	C9	C8	0.1°	90.0°
C12	C11	C9	H9	179.9°	90.0°
C12	N1	RU	N12	109.6°	90.0°
C12	N1	RU	C10	167.7°	90.0°
C12	N1	RU	N2	171.7°	90.0°
C12	N1	RU	N9	80.9°	90.0°
N1	C12	C11	C9	2.6°	90.0°
C12	N1	C10	C8	7.5°	90.0°
C12	N1	C10	C1	178.0°	90.0°
N1	C12	C11	H11	177.4°	90.0°
N12	RU	N1	N2	62.0°	90.0°
N12	RU	N1	N9	28.7°	90.0°
N12	RU	N2	N9	82.1°	90.0°
N12	RU	N1	C10	58.1°	90.0°
RU	N12	C36	C35	178.4°	90.0°
RU	N12	C36	C29	1.0°	90.0°
N12	RU	N2	C1	175.7°	90.0°
N12	RU	N2	C2	13.5°	90.0°
N12	RU	N9	C29	4.0°	90.0°
N12	RU	N9	C30	176.2°	90.0°
RU	N12	C38	H38	1.8°	90.0°
C36	N12	RU	N1	31.8°	90.0°
C36	N12	RU	N2	93.1°	90.0°
C36	N12	RU	N9	2.8°	90.0°
N12	C36	C35	N11	0.7°	90.0°
N12	C36	C35	C29	179.5°	90.0°
N12	C36	C35	C34	177.0°	90.0°
N12	C36	C29	N9	2.5°	90.0°
N12	C36	C29	C32	179.6°	90.0°
C36	N12	C38	H38	176.5°	90.0°
N1	RU	N2	N9	92.3°	90.0°
RU	N1	C10	C8	176.7°	90.0°
RU	N1	C10	C1	8.8°	90.0°
N1	RU	N2	C1	1.3°	90.0°
N1	RU	N2	C2	172.1°	90.0°
N1	RU	N9	C29	179.0°	90.0°
N1	RU	N9	C30	6.8°	90.0°
RU	N1	C12	H12	6.6°	90.0°
N2	RU	N1	C10	3.9°	90.0°
RU	N2	C1	C10	6.4°	90.0°
RU	N2	C1	C2	172.2°	90.0°
RU	N2	C1	C5	178.6°	90.0°
RU	N2	C2	C3	175.5°	90.0°
N2	RU	N9	C29	100.2°	90.0°
N2	RU	N9	C30	87.6°	90.0°
RU	N2	C2	H2	4.5°	90.0°
N9	RU	N1	C10	86.8°	90.0°
RU	N9	C29	C36	4.8°	90.0°
N9	RU	N2	C1	93.7°	90.0°
N9	RU	N2	C2	95.5°	90.0°
RU	N9	C29	C30	173.7°	90.0°
RU	N9	C29	C32	177.4°	90.0°
RU	N9	C30	C31	176.8°	90.0°
RU	N9	C30	H30	3.2°	90.0°
N11	C35	C36	C34	177.7°	90.0°
N11	C35	C36	C29	179.8°	90.0°
N11	C35	C34	C33	179.1°	90.0°
N11	C35	C34	H34	0.9°	90.0°
C35	N11	C37	H37	179.9°	90.0°
C11	C9	C8	H9	180.0°	90.0°
C11	C9	C8	C10	1.1°	90.0°
C11	C9	C8	C7	179.0°	90.0°
C9	C11	C12	H12	177.4°	90.0°
N1	C10	C8	C9	5.0°	90.0°
N1	C10	C8	C1	174.3°	90.0°
N1	C10	C1	N2	10.2°	90.0°
N1	C10	C8	C7	175.1°	90.0°
N1	C10	C1	C5	174.7°	90.0°
C10	N1	C12	H12	173.7°	90.0°
C35	C36	C29	N9	178.0°	90.0°
C35	C36	C29	C32	0.1°	90.0°
C36	C35	C34	C33	3.2°	90.0°
C36	C35	C34	H34	176.8°	90.0°
C29	C36	C35	C34	2.5°	90.0°
C36	C29	N9	C32	177.9°	90.0°
C36	C29	N9	C30	178.5°	90.0°
C36	C29	C32	C33	2.1°	90.0°
C36	C29	C32	N10	179.5°	90.0°
C35	C34	C33	H34	180.0°	90.0°
C35	C34	C33	C32	1.2°	90.0°
C35	C34	C33	H33	178.8°	90.0°
C9	C8	C10	C7	179.9°	90.0°
C9	C8	C10	C1	179.3°	90.0°
C9	C8	C7	N4	0.5°	90.0°
C9	C8	C7	C6	178.4°	90.0°
C8	C9	C11	H11	179.9°	90.0°
C8	C10	C1	N2	175.2°	90.0°
C8	C10	C1	C5	0.1°	90.0°
C10	C8	C7	N4	179.4°	90.0°
C10	C8	C7	C6	1.8°	90.0°
C10	C8	C9	H9	178.9°	90.0°
C10	C1	N2	C5	175.0°	90.0°
C10	C1	N2	C2	178.6°	90.0°
C1	C10	C8	C7	0.8°	90.0°
C10	C1	C5	C4	179.1°	90.0°
C10	C1	C5	C6	0.4°	90.0°
C1	N2	C2	C3	4.8°	90.0°
N2	C1	C5	C4	4.4°	90.0°
N2	C1	C5	C6	175.1°	90.0°
C1	N2	C2	H2	175.1°	90.0°
C2	N2	C1	C5	6.4°	90.0°
N2	C2	C3	H2	180.0°	90.0°
N2	C2	C3	C4	1.2°	90.0°
N2	C2	C3	H3	178.8°	90.0°
C8	C7	N4	C6	178.8°	90.0°
C8	C7	C6	C5	2.0°	90.0°
C8	C7	N4	C13	179.1°	90.0°
C8	C7	C6	N3	178.7°	90.0°
C7	C8	C9	H9	1.0°	90.0°
C1	C5	C4	C3	0.4°	90.0°
C1	C5	C6	C7	1.3°	90.0°
C1	C5	C4	C6	179.4°	90.0°
C1	C5	C6	N3	179.4°	90.0°
C1	C5	C4	H4	179.6°	90.0°
C2	C3	C4	H3	180.0°	90.0°
C2	C3	C4	C5	1.1°	90.0°
C2	C3	C4	H4	178.9°	90.0°
C29	N9	C30	C31	4.8°	90.0°
N9	C29	C32	C33	179.9°	90.0°
N9	C29	C32	N10	1.7°	90.0°
C29	N9	C30	H30	175.3°	90.0°
C30	N9	C29	C32	3.7°	90.0°
N9	C30	C31	H30	180.0°	90.0°
N9	C30	C31	N10	4.0°	90.0°
N9	C30	C31	H31	176.1°	90.0°
C29	C32	C33	C34	1.5°	90.0°
C29	C32	C33	N10	178.4°	90.0°
C29	C32	N10	C31	0.5°	90.0°
C29	C32	C33	H33	178.5°	90.0°
C34	C33	C32	H33	180.0°	90.0°
C34	C33	C32	N10	179.9°	90.0°
C3	C4	C5	H4	180.0°	90.0°
C3	C4	C5	C6	179.0°	90.0°
C4	C3	C2	H2	178.7°	90.0°
N4	C7	C6	C5	179.1°	90.0°
N4	C7	C6	N3	0.2°	90.0°
C7	N4	C13	C14	179.8°	90.0°
C7	N4	C13	C15	0.3°	90.0°
C7	C6	C5	C4	178.1°	90.0°
C7	C6	C5	N3	179.3°	90.0°
C6	C7	N4	C13	0.3°	90.0°
C7	C6	N3	C15	1.2°	90.0°
C4	C5	C6	N3	1.2°	90.0°
C5	C4	C3	H3	178.9°	90.0°
C5	C6	N3	C15	178.1°	90.0°
C6	C5	C4	H4	1.0°	90.0°
C30	C31	N10	C32	1.5°	90.0°
C30	C31	N10	H31	180.0°	90.0°
N4	C13	C14	C15	179.9°	90.0°
N4	C13	C15	N3	1.3°	90.0°
N4	C13	C14	C18	178.5°	90.0°
N4	C13	C15	C16	179.4°	90.0°
N4	C13	C14	H14	1.5°	90.0°
C6	N3	C15	C13	1.7°	90.0°
C6	N3	C15	C16	179.0°	90.0°
C33	C32	N10	C31	178.8°	90.0°
C32	C33	C34	H34	178.8°	90.0°
C32	N10	C31	H31	178.5°	90.0°
N10	C32	C33	H33	0.1°	90.0°
N10	C31	C30	H30	176.0°	90.0°
C14	C13	C15	N3	178.9°	90.0°
C13	C14	C18	H14	180.0°	90.0°
C14	C13	C15	C16	0.4°	90.0°
C13	C14	C18	C17	2.5°	90.0°
C13	C14	C18	H18	177.5°	90.0°
C13	C15	N3	C16	179.3°	90.0°
C15	C13	C14	C18	1.4°	90.0°
C13	C15	C16	C17	0.5°	90.0°
C15	C13	C14	H14	178.7°	90.0°
C13	C15	C16	H16	179.5°	90.0°
N3	C15	C16	C17	178.8°	90.0°
N3	C15	C16	H16	1.2°	90.0°
C14	C18	C17	H18	180.0°	90.0°
C14	C18	C17	C16	2.5°	90.0°
C14	C18	C17	C39	179.0°	90.0°
C15	C16	C17	C18	1.4°	90.0°
C15	C16	C17	H16	180.0°	90.0°
C15	C16	C17	C39	178.1°	90.0°
C18	C17	C16	C39	176.7°	90.0°
C17	C18	C14	H14	177.5°	90.0°
C18	C17	C16	H16	178.6°	90.0°
C18	C17	C39	H391	92.0°	90.0°
C18	C17	C39	H39	148.0°	90.0°
C18	C17	C39	H392	28.0°	90.0°
C16	C17	C18	H18	177.5°	90.0°
C16	C17	C39	H391	91.5°	90.0°
C16	C17	C39	H39	28.5°	90.0°
C16	C17	C39	H392	148.5°	90.0°
C39	C17	C18	H18	1.0°	90.0°
C39	C17	C16	H16	1.9°	90.0°
C17	C39	H391	H39	120.0°	90.0°
C17	C39	H391	H392	120.0°	90.0°
C17	C39	H39	H392	120.0°	90.0°
H14	C14	C18	H18	2.5°	90.0°
H9	C9	C11	H11	0.0°	90.0°
H11	C11	C12	H12	2.6°	90.0°
H4	C4	C3	H3	1.1°	90.0°
H3	C3	C2	H2	1.3°	90.0°
H38	C38	C37	H37	2.2°	90.0°
H20	C20	C21	H21	7.3°	90.0°
H23	C23	C24	H24	0.5°	90.0°
H27	C27	C28	H28	4.2°	90.0°
H30	C30	C31	H31	3.9°	90.0°
H33	C33	C34	H34	1.2°	90.0°
H391	C39	H39	H392	120.0°	90.0°

Release date:	2015-05-13
Definition date:	2014-11-25
Last modified:	2015-05-08
Release status:	REL
Processing site:	EBI
Derived from:	4X18