BWU

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
C10	C22	doub	0.00Å	1.38Å	Aromatic
C10	C9	sing	0.00Å	1.39Å	Aromatic
C13	C12	doub	0.00Å	1.39Å	Aromatic
C13	C14	sing	0.00Å	1.39Å	Aromatic
C15	C23	sing	0.00Å	1.38Å	Aromatic
C15	C14	doub	0.00Å	1.39Å	Aromatic
C20	C19	doub	0.00Å	1.39Å	Aromatic
C20	C24	sing	0.00Å	1.39Å	Aromatic
C11	C12	sing	0.00Å	1.39Å	Aromatic
C11	C23	doub	0.00Å	1.39Å	Aromatic
C19	C18	sing	0.00Å	1.39Å	Aromatic
C44	C41	doub	0.00Å	1.38Å
C44	C43	sing	0.00Å	1.40Å
C41	C42	sing	0.00Å	1.37Å
C43	N4	doub	0.00Å	1.35Å
C43	C28	sing	0.00Å	1.50Å
N4	C42	sing	0.00Å	1.34Å
N4	CO	sing	0.00Å	1.82Å
C42	C40	doub	0.00Å	1.39Å
C40	C37	sing	0.00Å	1.38Å
C40	N3	sing	0.00Å	1.35Å
C37	C38	doub	0.00Å	1.37Å
N3	C39	sing	0.00Å	1.36Å
N3	CO	sing	0.00Å	1.73Å
C39	C38	sing	0.00Å	1.39Å
C39	C26	doub	0.00Å	1.48Å
C26	C22	sing	0.00Å	1.49Å
C26	C25	sing	0.00Å	1.34Å
C22	C6	sing	0.00Å	1.39Å	Aromatic
C9	C8	doub	0.00Å	1.39Å	Aromatic
C8	C7	sing	0.00Å	1.39Å	Aromatic
C7	C6	doub	0.00Å	1.39Å	Aromatic
C28	C24	sing	0.00Å	1.50Å
C28	C27	doub	0.00Å	1.34Å
C24	C16	doub	0.00Å	1.38Å	Aromatic
C18	C17	doub	0.00Å	1.39Å	Aromatic
C17	C16	sing	0.00Å	1.39Å	Aromatic
C27	C23	sing	0.00Å	1.49Å
C27	C29	sing	0.00Å	1.49Å
C29	C32	doub	0.00Å	1.40Å	Aromatic
C29	N1	sing	0.00Å	1.35Å	Aromatic
C32	C31	sing	0.00Å	1.38Å	Aromatic
C31	C30	doub	0.00Å	1.38Å	Aromatic
C30	N1	sing	0.00Å	1.35Å	Aromatic
C30	C36	sing	0.00Å	1.39Å
N1	CO	sing	0.00Å	1.86Å
C36	N2	doub	0.00Å	1.34Å
C36	C35	sing	0.00Å	1.38Å
N2	C33	sing	0.00Å	1.35Å
N2	CO	sing	0.00Å	1.84Å
C35	C34	doub	0.00Å	1.37Å
C34	C33	sing	0.00Å	1.40Å
C33	C25	doub	0.00Å	1.49Å
C25	C21	sing	0.00Å	1.50Å
C21	C1	doub	0.00Å	1.39Å	Aromatic
C21	C5	sing	0.00Å	1.38Å	Aromatic
C1	C2	sing	0.00Å	1.39Å	Aromatic
C5	C4	doub	0.00Å	1.40Å	Aromatic
C4	C3	sing	0.00Å	1.39Å	Aromatic
C3	C2	doub	0.00Å	1.39Å	Aromatic
C10	H1	sing	0.00Å	1.08Å
C13	H2	sing	0.00Å	1.08Å
C15	H3	sing	0.00Å	1.08Å
C20	H4	sing	0.00Å	1.08Å
C11	H5	sing	0.00Å	1.08Å
C12	H6	sing	0.00Å	1.08Å
C19	H7	sing	0.00Å	1.08Å
C44	H8	sing	0.00Å	1.08Å
C41	H9	sing	0.00Å	1.08Å
C37	H11	sing	0.00Å	1.08Å
C38	H13	sing	0.00Å	1.08Å
C9	H14	sing	0.00Å	1.08Å
C8	H15	sing	0.00Å	1.08Å
C7	H16	sing	0.00Å	1.08Å
C6	H17	sing	0.00Å	1.08Å
C18	H18	sing	0.00Å	1.08Å
C17	H19	sing	0.00Å	1.08Å
C16	H20	sing	0.00Å	1.08Å
C14	H21	sing	0.00Å	1.08Å
C32	H22	sing	0.00Å	1.08Å
C31	H23	sing	0.00Å	1.08Å
C35	H24	sing	0.00Å	1.08Å
C34	H26	sing	0.00Å	1.08Å
C1	H27	sing	0.00Å	1.08Å
C5	H28	sing	0.00Å	1.08Å
C4	H29	sing	0.00Å	1.08Å
C3	H30	sing	0.00Å	1.08Å
C2	H31	sing	0.00Å	1.08Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
C22	C10	C9	119.1°	90.0°
C10	C22	C26	119.9°	90.0°
C10	C22	C6	120.5°	90.0°
C22	C10	H1	120.5°	90.0°
C10	C9	C8	120.4°	90.0°
C9	C10	H1	120.4°	90.0°
C10	C9	H14	119.8°	90.0°
C12	C13	C14	120.1°	90.0°
C13	C12	C11	119.7°	90.0°
C12	C13	H2	120.0°	90.0°
C13	C12	H6	120.2°	90.0°
C13	C14	C15	120.2°	90.0°
C14	C13	H2	119.9°	90.0°
C13	C14	H21	119.9°	90.0°
C23	C15	C14	119.4°	90.0°
C15	C23	C11	120.5°	90.0°
C15	C23	C27	119.8°	90.0°
C23	C15	H3	120.3°	90.0°
C14	C15	H3	120.3°	90.0°
C15	C14	H21	119.9°	90.0°
C19	C20	C24	119.9°	90.0°
C20	C19	C18	120.4°	90.0°
C19	C20	H4	120.0°	90.0°
C20	C19	H7	119.8°	90.0°
C20	C24	C28	120.0°	90.0°
C20	C24	C16	119.9°	90.0°
C24	C20	H4	120.0°	90.0°
C12	C11	C23	120.0°	90.0°
C12	C11	H5	120.0°	90.0°
C11	C12	H6	120.2°	90.0°
C11	C23	C27	119.7°	90.0°
C23	C11	H5	120.0°	90.0°
C19	C18	C17	119.5°	90.0°
C18	C19	H7	119.8°	90.0°
C19	C18	H18	120.2°	90.0°
C41	C44	C43	107.9°	90.0°
C44	C41	C42	104.8°	90.0°
C41	C44	H8	126.1°	90.0°
C44	C41	H9	127.6°	90.0°
C44	C43	N4	108.6°	90.0°
C44	C43	C28	124.0°	90.0°
C43	C44	H8	126.1°	90.0°
C41	C42	N4	112.2°	90.0°
C41	C42	C40	124.3°	90.0°
C42	C41	H9	127.6°	90.0°
N4	C43	C28	127.4°	90.0°
C43	N4	C42	106.6°	90.0°
C43	N4	CO	161.8°	90.0°
C43	C28	C24	118.1°	90.0°
C43	C28	C27	124.3°	90.0°
C42	N4	CO	91.6°	90.0°
N4	C42	C40	123.5°	90.0°
N4	CO	N3	107.9°	90.0°
N4	CO	N1	74.1°	90.0°
N4	CO	N2	175.2°	90.0°
C42	C40	C37	123.9°	90.0°
C42	C40	N3	123.8°	90.0°
C37	C40	N3	112.3°	90.0°
C40	C37	C38	104.8°	90.0°
C40	C37	H11	127.6°	90.0°
C40	N3	C39	105.7°	90.0°
C40	N3	CO	93.2°	90.0°
C37	C38	C39	108.0°	90.0°
C38	C37	H11	127.6°	90.0°
C37	C38	H13	126.0°	90.0°
C39	N3	CO	161.1°	90.0°
N3	C39	C38	109.2°	90.0°
N3	C39	C26	127.6°	90.0°
N3	CO	N1	177.2°	90.0°
N3	CO	N2	76.6°	90.0°
C38	C39	C26	123.2°	90.0°
C39	C38	H13	126.0°	90.0°
C39	C26	C22	116.4°	90.0°
C39	C26	C25	125.2°	90.0°
C22	C26	C25	118.5°	90.0°
C26	C22	C6	119.6°	90.0°
C26	C25	C33	124.8°	90.0°
C26	C25	C21	118.6°	90.0°
C22	C6	C7	120.8°	90.0°
C22	C6	H17	119.6°	90.0°
C9	C8	C7	120.4°	90.0°
C8	C9	H14	119.8°	90.0°
C9	C8	H15	119.8°	90.0°
C8	C7	C6	118.9°	90.0°
C7	C8	H15	119.7°	90.0°
C8	C7	H16	120.6°	90.0°
C6	C7	H16	120.6°	90.0°
C7	C6	H17	119.6°	90.0°
C24	C28	C27	116.2°	90.0°
C28	C24	C16	120.0°	90.0°
C28	C27	C23	118.1°	90.0°
C28	C27	C29	125.2°	90.0°
C24	C16	C17	120.0°	90.0°
C24	C16	H20	120.0°	90.0°
C18	C17	C16	120.3°	90.0°
C17	C18	H18	120.2°	90.0°
C18	C17	H19	119.9°	90.0°
C16	C17	H19	119.9°	90.0°
C17	C16	H20	120.0°	90.0°
C23	C27	C29	115.9°	90.0°
C27	C29	C32	122.7°	90.0°
C27	C29	N1	127.9°	90.0°
C32	C29	N1	109.4°	90.0°
C29	C32	C31	108.1°	90.0°
C29	C32	H22	126.0°	90.0°
C29	N1	C30	105.5°	90.0°
C29	N1	CO	159.2°	90.0°
C32	C31	C30	104.3°	90.0°
C31	C32	H22	126.0°	90.0°
C32	C31	H23	127.8°	90.0°
C31	C30	N1	112.7°	90.0°
C31	C30	C36	123.6°	90.0°
C30	C31	H23	127.8°	90.0°
N1	C30	C36	123.7°	90.0°
C30	N1	CO	95.3°	90.0°
C30	C36	N2	123.0°	90.0°
C30	C36	C35	124.1°	90.0°
N1	CO	N2	101.3°	90.0°
N2	C36	C35	112.9°	90.0°
C36	N2	C33	105.6°	90.0°
C36	N2	CO	96.6°	90.0°
C36	C35	C34	104.5°	90.0°
C36	C35	H24	127.7°	90.0°
C33	N2	CO	157.8°	90.0°
N2	C33	C34	109.5°	90.0°
N2	C33	C25	126.8°	90.0°
C35	C34	C33	107.5°	90.0°
C34	C35	H24	127.8°	90.0°
C35	C34	H26	126.2°	90.0°
C34	C33	C25	123.7°	90.0°
C33	C34	H26	126.3°	90.0°
C33	C25	C21	116.4°	90.0°
C25	C21	C1	120.2°	90.0°
C25	C21	C5	119.9°	90.0°
C1	C21	C5	119.9°	90.0°
C21	C1	C2	120.3°	90.0°
C21	C1	H27	119.8°	90.0°
C21	C5	C4	119.7°	90.0°
C21	C5	H28	120.2°	90.0°
C1	C2	C3	120.2°	90.0°
C2	C1	H27	119.9°	90.0°
C1	C2	H31	119.9°	90.0°
C5	C4	C3	120.5°	90.0°
C4	C5	H28	120.1°	90.0°
C5	C4	H29	119.7°	90.0°
C4	C3	C2	119.3°	90.0°
C3	C4	H29	119.7°	90.0°
C4	C3	H30	120.3°	90.0°
C2	C3	H30	120.3°	90.0°
C3	C2	H31	119.9°	90.0°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
C22	C10	C9	H1	180.0°	90.0°
C10	C22	C26	C39	106.6°	90.0°
C10	C22	C26	C6	180.0°	90.0°
C10	C22	C26	C25	72.6°	90.0°
C22	C10	C9	C8	0.2°	90.0°
C10	C22	C6	C7	0.7°	90.0°
C22	C10	C9	H14	179.8°	90.0°
C10	C22	C6	H17	179.3°	90.0°
C9	C10	C22	C26	179.9°	90.0°
C9	C10	C22	C6	0.0°	90.0°
C10	C9	C8	H14	180.0°	90.0°
C10	C9	C8	C7	0.3°	90.0°
C10	C9	C8	H15	179.7°	90.0°
C12	C13	C14	H2	180.0°	90.0°
C12	C13	C14	C15	0.9°	90.0°
C13	C12	C11	H6	180.0°	90.0°
C13	C12	C11	C23	1.3°	90.0°
C13	C12	C11	H5	178.6°	90.0°
C12	C13	C14	H21	179.1°	90.0°
C13	C14	C15	C23	0.8°	90.0°
C13	C14	C15	H21	180.0°	90.0°
C14	C13	C12	C11	0.2°	90.0°
C13	C14	C15	H3	179.2°	90.0°
C14	C13	C12	H6	179.8°	90.0°
C23	C15	C14	H3	180.0°	90.0°
C15	C23	C11	C12	1.4°	90.0°
C15	C23	C11	C27	179.2°	90.0°
C15	C23	C27	C28	72.6°	90.0°
C15	C23	C27	C29	117.0°	90.0°
C15	C23	C11	H5	178.6°	90.0°
C23	C15	C14	H21	179.2°	90.0°
C14	C15	C23	C11	0.3°	90.0°
C14	C15	C23	C27	179.5°	90.0°
C15	C14	C13	H2	179.2°	90.0°
C19	C20	C24	H4	180.0°	90.0°
C20	C19	C18	H7	180.0°	90.0°
C19	C20	C24	C28	178.9°	90.0°
C19	C20	C24	C16	0.4°	90.0°
C20	C19	C18	C17	1.3°	90.0°
C20	C19	C18	H18	178.7°	90.0°
C24	C20	C19	C18	0.6°	90.0°
C20	C24	C28	C43	96.3°	90.0°
C20	C24	C28	C16	178.5°	90.0°
C20	C24	C28	C27	70.7°	90.0°
C20	C24	C16	C17	0.7°	90.0°
C24	C20	C19	H7	179.4°	90.0°
C20	C24	C16	H20	179.3°	90.0°
C12	C11	C23	H5	180.0°	90.0°
C12	C11	C23	C27	179.4°	90.0°
C11	C12	C13	H2	179.8°	90.0°
C11	C23	C27	C28	108.2°	90.0°
C11	C23	C27	C29	62.2°	90.0°
C11	C23	C15	H3	179.7°	90.0°
C23	C11	C12	H6	178.7°	90.0°
C19	C18	C17	H18	180.0°	90.0°
C19	C18	C17	C16	1.0°	90.0°
C18	C19	C20	H4	179.4°	90.0°
C19	C18	C17	H19	179.0°	90.0°
C41	C44	C43	H8	180.0°	90.0°
C44	C41	C42	H9	180.0°	90.0°
C41	C44	C43	N4	0.7°	90.0°
C41	C44	C43	C28	179.7°	90.0°
C44	C41	C42	N4	0.5°	90.0°
C44	C41	C42	C40	178.7°	90.0°
C43	C44	C41	C42	0.2°	90.0°
C44	C43	N4	C28	178.9°	90.0°
C44	C43	N4	C42	1.0°	90.0°
C44	C43	N4	CO	178.2°	90.0°
C44	C43	C28	C24	16.6°	90.0°
C44	C43	C28	C27	177.6°	90.0°
C43	C44	C41	H9	179.8°	90.0°
C41	C42	N4	C43	0.9°	90.0°
C41	C42	N4	C40	179.2°	90.0°
C41	C42	N4	CO	180.0°	90.0°
C41	C42	C40	C37	1.8°	90.0°
C41	C42	C40	N3	178.3°	90.0°
C42	C41	C44	H8	179.8°	90.0°
C43	N4	C42	CO	179.1°	90.0°
C43	N4	C42	C40	178.3°	90.0°
C43	N4	CO	N3	175.6°	90.0°
N4	C43	C28	C24	164.7°	90.0°
N4	C43	C28	C27	1.1°	90.0°
C43	N4	CO	N1	2.3°	90.0°
C43	N4	CO	N2	15.3°	90.0°
N4	C43	C44	H8	179.3°	90.0°
C28	C43	N4	C42	179.9°	90.0°
C28	C43	N4	CO	2.9°	90.0°
C43	C28	C24	C27	166.9°	90.0°
C43	C28	C24	C16	85.2°	90.0°
C43	C28	C27	C23	172.5°	90.0°
C43	C28	C27	C29	3.1°	90.0°
C28	C43	C44	H8	0.3°	90.0°
N4	C42	C40	C37	179.1°	90.0°
N4	C42	C40	N3	0.8°	90.0°
C42	N4	CO	N3	1.7°	90.0°
C42	N4	CO	N1	179.6°	90.0°
C42	N4	CO	N2	162.0°	90.0°
N4	C42	C41	H9	179.5°	90.0°
CO	N4	C42	C40	0.8°	90.0°
N4	CO	N3	C40	2.0°	90.0°
N4	CO	N3	C39	179.6°	90.0°
N4	CO	N3	N1	134.6°	90.0°
N4	CO	N3	N2	178.3°	90.0°
N4	CO	N1	C29	1.4°	90.0°
N4	CO	N1	C30	179.3°	90.0°
N4	CO	N1	N2	178.5°	90.0°
N4	CO	N2	C36	19.2°	90.0°
N4	CO	N2	C33	164.7°	90.0°
C42	C40	C37	N3	179.9°	90.0°
C42	C40	C37	C38	178.8°	90.0°
C42	C40	N3	C39	179.0°	90.0°
C42	C40	N3	CO	1.8°	90.0°
C40	C42	C41	H9	1.3°	90.0°
C42	C40	C37	H11	1.3°	90.0°
C40	C37	C38	H11	180.0°	90.0°
C37	C40	N3	C39	1.1°	90.0°
C37	C40	N3	CO	178.0°	90.0°
C40	C37	C38	C39	1.0°	90.0°
C40	C37	C38	H13	179.0°	90.0°
N3	C40	C37	C38	1.4°	90.0°
C40	N3	C39	CO	177.4°	90.0°
C40	N3	C39	C38	0.5°	90.0°
C40	N3	C39	C26	179.8°	90.0°
C40	N3	CO	N1	136.6°	90.0°
C40	N3	CO	N2	179.6°	90.0°
N3	C40	C37	H11	178.6°	90.0°
C37	C38	C39	N3	0.4°	90.0°
C37	C38	C39	H13	180.0°	90.0°
C37	C38	C39	C26	179.0°	90.0°
N3	C39	C38	C26	179.4°	90.0°
N3	C39	C26	C22	179.0°	90.0°
N3	C39	C26	C25	0.2°	90.0°
C39	N3	CO	N1	45.8°	90.0°
C39	N3	CO	N2	2.1°	90.0°
N3	C39	C38	H13	179.6°	90.0°
CO	N3	C39	C38	177.0°	90.0°
CO	N3	C39	C26	2.4°	90.0°
N3	CO	N1	C29	136.6°	90.0°
N3	CO	N1	C30	45.5°	90.0°
N3	CO	N1	N2	43.3°	90.0°
N3	CO	N2	C36	179.9°	90.0°
N3	CO	N2	C33	4.0°	90.0°
C38	C39	C26	C22	1.8°	90.0°
C38	C39	C26	C25	179.1°	90.0°
C39	C38	C37	H11	178.9°	90.0°
C39	C26	C22	C25	179.2°	90.0°
C39	C26	C22	C6	73.3°	90.0°
C39	C26	C25	C33	2.0°	90.0°
C39	C26	C25	C21	173.3°	90.0°
C26	C39	C38	H13	1.0°	90.0°
C26	C22	C6	C7	179.4°	90.0°
C22	C26	C25	C33	178.9°	90.0°
C22	C26	C25	C21	5.9°	90.0°
C26	C22	C10	H1	0.1°	90.0°
C26	C22	C6	H17	0.6°	90.0°
C25	C26	C22	C6	107.5°	90.0°
C26	C25	C33	N2	3.9°	90.0°
C26	C25	C33	C34	177.0°	90.0°
C26	C25	C33	C21	175.3°	90.0°
C26	C25	C21	C1	79.8°	90.0°
C26	C25	C21	C5	103.2°	90.0°
C22	C6	C7	C8	1.1°	90.0°
C22	C6	C7	H17	180.0°	90.0°
C6	C22	C10	H1	179.9°	90.0°
C22	C6	C7	H16	178.9°	90.0°
C9	C8	C7	H15	180.0°	90.0°
C9	C8	C7	C6	0.9°	90.0°
C8	C9	C10	H1	179.8°	90.0°
C9	C8	C7	H16	179.1°	90.0°
C8	C7	C6	H16	180.0°	90.0°
C7	C8	C9	H14	179.7°	90.0°
C8	C7	C6	H17	178.9°	90.0°
C6	C7	C8	H15	179.0°	90.0°
C28	C24	C16	C17	179.2°	90.0°
C24	C28	C27	C23	6.5°	90.0°
C24	C28	C27	C29	162.9°	90.0°
C28	C24	C20	H4	1.1°	90.0°
C28	C24	C16	H20	0.8°	90.0°
C27	C28	C24	C16	107.8°	90.0°
C28	C27	C23	C29	170.4°	90.0°
C28	C27	C29	C32	179.0°	90.0°
C28	C27	C29	N1	2.5°	90.0°
C24	C16	C17	C18	0.1°	90.0°
C24	C16	C17	H20	180.0°	90.0°
C16	C24	C20	H4	179.6°	90.0°
C24	C16	C17	H19	180.0°	90.0°
C18	C17	C16	H19	180.0°	90.0°
C17	C18	C19	H7	178.7°	90.0°
C18	C17	C16	H20	180.0°	90.0°
C16	C17	C18	H18	179.0°	90.0°
C23	C27	C29	C32	9.4°	90.0°
C23	C27	C29	N1	172.1°	90.0°
C27	C23	C15	H3	0.5°	90.0°
C27	C23	C11	H5	0.6°	90.0°
C27	C29	C32	N1	178.8°	90.0°
C27	C29	C32	C31	178.9°	90.0°
C27	C29	N1	C30	178.8°	90.0°
C27	C29	N1	CO	0.9°	90.0°
C27	C29	C32	H22	1.1°	90.0°
C29	C32	C31	H22	180.0°	90.0°
C29	C32	C31	C30	0.2°	90.0°
C32	C29	N1	C30	0.1°	90.0°
C32	C29	N1	CO	177.8°	90.0°
C29	C32	C31	H23	179.9°	90.0°
N1	C29	C32	C31	0.2°	90.0°
C29	N1	C30	C31	0.0°	90.0°
C29	N1	C30	CO	179.2°	90.0°
C29	N1	C30	C36	178.9°	90.0°
C29	N1	CO	N2	179.9°	90.0°
N1	C29	C32	H22	179.9°	90.0°
C32	C31	C30	H23	180.0°	90.0°
C32	C31	C30	N1	0.1°	90.0°
C32	C31	C30	C36	179.0°	90.0°
C31	C30	N1	C36	178.8°	90.0°
C31	C30	N1	CO	179.3°	90.0°
C31	C30	C36	N2	179.3°	90.0°
C31	C30	C36	C35	1.6°	90.0°
C30	C31	C32	H22	179.9°	90.0°
N1	C30	C36	N2	0.6°	90.0°
N1	C30	C36	C35	179.7°	90.0°
C30	N1	CO	N2	2.2°	90.0°
N1	C30	C31	H23	179.9°	90.0°
C36	C30	N1	CO	1.9°	90.0°
C30	C36	N2	C35	179.2°	90.0°
C30	C36	N2	C33	179.7°	90.0°
C30	C36	N2	CO	1.2°	90.0°
C30	C36	C35	C34	178.7°	90.0°
C36	C30	C31	H23	1.1°	90.0°
C30	C36	C35	H24	1.3°	90.0°
N1	CO	N2	C36	1.9°	90.0°
N1	CO	N2	C33	178.0°	90.0°
C36	N2	C33	CO	175.9°	90.0°
N2	C36	C35	C34	0.5°	90.0°
C36	N2	C33	C34	1.2°	90.0°
C36	N2	C33	C25	178.0°	90.0°
N2	C36	C35	H24	179.5°	90.0°
C35	C36	N2	C33	0.4°	90.0°
C35	C36	N2	CO	178.0°	90.0°
C36	C35	C34	H24	180.0°	90.0°
C36	C35	C34	C33	1.2°	90.0°
C36	C35	C34	H26	178.8°	90.0°
N2	C33	C34	C35	1.6°	90.0°
N2	C33	C34	C25	179.2°	90.0°
N2	C33	C25	C21	171.5°	90.0°
N2	C33	C34	H26	178.5°	90.0°
CO	N2	C33	C34	174.7°	90.0°
CO	N2	C33	C25	6.1°	90.0°
C35	C34	C33	H26	180.0°	90.0°
C35	C34	C33	C25	177.6°	90.0°
C34	C33	C25	C21	7.6°	90.0°
C33	C34	C35	H24	178.8°	90.0°
C33	C25	C21	C1	104.6°	90.0°
C33	C25	C21	C5	72.4°	90.0°
C25	C33	C34	H26	2.3°	90.0°
C25	C21	C1	C5	177.0°	90.0°
C25	C21	C1	C2	177.9°	90.0°
C25	C21	C5	C4	179.2°	90.0°
C25	C21	C1	H27	2.1°	90.0°
C25	C21	C5	H28	0.8°	90.0°
C21	C1	C2	H27	180.0°	90.0°
C1	C21	C5	C4	2.2°	90.0°
C21	C1	C2	C3	1.4°	90.0°
C1	C21	C5	H28	177.8°	90.0°
C21	C1	C2	H31	178.6°	90.0°
C5	C21	C1	C2	0.9°	90.0°
C21	C5	C4	H28	180.0°	90.0°
C21	C5	C4	C3	1.4°	90.0°
C5	C21	C1	H27	179.2°	90.0°
C21	C5	C4	H29	178.7°	90.0°
C1	C2	C3	C4	2.2°	90.0°
C1	C2	C3	H31	180.0°	90.0°
C1	C2	C3	H30	177.8°	90.0°
C5	C4	C3	H29	180.0°	90.0°
C5	C4	C3	C2	0.8°	90.0°
C5	C4	C3	H30	179.2°	90.0°
C4	C3	C2	H30	180.0°	90.0°
C3	C4	C5	H28	178.6°	90.0°
C4	C3	C2	H31	177.8°	90.0°
C3	C2	C1	H27	178.6°	90.0°
C2	C3	C4	H29	179.2°	90.0°
H1	C10	C9	H14	0.3°	90.0°
H2	C13	C12	H6	0.2°	90.0°
H2	C13	C14	H21	0.8°	90.0°
H3	C15	C14	H21	0.8°	90.0°
H4	C20	C19	H7	0.6°	90.0°
H5	C11	C12	H6	1.3°	90.0°
H7	C19	C18	H18	1.3°	90.0°
H8	C44	C41	H9	0.2°	90.0°
H11	C37	C38	H13	1.1°	90.0°
H14	C9	C8	H15	0.3°	90.0°
H15	C8	C7	H16	1.0°	90.0°
H16	C7	C6	H17	1.1°	90.0°
H18	C18	C17	H19	1.0°	90.0°
H19	C17	C16	H20	0.0°	90.0°
H22	C32	C31	H23	0.1°	90.0°
H24	C35	C34	H26	1.2°	90.0°
H27	C1	C2	H31	1.4°	90.0°
H28	C5	C4	H29	1.3°	90.0°
H29	C4	C3	H30	0.9°	90.0°
H30	C3	C2	H31	2.2°	90.0°

Release date:	2020-03-11
Definition date:	2019-03-25
Last modified:	2020-06-17
Release status:	REL
Processing site:	PDBJ
Derived from:	6JLG