SVP

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
N35	C36	sing	0.00Å	1.46Å
N35	C33	sing	0.00Å	1.35Å
C37	C36	sing	0.00Å	1.54Å
C37	S38	sing	0.00Å	1.82Å
O34	C33	doub	0.00Å	1.21Å
C36	C31	sing	0.00Å	1.55Å
C33	N32	sing	0.00Å	1.34Å
S38	C01	sing	0.00Å	1.81Å
N32	C31	sing	0.00Å	1.46Å
C31	C01	sing	0.00Å	1.55Å
C01	C02	sing	0.00Å	1.55Å
C02	C03	sing	0.00Å	1.56Å
C03	C04	sing	0.00Å	1.54Å
C04	C05	sing	0.00Å	1.54Å
C05	C06	sing	0.00Å	1.51Å
C29	C27	sing	0.00Å	1.55Å
C28	C27	sing	0.00Å	1.55Å
C06	N08	sing	0.00Å	1.35Å
C06	O07	doub	0.00Å	1.21Å
N08	C09	sing	0.00Å	1.47Å
C10	C09	sing	0.00Å	1.54Å
C10	P11	sing	0.00Å	1.83Å
C27	C30	sing	0.00Å	1.55Å
C27	P11	sing	0.00Å	1.86Å
P11	C23	sing	0.00Å	1.87Å
P11	PD	sing	0.00Å	2.32Å
C25	C23	sing	0.00Å	1.55Å
C23	C26	sing	0.00Å	1.54Å
C23	C24	sing	0.00Å	1.55Å
PD	CL	sing	0.00Å	2.37Å
C01	H1	sing	0.00Å	1.10Å
C02	H2	sing	0.00Å	1.10Å
C02	H3	sing	0.00Å	1.10Å
C03	H4	sing	0.00Å	1.10Å
C03	H5	sing	0.00Å	1.10Å
C04	H6	sing	0.00Å	1.10Å
C04	H7	sing	0.00Å	1.10Å
C05	H8	sing	0.00Å	1.10Å
C05	H9	sing	0.00Å	1.10Å
N08	H10	sing	0.00Å	1.00Å
C09	H11	sing	0.00Å	1.10Å
C09	H12	sing	0.00Å	1.10Å
C10	H13	sing	0.00Å	1.10Å
C10	H14	sing	0.00Å	1.10Å
C24	H15	sing	0.00Å	1.10Å
C24	H16	sing	0.00Å	1.10Å
C24	H17	sing	0.00Å	1.10Å
C25	H18	sing	0.00Å	1.10Å
C25	H19	sing	0.00Å	1.10Å
C25	H20	sing	0.00Å	1.10Å
C26	H21	sing	0.00Å	1.10Å
C26	H22	sing	0.00Å	1.10Å
C26	H23	sing	0.00Å	1.10Å
C28	H24	sing	0.00Å	1.10Å
C28	H25	sing	0.00Å	1.10Å
C28	H26	sing	0.00Å	1.10Å
C29	H27	sing	0.00Å	1.10Å
C29	H28	sing	0.00Å	1.10Å
C29	H29	sing	0.00Å	1.10Å
C30	H30	sing	0.00Å	1.10Å
C30	H31	sing	0.00Å	1.10Å
C30	H32	sing	0.00Å	1.10Å
C31	H33	sing	0.00Å	1.10Å
N32	H34	sing	0.00Å	1.00Å
N35	H35	sing	0.00Å	1.00Å
C36	H36	sing	0.00Å	1.10Å
C37	H37	sing	0.00Å	1.10Å
C37	H38	sing	0.00Å	1.10Å
C1	C2	sing	0.00Å	0.00Å
C2	C3	doub	0.00Å	0.00Å
C3	C4	sing	0.00Å	0.00Å
C4	C5	doub	0.00Å	0.00Å	Aromatic
C4	C6	sing	0.00Å	0.00Å	Aromatic
C6	C11	doub	0.00Å	0.00Å	Aromatic
C5	C8	sing	0.00Å	0.00Å	Aromatic
C8	C9	doub	0.00Å	0.00Å	Aromatic
C9	C11	sing	0.00Å	0.00Å	Aromatic
PD	C1	sing	0.00Å	41.15Å
PD	C3	sing	0.00Å	41.15Å
C1	H39	sing	0.00Å	0.00Å
C1	H40	sing	0.00Å	0.00Å
C2	H41	sing	0.00Å	0.00Å
C5	H42	sing	0.00Å	0.00Å
C6	H43	sing	0.00Å	0.00Å
C8	H44	sing	0.00Å	0.00Å
C9	H45	sing	0.00Å	0.00Å
C11	H46	sing	0.00Å	0.00Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
C36	N35	C33	113.4°	90.0°
N35	C36	C37	110.7°	90.0°
N35	C36	C31	102.5°	90.0°
C36	N35	H35	123.3°	90.0°
N35	C36	H36	112.7°	90.0°
N35	C33	O34	126.6°	90.0°
N35	C33	N32	107.9°	90.0°
C33	N35	H35	123.3°	90.0°
C36	C37	S38	107.8°	90.0°
C37	C36	C31	107.8°	90.0°
C37	C36	H36	111.4°	90.0°
C36	C37	H37	109.9°	90.0°
C36	C37	H38	109.9°	90.0°
C37	S38	C01	87.4°	90.0°
S38	C37	H37	109.9°	90.0°
S38	C37	H38	109.9°	90.0°
O34	C33	N32	125.5°	90.0°
C36	C31	N32	102.3°	90.0°
C36	C31	C01	108.5°	90.0°
C36	C31	H33	110.9°	90.0°
C31	C36	H36	111.4°	90.0°
C33	N32	C31	113.8°	90.0°
C33	N32	H34	123.1°	90.0°
S38	C01	C31	106.9°	90.0°
S38	C01	C02	111.6°	90.0°
S38	C01	H1	105.8°	90.0°
N32	C31	C01	111.8°	90.0°
N32	C31	H33	112.1°	90.0°
C31	N32	H34	123.1°	90.0°
C31	C01	C02	114.8°	90.0°
C31	C01	H1	108.7°	90.0°
C01	C31	H33	110.9°	90.0°
C01	C02	C03	110.4°	90.0°
C02	C01	H1	108.6°	90.0°
C01	C02	H2	109.2°	90.0°
C01	C02	H3	109.2°	90.0°
C02	C03	C04	112.5°	90.0°
C03	C02	H2	109.3°	90.0°
C03	C02	H3	109.2°	90.0°
C02	C03	H4	108.7°	90.0°
C02	C03	H5	108.7°	90.0°
C03	C04	C05	111.2°	90.0°
C04	C03	H4	108.7°	90.0°
C04	C03	H5	108.7°	90.0°
C03	C04	H6	109.0°	90.0°
C03	C04	H7	109.1°	90.0°
C04	C05	C06	113.9°	90.0°
C05	C04	H6	109.1°	90.0°
C05	C04	H7	109.0°	90.0°
C04	C05	H8	108.4°	90.0°
C04	C05	H9	108.4°	90.0°
C05	C06	N08	114.8°	90.0°
C05	C06	O07	123.5°	90.0°
C06	C05	H8	108.4°	90.0°
C06	C05	H9	108.4°	90.0°
C29	C27	C28	105.8°	90.0°
C29	C27	C30	106.5°	90.0°
C29	C27	P11	113.3°	90.0°
C27	C29	H27	109.5°	90.0°
C27	C29	H28	109.4°	90.0°
C27	C29	H29	109.5°	90.0°
C28	C27	C30	109.0°	90.0°
C28	C27	P11	109.0°	90.0°
C27	C28	H24	109.5°	90.0°
C27	C28	H25	109.5°	90.0°
C27	C28	H26	109.5°	90.0°
N08	C06	O07	121.7°	90.0°
C06	N08	C09	122.7°	90.0°
C06	N08	H10	118.7°	90.0°
N08	C09	C10	111.5°	90.0°
C09	N08	H10	118.6°	90.0°
N08	C09	H11	109.0°	90.0°
N08	C09	H12	108.9°	90.0°
C09	C10	P11	117.3°	90.0°
C10	C09	H11	109.0°	90.0°
C10	C09	H12	109.0°	90.0°
C09	C10	H13	107.5°	90.0°
C09	C10	H14	107.5°	90.0°
C10	P11	C27	107.1°	90.0°
C10	P11	C23	110.9°	90.0°
C10	P11	PD	110.9°	90.0°
P11	C10	H13	107.5°	90.0°
P11	C10	H14	107.5°	90.0°
C30	C27	P11	112.9°	90.0°
C27	C30	H30	109.5°	90.0°
C27	C30	H31	109.4°	90.0°
C27	C30	H32	109.5°	90.0°
C27	P11	C23	116.2°	90.0°
C27	P11	PD	113.7°	90.0°
C23	P11	PD	97.8°	90.0°
P11	C23	C25	115.5°	90.0°
P11	C23	C26	113.3°	90.0°
P11	C23	C24	109.8°	90.0°
P11	PD	CL	107.9°	90.0°
P11	PD	C1	60.5°	90.0°
P11	PD	C3	60.5°	90.0°
C25	C23	C26	106.7°	90.0°
C25	C23	C24	104.6°	90.0°
C23	C25	H18	109.5°	90.0°
C23	C25	H19	109.5°	90.0°
C23	C25	H20	109.5°	90.0°
C26	C23	C24	106.2°	90.0°
C23	C26	H21	109.5°	90.0°
C23	C26	H22	109.4°	90.0°
C23	C26	H23	109.5°	90.0°
C23	C24	H15	109.5°	90.0°
C23	C24	H16	109.4°	90.0°
C23	C24	H17	109.4°	90.0°
CL	PD	C1	146.4°	90.0°
CL	PD	C3	146.4°	90.0°
H2	C02	H3	109.5°	90.0°
H4	C03	H5	109.4°	90.0°
H6	C04	H7	109.5°	90.0°
H8	C05	H9	109.4°	90.0°
H11	C09	H12	109.5°	90.0°
H13	C10	H14	109.5°	90.0°
H15	C24	H16	109.5°	90.0°
H15	C24	H17	109.5°	90.0°
H16	C24	H17	109.5°	90.0°
H18	C25	H19	109.5°	90.0°
H18	C25	H20	109.4°	90.0°
H19	C25	H20	109.5°	90.0°
H21	C26	H22	109.5°	90.0°
H21	C26	H23	109.5°	90.0°
H22	C26	H23	109.5°	90.0°
H24	C28	H25	109.5°	90.0°
H24	C28	H26	109.4°	90.0°
H25	C28	H26	109.5°	90.0°
H27	C29	H28	109.5°	90.0°
H27	C29	H29	109.5°	90.0°
H28	C29	H29	109.5°	90.0°
H30	C30	H31	109.5°	90.0°
H30	C30	H32	109.5°	90.0°
H31	C30	H32	109.5°	90.0°
H37	C37	H38	109.5°	90.0°
C1	C2	C3	90.0°	90.0°
C2	C1	PD	90.0°	90.0°
C2	C1	H39	90.0°	90.0°
C2	C1	H40	90.0°	90.0°
C1	C2	H41	90.0°	90.0°
C2	C3	C4	90.0°	90.0°
C2	C3	PD	90.0°	90.0°
C3	C2	H41	90.0°	90.0°
C3	C4	C5	90.0°	90.0°
C3	C4	C6	90.0°	90.0°
C4	C3	PD	90.0°	90.0°
C5	C4	C6	90.0°	90.0°
C4	C5	C8	90.0°	90.0°
C4	C5	H42	90.0°	90.0°
C4	C6	C11	90.0°	90.0°
C4	C6	H43	90.0°	90.0°
C6	C11	C9	90.0°	90.0°
C11	C6	H43	90.0°	90.0°
C6	C11	H46	90.0°	90.0°
C5	C8	C9	90.0°	90.0°
C8	C5	H42	90.0°	90.0°
C5	C8	H44	90.0°	90.0°
C8	C9	C11	90.0°	90.0°
C9	C8	H44	90.0°	90.0°
C8	C9	H45	90.0°	90.0°
C11	C9	H45	90.0°	90.0°
C9	C11	H46	90.0°	90.0°
C1	PD	C3	0.0°	90.0°
PD	C1	H39	90.0°	90.0°
PD	C1	H40	90.0°	90.0°
H39	C1	H40	90.0°	90.0°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
C36	N35	C33	H35	180.0°	90.0°
N35	C36	C37	C31	111.3°	90.0°
N35	C36	C37	H36	126.2°	90.0°
N35	C36	C37	S38	83.0°	90.0°
C36	N35	C33	O34	179.4°	90.0°
N35	C36	C31	H36	120.7°	90.0°
C36	N35	C33	N32	1.8°	90.0°
N35	C36	C31	N32	0.9°	90.0°
N35	C36	C31	C01	119.2°	90.0°
N35	C36	C31	H33	118.8°	90.0°
N35	C36	C37	H37	157.2°	90.0°
N35	C36	C37	H38	36.7°	90.0°
C33	N35	C36	C37	113.0°	90.0°
N35	C33	O34	N32	178.6°	90.0°
C33	N35	C36	C31	1.7°	90.0°
N35	C33	N32	C31	1.1°	90.0°
N35	C33	N32	H34	178.9°	90.0°
C33	N35	C36	H36	121.5°	90.0°
C36	C37	S38	H37	119.8°	90.0°
C36	C37	S38	H38	119.8°	90.0°
C37	C36	C31	H36	122.5°	90.0°
C36	C37	S38	C01	40.9°	90.0°
C37	C36	C31	N32	115.9°	90.0°
C37	C36	C31	C01	2.4°	90.0°
C37	C36	C31	H33	124.4°	90.0°
C37	C36	N35	H35	67.0°	90.0°
C36	C37	H37	H38	120.8°	90.0°
S38	C37	C36	C31	28.3°	90.0°
C37	S38	C01	C31	42.0°	90.0°
C37	S38	C01	C02	168.3°	90.0°
C37	S38	C01	H1	73.8°	90.0°
S38	C37	C36	H36	150.8°	90.0°
S38	C37	H37	H38	120.7°	90.0°
O34	C33	N32	C31	179.9°	90.0°
O34	C33	N32	H34	0.1°	90.0°
O34	C33	N35	H35	0.6°	90.0°
C36	C31	N32	C33	0.1°	90.0°
C36	C31	C01	S38	32.2°	90.0°
C36	C31	N32	C01	115.9°	90.0°
C36	C31	N32	H33	118.8°	90.0°
C36	C31	C01	H33	121.9°	90.0°
C36	C31	C01	C02	156.6°	90.0°
C36	C31	C01	H1	81.6°	90.0°
C36	C31	N32	H34	179.9°	90.0°
C31	C36	N35	H35	178.3°	90.0°
C31	C36	C37	H37	91.4°	90.0°
C31	C36	C37	H38	148.1°	90.0°
C33	N32	C31	H34	180.0°	90.0°
C33	N32	C31	C01	115.8°	90.0°
C33	N32	C31	H33	118.9°	90.0°
N32	C33	N35	H35	178.2°	90.0°
S38	C01	C31	N32	79.9°	90.0°
S38	C01	C31	C02	124.4°	90.0°
S38	C01	C31	H1	113.8°	90.0°
S38	C01	C02	H1	116.3°	90.0°
S38	C01	C02	C03	77.2°	90.0°
S38	C01	C02	H2	43.0°	90.0°
S38	C01	C02	H3	162.7°	90.0°
S38	C01	C31	H33	154.1°	90.0°
C01	S38	C37	H37	78.8°	90.0°
C01	S38	C37	H38	160.7°	90.0°
N32	C31	C01	H33	125.9°	90.0°
N32	C31	C01	C02	44.4°	90.0°
N32	C31	C01	H1	166.3°	90.0°
N32	C31	C36	H36	121.6°	90.0°
C31	C01	C02	H1	121.9°	90.0°
C31	C01	C02	C03	161.0°	90.0°
C31	C01	C02	H2	78.8°	90.0°
C31	C01	C02	H3	40.9°	90.0°
C01	C31	N32	H34	64.2°	90.0°
C01	C31	C36	H36	120.1°	90.0°
C01	C02	C03	H2	120.1°	90.0°
C01	C02	C03	H3	120.1°	90.0°
C01	C02	C03	C04	171.1°	90.0°
C01	C02	H2	H3	119.6°	90.0°
C01	C02	C03	H4	68.5°	90.0°
C01	C02	C03	H5	50.6°	90.0°
C02	C01	C31	H33	81.5°	90.0°
C02	C03	C04	H4	120.5°	90.0°
C02	C03	C04	H5	120.4°	90.0°
C02	C03	C04	C05	179.0°	90.0°
C03	C02	C01	H1	39.1°	90.0°
C03	C02	H2	H3	119.6°	90.0°
C02	C03	H4	H5	118.6°	90.0°
C02	C03	C04	H6	58.7°	90.0°
C02	C03	C04	H7	60.8°	90.0°
C03	C04	C05	H6	120.3°	90.0°
C03	C04	C05	H7	120.3°	90.0°
C03	C04	C05	C06	75.3°	90.0°
C04	C03	C02	H2	50.9°	90.0°
C04	C03	C02	H3	68.8°	90.0°
C04	C03	H4	H5	118.7°	90.0°
C03	C04	H6	H7	119.2°	90.0°
C03	C04	C05	H8	45.3°	90.0°
C03	C04	C05	H9	164.0°	90.0°
C04	C05	C06	H8	120.7°	90.0°
C04	C05	C06	H9	120.7°	90.0°
C04	C05	C06	N08	152.8°	90.0°
C04	C05	C06	O07	27.6°	90.0°
C05	C04	C03	H4	60.6°	90.0°
C05	C04	C03	H5	58.5°	90.0°
C05	C04	H6	H7	119.2°	90.0°
C04	C05	H8	H9	118.0°	90.0°
C05	C06	N08	O07	179.6°	90.0°
C05	C06	N08	C09	179.7°	90.0°
C06	C05	C04	H6	164.4°	90.0°
C06	C05	C04	H7	44.9°	90.0°
C06	C05	H8	H9	118.0°	90.0°
C05	C06	N08	H10	0.3°	90.0°
C29	C27	C28	C30	114.1°	90.0°
C29	C27	C28	P11	122.2°	90.0°
C29	C27	P11	C10	61.7°	90.0°
C29	C27	C30	P11	124.9°	90.0°
C29	C27	P11	C23	173.7°	90.0°
C29	C27	P11	PD	61.2°	90.0°
C29	C27	C28	H24	180.0°	90.0°
C29	C27	C28	H25	60.0°	90.0°
C29	C27	C28	H26	60.0°	90.0°
C27	C29	H27	H28	120.0°	90.0°
C27	C29	H27	H29	120.0°	90.0°
C27	C29	H28	H29	120.0°	90.0°
C29	C27	C30	H30	180.0°	90.0°
C29	C27	C30	H31	60.0°	90.0°
C29	C27	C30	H32	60.0°	90.0°
C28	C27	P11	C10	55.9°	90.0°
C28	C27	C30	P11	121.3°	90.0°
C28	C27	P11	C23	68.7°	90.0°
C28	C27	P11	PD	178.8°	90.0°
C27	C28	H24	H25	120.0°	90.0°
C27	C28	H24	H26	120.0°	90.0°
C27	C28	H25	H26	120.0°	90.0°
C28	C27	C29	H27	180.0°	90.0°
C28	C27	C29	H28	60.0°	90.0°
C28	C27	C29	H29	60.0°	90.0°
C28	C27	C30	H30	66.3°	90.0°
C28	C27	C30	H31	53.7°	90.0°
C28	C27	C30	H32	173.7°	90.0°
C06	N08	C09	H10	180.0°	90.0°
C06	N08	C09	C10	66.2°	90.0°
N08	C06	C05	H8	32.2°	90.0°
N08	C06	C05	H9	86.5°	90.0°
C06	N08	C09	H11	173.5°	90.0°
C06	N08	C09	H12	54.1°	90.0°
O07	C06	N08	C09	0.1°	90.0°
O07	C06	C05	H8	148.3°	90.0°
O07	C06	C05	H9	93.1°	90.0°
O07	C06	N08	H10	179.9°	90.0°
N08	C09	C10	H11	120.3°	90.0°
N08	C09	C10	H12	120.3°	90.0°
N08	C09	C10	P11	174.8°	90.0°
N08	C09	H11	H12	119.1°	90.0°
N08	C09	C10	H13	53.7°	90.0°
N08	C09	C10	H14	64.1°	90.0°
C09	C10	P11	H13	121.1°	90.0°
C09	C10	P11	H14	121.1°	90.0°
C09	C10	P11	C27	146.1°	90.0°
C09	C10	P11	C23	86.1°	90.0°
C09	C10	P11	PD	21.5°	90.0°
C10	C09	N08	H10	113.8°	90.0°
C10	C09	H11	H12	119.1°	90.0°
C09	C10	H13	H14	116.4°	90.0°
C10	P11	C27	C30	177.2°	90.0°
C10	P11	C27	C23	124.7°	90.0°
C10	P11	C27	PD	122.9°	90.0°
C10	P11	C23	PD	116.0°	90.0°
C10	P11	C23	C25	89.7°	90.0°
C10	P11	C23	C26	33.9°	90.0°
C10	P11	C23	C24	152.4°	90.0°
C10	P11	PD	CL	75.1°	90.0°
P11	C10	C09	H11	64.9°	90.0°
P11	C10	C09	H12	54.5°	90.0°
P11	C10	H13	H14	116.5°	90.0°
C10	P11	PD	C1	70.3°	90.0°
C10	P11	PD	C3	70.3°	90.0°
C30	C27	P11	C23	52.5°	90.0°
C30	C27	P11	PD	59.9°	90.0°
C30	C27	C28	H24	65.8°	90.0°
C30	C27	C28	H25	174.1°	90.0°
C30	C27	C28	H26	54.1°	90.0°
C30	C27	C29	H27	64.1°	90.0°
C30	C27	C29	H28	55.9°	90.0°
C30	C27	C29	H29	175.9°	90.0°
C27	C30	H30	H31	120.0°	90.0°
C27	C30	H30	H32	120.0°	90.0°
C27	C30	H31	H32	120.0°	90.0°
C27	P11	C23	PD	121.3°	90.0°
C27	P11	C23	C25	33.0°	90.0°
C27	P11	C23	C26	156.6°	90.0°
C27	P11	C23	C24	84.9°	90.0°
C27	P11	PD	CL	164.1°	90.0°
C27	P11	C10	H13	92.8°	90.0°
C27	P11	C10	H14	25.0°	90.0°
P11	C27	C28	H24	57.8°	90.0°
P11	C27	C28	H25	62.2°	90.0°
P11	C27	C28	H26	177.8°	90.0°
P11	C27	C29	H27	60.6°	90.0°
P11	C27	C29	H28	179.4°	90.0°
P11	C27	C29	H29	59.4°	90.0°
P11	C27	C30	H30	55.0°	90.0°
P11	C27	C30	H31	175.0°	90.0°
P11	C27	C30	H32	64.9°	90.0°
C27	P11	PD	C1	50.5°	90.0°
C27	P11	PD	C3	50.5°	90.0°
P11	C23	C25	C26	126.9°	90.0°
P11	C23	C25	C24	120.8°	90.0°
P11	C23	C26	C24	120.6°	90.0°
C23	P11	PD	CL	40.9°	90.0°
C23	P11	C10	H13	35.0°	90.0°
C23	P11	C10	H14	152.8°	90.0°
P11	C23	C24	H15	180.0°	90.0°
P11	C23	C24	H16	60.0°	90.0°
P11	C23	C24	H17	60.0°	90.0°
P11	C23	C25	H18	180.0°	90.0°
P11	C23	C25	H19	60.0°	90.0°
P11	C23	C25	H20	60.0°	90.0°
P11	C23	C26	H21	180.0°	90.0°
P11	C23	C26	H22	60.0°	90.0°
P11	C23	C26	H23	60.0°	90.0°
C23	P11	PD	C1	173.7°	90.0°
C23	P11	PD	C3	173.7°	90.0°
PD	P11	C23	C25	154.4°	90.0°
PD	P11	C23	C26	82.1°	90.0°
PD	P11	C23	C24	36.4°	90.0°
P11	PD	CL	C1	63.4°	90.0°
P11	PD	CL	C3	63.4°	90.0°
PD	P11	C10	H13	142.6°	90.0°
PD	P11	C10	H14	99.6°	90.0°
P11	PD	C1	C2	90.0°	90.0°
P11	PD	C3	C2	90.0°	90.0°
P11	PD	C3	C4	90.0°	90.0°
P11	PD	C1	C3	90.0°	90.0°
P11	PD	C1	H39	90.0°	90.0°
P11	PD	C1	H40	90.0°	90.0°
C25	C23	C26	C24	111.2°	90.0°
C25	C23	C24	H15	55.5°	90.0°
C25	C23	C24	H16	64.5°	90.0°
C25	C23	C24	H17	175.5°	90.0°
C23	C25	H18	H19	120.0°	90.0°
C23	C25	H18	H20	120.0°	90.0°
C23	C25	H19	H20	120.0°	90.0°
C25	C23	C26	H21	51.8°	90.0°
C25	C23	C26	H22	171.8°	90.0°
C25	C23	C26	H23	68.3°	90.0°
C26	C23	C24	H15	57.2°	90.0°
C26	C23	C24	H16	177.2°	90.0°
C26	C23	C24	H17	62.8°	90.0°
C26	C23	C25	H18	53.1°	90.0°
C26	C23	C25	H19	66.9°	90.0°
C26	C23	C25	H20	173.0°	90.0°
C23	C26	H21	H22	120.0°	90.0°
C23	C26	H21	H23	120.0°	90.0°
C23	C26	H22	H23	119.9°	90.0°
C23	C24	H15	H16	120.0°	90.0°
C23	C24	H15	H17	120.0°	90.0°
C23	C24	H16	H17	119.9°	90.0°
C24	C23	C25	H18	59.2°	90.0°
C24	C23	C25	H19	179.2°	90.0°
C24	C23	C25	H20	60.7°	90.0°
C24	C23	C26	H21	59.4°	90.0°
C24	C23	C26	H22	60.6°	90.0°
C24	C23	C26	H23	179.5°	90.0°
CL	PD	C1	C2	90.0°	90.0°
CL	PD	C3	C2	90.0°	90.0°
CL	PD	C3	C4	90.0°	90.0°
CL	PD	C1	C3	90.0°	90.0°
CL	PD	C1	H39	90.0°	90.0°
CL	PD	C1	H40	90.0°	90.0°
H1	C01	C02	H2	159.3°	90.0°
H1	C01	C02	H3	81.0°	90.0°
H1	C01	C31	H33	40.4°	90.0°
H2	C02	C03	H4	171.4°	90.0°
H2	C02	C03	H5	69.5°	90.0°
H3	C02	C03	H4	51.7°	90.0°
H3	C02	C03	H5	170.7°	90.0°
H4	C03	C04	H6	179.2°	90.0°
H4	C03	C04	H7	59.7°	90.0°
H5	C03	C04	H6	61.8°	90.0°
H5	C03	C04	H7	178.8°	90.0°
H6	C04	C05	H8	75.0°	90.0°
H6	C04	C05	H9	43.7°	90.0°
H7	C04	C05	H8	165.6°	90.0°
H7	C04	C05	H9	75.7°	90.0°
H10	N08	C09	H11	6.5°	90.0°
H10	N08	C09	H12	125.9°	90.0°
H11	C09	C10	H13	174.0°	90.0°
H11	C09	C10	H14	56.2°	90.0°
H12	C09	C10	H13	66.6°	90.0°
H12	C09	C10	H14	175.6°	90.0°
H15	C24	H16	H17	120.0°	90.0°
H18	C25	H19	H20	120.0°	90.0°
H21	C26	H22	H23	120.0°	90.0°
H24	C28	H25	H26	120.0°	90.0°
H27	C29	H28	H29	120.0°	90.0°
H30	C30	H31	H32	120.0°	90.0°
H33	C31	N32	H34	61.1°	90.0°
H33	C31	C36	H36	1.9°	90.0°
H35	N35	C36	H36	58.5°	90.0°
H36	C36	C37	H37	31.0°	90.0°
H36	C36	C37	H38	89.5°	90.0°
C1	C2	C3	H41	90.0°	90.0°
C1	C2	C3	C4	90.0°	90.0°
C2	C1	PD	H39	90.0°	90.0°
C2	C1	PD	H40	90.0°	90.0°
C2	C1	PD	C3	90.0°	90.0°
C2	C1	H39	H40	90.0°	90.0°
C2	C3	C4	PD	90.0°	90.0°
C2	C3	C4	C5	90.0°	90.0°
C2	C3	C4	C6	90.0°	90.0°
C3	C2	C1	H39	90.0°	90.0°
C3	C2	C1	H40	90.0°	90.0°
C3	C4	C5	C6	90.0°	90.0°
C3	C4	C6	C11	90.0°	90.0°
C3	C4	C5	C8	90.0°	90.0°
C4	C3	PD	C1	90.0°	90.0°
C4	C3	C2	H41	90.0°	90.0°
C3	C4	C5	H42	90.0°	90.0°
C3	C4	C6	H43	90.0°	90.0°
C5	C4	C6	C11	90.0°	90.0°
C4	C5	C8	H42	90.0°	90.0°
C4	C5	C8	C9	90.0°	90.0°
C5	C4	C3	PD	90.0°	90.0°
C5	C4	C6	H43	90.0°	90.0°
C4	C5	C8	H44	90.0°	90.0°
C4	C6	C11	H43	90.0°	90.0°
C6	C4	C5	C8	90.0°	90.0°
C4	C6	C11	C9	90.0°	90.0°
C6	C4	C3	PD	90.0°	90.0°
C6	C4	C5	H42	90.0°	90.0°
C4	C6	C11	H46	90.0°	90.0°
C6	C11	C9	C8	90.0°	90.0°
C6	C11	C9	H46	90.0°	90.0°
C6	C11	C9	H45	90.0°	90.0°
C5	C8	C9	H44	90.0°	90.0°
C5	C8	C9	C11	90.0°	90.0°
C5	C8	C9	H45	90.0°	90.0°
C8	C9	C11	H45	90.0°	90.0°
C9	C8	C5	H42	90.0°	90.0°
C8	C9	C11	H46	90.0°	90.0°
C9	C11	C6	H43	90.0°	90.0°
C11	C9	C8	H44	90.0°	90.0°
PD	C1	H39	H40	90.0°	90.0°
PD	C1	C2	H41	90.0°	90.0°
C3	PD	C1	H39	90.0°	90.0°
C3	PD	C1	H40	90.0°	90.0°
PD	C3	C2	H41	90.0°	90.0°
H39	C1	C2	H41	90.0°	90.0°
H40	C1	C2	H41	90.0°	90.0°
H42	C5	C8	H44	90.0°	90.0°
H43	C6	C11	H46	90.0°	90.0°
H44	C8	C9	H45	90.0°	90.0°
H45	C9	C11	H46	90.0°	90.0°

Release date:	2015-11-04
Definition date:	2015-07-23
Last modified:	2015-10-30
Release status:	REL
Processing site:	EBI
Derived from:	5CSE