Obsolete: PEH

PEH was replaced with 3PE on

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
P	O11	sing	1.61Å	1.61Å
P	O12	sing	1.61Å	1.63Å
P	O13	sing	1.61Å	1.50Å
P	O14	doub	1.48Å	1.52Å
N	C12	sing	1.47Å	1.51Å
N	HN1	sing	1.01Å	1.02Å
N	HN2	sing	1.01Å	1.02Å
O11	C1	sing	1.43Å	1.42Å
O12	C11	sing	1.43Å	1.43Å
O13	HPO	sing	0.97Å	0.95Å
C11	C12	sing	1.53Å	1.52Å
C11	H111	sing	1.09Å	1.11Å
C11	H112	sing	1.09Å	1.12Å
C12	H121	sing	1.09Å	1.11Å
C12	H122	sing	1.09Å	1.12Å
C1	C2	sing	1.53Å	1.51Å
C1	H11	sing	1.09Å	1.12Å
C1	H12	sing	1.09Å	1.11Å
C2	C3	sing	1.53Å	1.49Å
C2	O21	sing	1.45Å	1.41Å
C2	H2	sing	1.09Å	1.11Å
C3	O31	sing	1.45Å	1.43Å
C3	H31	sing	1.09Å	1.11Å
C3	H32	sing	1.09Å	1.12Å
O31	C31	sing	1.34Å	1.55Å
O32	C31	doub	1.21Å	1.28Å
C31	C32	sing	1.51Å	1.55Å
C32	C33	sing	1.53Å	1.54Å
C32	H321	sing	1.09Å	1.11Å
C32	H322	sing	1.09Å	1.12Å
C33	C34	sing	1.53Å	1.52Å
C33	H331	sing	1.09Å	1.11Å
C33	H332	sing	1.09Å	1.11Å
C34	C35	sing	1.53Å	1.51Å
C34	H341	sing	1.09Å	1.12Å
C34	H342	sing	1.09Å	1.12Å
C35	C36	sing	1.53Å	1.53Å
C35	H351	sing	1.09Å	1.12Å
C35	H352	sing	1.09Å	1.11Å
C36	C37	sing	1.53Å	1.53Å
C36	H361	sing	1.09Å	1.11Å
C36	H362	sing	1.09Å	1.12Å
C37	C38	sing	1.53Å	1.52Å
C37	H371	sing	1.09Å	1.12Å
C37	H372	sing	1.09Å	1.11Å
C38	C39	sing	1.53Å	1.51Å
C38	H381	sing	1.09Å	1.12Å
C38	H382	sing	1.09Å	1.11Å
C39	C3A	sing	1.53Å	1.52Å
C39	H391	sing	1.09Å	1.11Å
C39	H392	sing	1.09Å	1.12Å
C3A	C3B	sing	1.53Å	1.52Å
C3A	H3A1	sing	1.09Å	1.11Å
C3A	H3A2	sing	1.09Å	1.12Å
C3B	C3C	sing	1.53Å	1.53Å
C3B	H3B1	sing	1.09Å	1.12Å
C3B	H3B2	sing	1.09Å	1.11Å
C3C	C3D	sing	1.53Å	1.52Å
C3C	H3C1	sing	1.09Å	1.11Å
C3C	H3C2	sing	1.09Å	1.12Å
C3D	C3E	sing	1.53Å	1.51Å
C3D	H3D1	sing	1.09Å	1.12Å
C3D	H3D2	sing	1.09Å	1.11Å
C3E	C3F	sing	1.53Å	1.52Å
C3E	H3E1	sing	1.09Å	1.11Å
C3E	H3E2	sing	1.09Å	1.11Å
C3F	C3G	sing	1.53Å	1.52Å
C3F	H3F1	sing	1.09Å	1.12Å
C3F	H3F2	sing	1.09Å	1.11Å
C3G	C3H	sing	1.53Å	1.53Å
C3G	H3G1	sing	1.09Å	1.11Å
C3G	H3G2	sing	1.09Å	1.11Å
C3H	C3I	sing	1.53Å	1.52Å
C3H	H3H1	sing	1.09Å	1.11Å
C3H	H3H2	sing	1.09Å	1.12Å
C3I	H3I1	sing	1.09Å	1.11Å
C3I	H3I2	sing	1.09Å	1.12Å
C3I	H3I3	sing	1.09Å	1.11Å
O21	C21	sing	1.34Å	1.54Å
O22	C21	doub	1.21Å	1.26Å
C21	C22	sing	1.51Å	1.50Å
C22	C23	sing	1.53Å	1.51Å
C22	H221	sing	1.09Å	1.12Å
C22	H222	sing	1.09Å	1.11Å
C23	C24	sing	1.53Å	1.52Å
C23	H231	sing	1.09Å	1.12Å
C23	H232	sing	1.09Å	1.12Å
C24	C25	sing	1.53Å	1.53Å
C24	H241	sing	1.09Å	1.11Å
C24	H242	sing	1.09Å	1.12Å
C25	C26	sing	1.53Å	1.51Å
C25	H251	sing	1.09Å	1.12Å
C25	H252	sing	1.09Å	1.11Å
C26	C27	sing	1.53Å	1.49Å
C26	H261	sing	1.09Å	1.11Å
C26	H262	sing	1.09Å	1.12Å
C27	C28	sing	1.53Å	1.50Å
C27	H271	sing	1.09Å	1.12Å
C27	H272	sing	1.09Å	1.11Å
C28	C29	sing	1.53Å	1.51Å
C28	H281	sing	1.09Å	1.11Å
C28	H282	sing	1.09Å	1.11Å
C29	C2A	sing	1.53Å	1.51Å
C29	H291	sing	1.09Å	1.11Å
C29	H292	sing	1.09Å	1.11Å
C2A	C2B	sing	1.53Å	1.52Å
C2A	H2A1	sing	1.09Å	1.11Å
C2A	H2A2	sing	1.09Å	1.12Å
C2B	C2C	sing	1.53Å	1.52Å
C2B	H2B1	sing	1.09Å	1.12Å
C2B	H2B2	sing	1.09Å	1.12Å
C2C	C2D	sing	1.53Å	1.52Å
C2C	H2C1	sing	1.09Å	1.11Å
C2C	H2C2	sing	1.09Å	1.11Å
C2D	C2E	sing	1.53Å	1.53Å
C2D	H2D1	sing	1.09Å	1.12Å
C2D	H2D2	sing	1.09Å	1.11Å
C2E	C2F	sing	1.53Å	1.53Å
C2E	H2E1	sing	1.09Å	1.11Å
C2E	H2E2	sing	1.09Å	1.11Å
C2F	C2G	sing	1.53Å	1.52Å
C2F	H2F1	sing	1.09Å	1.12Å
C2F	H2F2	sing	1.09Å	1.11Å
C2G	C2H	sing	1.53Å	1.51Å
C2G	H2G1	sing	1.09Å	1.11Å
C2G	H2G2	sing	1.09Å	1.12Å
C2H	C2I	sing	1.53Å	1.52Å
C2H	H2H1	sing	1.09Å	1.12Å
C2H	H2H2	sing	1.09Å	1.11Å
C2I	H2I1	sing	1.09Å	1.11Å
C2I	H2I2	sing	1.09Å	1.12Å
C2I	H2I3	sing	1.09Å	1.11Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
O11	P	O12	105.7°	109.5°
O11	P	O13	111.5°	109.5°
O11	P	O14	108.0°	109.5°
P	O11	C1	116.9°	106.7°
O12	P	O13	106.3°	109.5°
O12	P	O14	111.7°	109.5°
P	O12	C11	115.8°	106.8°
O13	P	O14	113.4°	109.4°
P	O13	HPO	111.5°	106.8°
C12	N	HN1	105.3°	106.7°
C12	N	HN2	113.8°	106.6°
N	C12	C11	105.2°	109.5°
N	C12	H121	113.8°	109.5°
N	C12	H122	113.8°	109.5°
HN1	N	HN2	113.7°	106.7°
O11	C1	C2	107.0°	109.4°
O11	C1	H11	113.1°	109.5°
O11	C1	H12	113.2°	109.4°
O12	C11	C12	104.8°	109.5°
O12	C11	H111	114.0°	109.5°
O12	C11	H112	114.0°	109.5°
C12	C11	H111	114.0°	109.5°
C12	C11	H112	114.0°	109.5°
C11	C12	H121	113.8°	109.4°
C11	C12	H122	113.8°	109.5°
H111	C11	H112	96.4°	109.5°
H121	C12	H122	96.7°	109.4°
C2	C1	H11	113.2°	109.5°
C2	C1	H12	113.2°	109.5°
C1	C2	C3	104.6°	109.5°
C1	C2	O21	107.0°	109.5°
C1	C2	H2	113.3°	109.5°
H11	C1	H12	97.3°	109.5°
C3	C2	O21	107.0°	109.4°
C3	C2	H2	113.3°	109.4°
C2	C3	O31	117.3°	109.4°
C2	C3	H31	109.4°	109.4°
C2	C3	H32	109.4°	109.5°
O21	C2	H2	111.2°	109.5°
C2	O21	C21	112.8°	120.0°
O31	C3	H31	109.4°	109.5°
O31	C3	H32	109.4°	109.5°
C3	O31	C31	110.7°	120.0°
H31	C3	H32	100.7°	109.5°
O31	C31	O32	124.6°	120.0°
O31	C31	C32	111.3°	120.0°
O32	C31	C32	124.0°	120.0°
C31	C32	C33	111.7°	109.5°
C31	C32	H321	111.4°	109.4°
C31	C32	H322	111.3°	109.5°
C33	C32	H321	111.4°	109.4°
C33	C32	H322	111.4°	109.5°
C32	C33	C34	111.2°	109.5°
C32	C33	H331	111.5°	109.4°
C32	C33	H332	111.6°	109.5°
H321	C32	H322	98.9°	109.5°
C34	C33	H331	111.6°	109.4°
C34	C33	H332	111.5°	109.5°
C33	C34	C35	109.5°	109.5°
C33	C34	H341	112.2°	109.4°
C33	C34	H342	112.1°	109.4°
H331	C33	H332	98.9°	109.4°
C35	C34	H341	112.2°	109.5°
C35	C34	H342	112.2°	109.5°
C34	C35	C36	112.7°	109.5°
C34	C35	H351	111.0°	109.5°
C34	C35	H352	111.0°	109.5°
H341	C34	H342	98.2°	109.5°
C36	C35	H351	111.1°	109.4°
C36	C35	H352	111.0°	109.5°
C35	C36	C37	109.0°	109.5°
C35	C36	H361	112.4°	109.4°
C35	C36	H362	112.3°	109.5°
H351	C35	H352	99.3°	109.4°
C37	C36	H361	112.4°	109.4°
C37	C36	H362	112.4°	109.5°
C36	C37	C38	112.2°	109.5°
C36	C37	H371	111.2°	109.5°
C36	C37	H372	111.2°	109.5°
H361	C36	H362	98.0°	109.5°
C38	C37	H371	111.2°	109.4°
C38	C37	H372	111.2°	109.5°
C37	C38	C39	107.7°	109.5°
C37	C38	H381	112.8°	109.4°
C37	C38	H382	112.9°	109.5°
H371	C37	H372	99.1°	109.5°
C39	C38	H381	112.8°	109.4°
C39	C38	H382	112.8°	109.5°
C38	C39	C3A	110.4°	109.5°
C38	C39	H391	111.9°	109.5°
C38	C39	H392	111.9°	109.5°
H381	C38	H382	97.6°	109.6°
C3A	C39	H391	111.9°	109.4°
C3A	C39	H392	111.9°	109.5°
C39	C3A	C3B	107.3°	109.5°
C39	C3A	H3A1	113.0°	109.5°
C39	C3A	H3A2	113.0°	109.5°
H391	C39	H392	98.5°	109.4°
C3B	C3A	H3A1	113.1°	109.4°
C3B	C3A	H3A2	113.0°	109.4°
C3A	C3B	C3C	110.3°	109.5°
C3A	C3B	H3B1	111.9°	109.5°
C3A	C3B	H3B2	111.9°	109.4°
H3A1	C3A	H3A2	97.4°	109.4°
C3C	C3B	H3B1	111.9°	109.4°
C3C	C3B	H3B2	112.0°	109.5°
C3B	C3C	C3D	107.3°	109.5°
C3B	C3C	H3C1	113.0°	109.5°
C3B	C3C	H3C2	112.9°	109.5°
H3B1	C3B	H3B2	98.5°	109.5°
C3D	C3C	H3C1	113.1°	109.4°
C3D	C3C	H3C2	113.0°	109.4°
C3C	C3D	C3E	115.0°	109.5°
C3C	C3D	H3D1	110.2°	109.5°
C3C	C3D	H3D2	110.2°	109.4°
H3C1	C3C	H3C2	97.4°	109.5°
C3E	C3D	H3D1	110.2°	109.4°
C3E	C3D	H3D2	110.2°	109.5°
C3D	C3E	C3F	110.2°	109.5°
C3D	C3E	H3E1	111.9°	109.5°
C3D	C3E	H3E2	111.9°	109.5°
H3D1	C3D	H3D2	100.0°	109.5°
C3F	C3E	H3E1	111.9°	109.5°
C3F	C3E	H3E2	111.9°	109.4°
C3E	C3F	C3G	113.6°	109.5°
C3E	C3F	H3F1	110.7°	109.5°
C3E	C3F	H3F2	110.7°	109.4°
H3E1	C3E	H3E2	98.6°	109.4°
C3G	C3F	H3F1	110.7°	109.5°
C3G	C3F	H3F2	110.7°	109.5°
C3F	C3G	C3H	111.9°	109.4°
C3F	C3G	H3G1	111.3°	109.5°
C3F	C3G	H3G2	111.3°	109.5°
H3F1	C3F	H3F2	99.5°	109.6°
C3H	C3G	H3G1	111.4°	109.5°
C3H	C3G	H3G2	111.4°	109.5°
C3G	C3H	C3I	107.3°	109.4°
C3G	C3H	H3H1	113.0°	109.5°
C3G	C3H	H3H2	113.0°	109.4°
H3G1	C3G	H3G2	99.0°	109.5°
C3I	C3H	H3H1	113.1°	109.5°
C3I	C3H	H3H2	113.0°	109.5°
C3H	C3I	H3I1	107.3°	109.5°
C3H	C3I	H3I2	113.0°	109.4°
C3H	C3I	H3I3	113.0°	109.5°
H3H1	C3H	H3H2	97.5°	109.5°
H3I1	C3I	H3I2	113.0°	109.5°
H3I1	C3I	H3I3	113.1°	109.5°
H3I2	C3I	H3I3	97.5°	109.4°
O21	C21	O22	122.3°	120.0°
O21	C21	C22	112.7°	120.0°
O22	C21	C22	125.0°	120.0°
C21	C22	C23	113.3°	109.5°
C21	C22	H221	110.8°	109.5°
C21	C22	H222	110.8°	109.5°
C23	C22	H221	110.8°	109.4°
C23	C22	H222	110.8°	109.5°
C22	C23	C24	117.2°	109.4°
C22	C23	H231	109.4°	109.4°
C22	C23	H232	109.4°	109.5°
H221	C22	H222	99.6°	109.5°
C24	C23	H231	109.4°	109.5°
C24	C23	H232	109.4°	109.5°
C23	C24	C25	113.3°	109.5°
C23	C24	H241	110.8°	109.4°
C23	C24	H242	110.8°	109.4°
H231	C23	H232	100.7°	109.5°
C25	C24	H241	110.8°	109.5°
C25	C24	H242	110.8°	109.5°
C24	C25	C26	110.8°	109.5°
C24	C25	H251	111.7°	109.5°
C24	C25	H252	111.7°	109.5°
H241	C24	H242	99.6°	109.5°
C26	C25	H251	111.7°	109.4°
C26	C25	H252	111.7°	109.5°
C25	C26	C27	112.1°	109.5°
C25	C26	H261	111.3°	109.5°
C25	C26	H262	111.2°	109.5°
H251	C25	H252	98.7°	109.5°
C27	C26	H261	111.3°	109.5°
C27	C26	H262	111.3°	109.5°
C26	C27	C28	113.3°	109.4°
C26	C27	H271	110.8°	109.5°
C26	C27	H272	110.8°	109.5°
H261	C26	H262	99.1°	109.5°
C28	C27	H271	110.9°	109.5°
C28	C27	H272	110.9°	109.4°
C27	C28	C29	110.1°	109.5°
C27	C28	H281	111.9°	109.5°
C27	C28	H282	111.9°	109.5°
H271	C27	H272	99.5°	109.5°
C29	C28	H281	112.0°	109.4°
C29	C28	H282	112.0°	109.5°
C28	C29	C2A	115.9°	109.5°
C28	C29	H291	109.8°	109.5°
C28	C29	H292	109.9°	109.5°
H281	C28	H282	98.5°	109.5°
C2A	C29	H291	109.9°	109.5°
C2A	C29	H292	109.9°	109.5°
C29	C2A	C2B	109.8°	109.5°
C29	C2A	H2A1	112.0°	109.5°
C29	C2A	H2A2	112.0°	109.5°
H291	C29	H292	100.3°	109.4°
C2B	C2A	H2A1	112.1°	109.5°
C2B	C2A	H2A2	112.1°	109.5°
C2A	C2B	C2C	109.0°	109.4°
C2A	C2B	H2B1	112.4°	109.5°
C2A	C2B	H2B2	112.4°	109.5°
H2A1	C2A	H2A2	98.4°	109.4°
C2C	C2B	H2B1	112.4°	109.5°
C2C	C2B	H2B2	112.4°	109.4°
C2B	C2C	C2D	111.2°	109.5°
C2B	C2C	H2C1	111.5°	109.5°
C2B	C2C	H2C2	111.5°	109.5°
H2B1	C2B	H2B2	98.0°	109.5°
C2D	C2C	H2C1	111.6°	109.5°
C2D	C2C	H2C2	111.6°	109.4°
C2C	C2D	C2E	108.6°	109.5°
C2C	C2D	H2D1	112.5°	109.5°
C2C	C2D	H2D2	112.5°	109.5°
H2C1	C2C	H2C2	98.9°	109.5°
C2E	C2D	H2D1	112.6°	109.5°
C2E	C2D	H2D2	112.6°	109.5°
C2D	C2E	C2F	111.2°	109.5°
C2D	C2E	H2E1	111.5°	109.5°
C2D	C2E	H2E2	111.5°	109.5°
H2D1	C2D	H2D2	97.8°	109.4°
C2F	C2E	H2E1	111.6°	109.5°
C2F	C2E	H2E2	111.6°	109.5°
C2E	C2F	C2G	112.3°	109.4°
C2E	C2F	H2F1	111.2°	109.4°
C2E	C2F	H2F2	111.2°	109.5°
H2E1	C2E	H2E2	98.9°	109.4°
C2G	C2F	H2F1	111.2°	109.5°
C2G	C2F	H2F2	111.2°	109.5°
C2F	C2G	C2H	109.9°	109.5°
C2F	C2G	H2G1	112.0°	109.5°
C2F	C2G	H2G2	112.0°	109.5°
H2F1	C2F	H2F2	99.1°	109.5°
C2H	C2G	H2G1	112.1°	109.4°
C2H	C2G	H2G2	112.1°	109.5°
C2G	C2H	C2I	111.5°	109.5°
C2G	C2H	H2H1	111.4°	109.4°
C2G	C2H	H2H2	111.4°	109.5°
H2G1	C2G	H2G2	98.3°	109.5°
C2I	C2H	H2H1	111.5°	109.5°
C2I	C2H	H2H2	111.5°	109.5°
C2H	C2I	H2I1	111.5°	109.5°
C2H	C2I	H2I2	111.4°	109.4°
C2H	C2I	H2I3	111.4°	109.5°
H2H1	C2H	H2H2	98.9°	109.5°
H2I1	C2I	H2I2	111.5°	109.5°
H2I1	C2I	H2I3	111.5°	109.5°
H2I2	C2I	H2I3	99.0°	109.5°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
O11	P	O12	O13	118.6°	120.0°
O11	P	O12	O14	117.3°	120.0°
O11	P	O13	O14	122.2°	120.0°
O11	P	O12	C11	103.0°	180.0°
O11	P	O13	HPO	180.0°	60.0°
P	O11	C1	C2	138.0°	180.0°
P	O11	C1	H11	96.8°	60.0°
P	O11	C1	H12	12.7°	60.1°
O12	P	O13	O14	123.1°	120.0°
O12	P	O11	C1	141.6°	180.0°
O12	P	O13	HPO	65.2°	60.0°
P	O12	C11	C12	150.8°	180.0°
P	O12	C11	H111	84.0°	60.0°
P	O12	C11	H112	25.5°	60.0°
O13	P	O11	C1	103.3°	60.0°
O13	P	O12	C11	15.6°	60.0°
O14	P	O11	C1	22.0°	60.0°
O14	P	O12	C11	139.8°	60.0°
O14	P	O13	HPO	57.8°	180.0°
C12	N	HN1	HN2	125.2°	113.7°
N	C12	C11	O12	143.5°	60.1°
N	C12	C11	H121	125.3°	120.0°
N	C12	C11	H122	125.2°	120.1°
N	C12	C11	H111	18.2°	60.0°
N	C12	C11	H112	91.2°	180.0°
N	C12	H121	H122	119.7°	120.0°
HN1	N	C12	C11	180.0°	180.0°
HN1	N	C12	H121	54.7°	60.1°
HN1	N	C12	H122	54.7°	59.9°
HN2	N	C12	C11	54.8°	66.2°
HN2	N	C12	H121	179.9°	173.8°
HN2	N	C12	H122	70.5°	53.8°
O11	C1	C2	H11	125.2°	120.0°
O11	C1	C2	H12	125.3°	119.9°
O11	C1	H11	H12	119.1°	120.0°
O11	C1	C2	C3	49.4°	60.0°
O11	C1	C2	O21	162.6°	60.0°
O11	C1	C2	H2	74.5°	180.0°
O12	C11	C12	H111	125.3°	120.0°
O12	C11	C12	H112	125.3°	120.0°
O12	C11	H111	H112	119.9°	120.0°
O12	C11	C12	H121	18.2°	180.0°
O12	C11	C12	H122	91.3°	60.0°
C12	C11	H111	H112	119.8°	120.0°
C11	C12	H121	H122	119.7°	120.0°
H111	C11	C12	H121	107.1°	60.0°
H111	C11	C12	H122	143.4°	179.9°
H112	C11	C12	H121	143.5°	60.0°
H112	C11	C12	H122	34.0°	59.9°
C2	C1	H11	H12	119.1°	120.1°
C1	C2	C3	O21	113.2°	120.0°
C1	C2	C3	H2	123.9°	120.0°
C1	C2	O21	H2	124.2°	120.0°
C1	C2	C3	O31	148.2°	60.0°
C1	C2	C3	H31	86.5°	60.0°
C1	C2	C3	H32	23.0°	179.9°
C1	C2	O21	C21	124.0°	90.0°
H11	C1	C2	C3	75.9°	60.0°
H11	C1	C2	O21	37.4°	180.0°
H11	C1	C2	H2	160.3°	60.0°
H12	C1	C2	C3	174.7°	179.9°
H12	C1	C2	O21	72.1°	59.9°
H12	C1	C2	H2	50.8°	60.1°
C3	C2	O21	H2	124.2°	119.9°
C2	C3	O31	H31	125.3°	119.9°
C2	C3	O31	H32	125.3°	120.0°
C2	C3	H31	H32	115.1°	120.0°
C2	C3	O31	C31	94.1°	180.0°
C3	C2	O21	C21	124.4°	150.0°
O21	C2	C3	O31	35.0°	60.1°
O21	C2	C3	H31	160.3°	180.0°
O21	C2	C3	H32	90.3°	60.0°
C2	O21	C21	O22	27.0°	0.0°
C2	O21	C21	C22	153.1°	179.9°
H2	C2	C3	O31	87.9°	180.0°
H2	C2	C3	H31	37.4°	60.0°
H2	C2	C3	H32	146.8°	59.9°
H2	C2	O21	C21	0.2°	30.1°
O31	C3	H31	H32	115.1°	120.1°
C3	O31	C31	O32	19.3°	0.0°
C3	O31	C31	C32	163.2°	180.0°
H31	C3	O31	C31	140.6°	60.0°
H32	C3	O31	C31	31.1°	60.0°
O31	C31	O32	C32	177.2°	180.0°
O31	C31	C32	C33	89.8°	180.0°
O31	C31	C32	H321	35.5°	60.0°
O31	C31	C32	H322	144.9°	60.0°
O32	C31	C32	C33	87.7°	0.0°
O32	C31	C32	H321	147.0°	120.0°
O32	C31	C32	H322	37.5°	120.0°
C31	C32	C33	H321	125.3°	120.0°
C31	C32	C33	H322	125.2°	120.0°
C31	C32	H321	H322	117.2°	120.0°
C31	C32	C33	C34	158.5°	180.0°
C31	C32	C33	H331	33.3°	60.0°
C31	C32	C33	H332	76.2°	59.9°
C33	C32	H321	H322	117.3°	120.0°
C32	C33	C34	H331	125.2°	120.0°
C32	C33	C34	H332	125.2°	120.1°
C32	C33	H331	H332	117.5°	120.0°
C32	C33	C34	C35	156.4°	180.0°
C32	C33	C34	H341	78.3°	60.0°
C32	C33	C34	H342	31.1°	60.0°
H321	C32	C33	C34	76.2°	60.1°
H321	C32	C33	H331	158.6°	180.0°
H321	C32	C33	H332	49.1°	60.0°
H322	C32	C33	C34	33.3°	60.0°
H322	C32	C33	H331	91.9°	60.0°
H322	C32	C33	H332	158.5°	180.0°
C34	C33	H331	H332	117.5°	120.0°
C33	C34	C35	H341	125.3°	119.9°
C33	C34	C35	H342	125.2°	120.0°
C33	C34	H341	H342	118.0°	119.9°
C33	C34	C35	C36	161.7°	180.0°
C33	C34	C35	H351	36.4°	60.1°
C33	C34	C35	H352	73.0°	59.9°
H331	C33	C34	C35	31.2°	60.1°
H331	C33	C34	H341	156.5°	180.0°
H331	C33	C34	H342	94.1°	60.0°
H332	C33	C34	C35	78.4°	59.9°
H332	C33	C34	H341	46.9°	60.1°
H332	C33	C34	H342	156.3°	180.0°
C35	C34	H341	H342	118.2°	120.1°
C34	C35	C36	H351	125.2°	119.9°
C34	C35	C36	H352	125.3°	120.1°
C34	C35	H351	H352	116.9°	120.0°
C34	C35	C36	C37	174.8°	180.0°
C34	C35	C36	H361	59.9°	60.1°
C34	C35	C36	H362	49.5°	59.9°
H341	C34	C35	C36	73.0°	60.1°
H341	C34	C35	H351	161.7°	180.0°
H341	C34	C35	H352	52.3°	60.0°
H342	C34	C35	C36	36.5°	60.0°
H342	C34	C35	H351	88.8°	59.9°
H342	C34	C35	H352	161.8°	179.9°
C36	C35	H351	H352	116.9°	120.0°
C35	C36	C37	H361	125.3°	119.9°
C35	C36	C37	H362	125.2°	120.1°
C35	C36	H361	H362	118.2°	120.0°
C35	C36	C37	C38	159.6°	180.0°
C35	C36	C37	H371	75.2°	60.1°
C35	C36	C37	H372	34.2°	59.9°
H351	C35	C36	C37	49.6°	60.1°
H351	C35	C36	H361	174.9°	180.0°
H351	C35	C36	H362	75.7°	60.0°
H352	C35	C36	C37	59.9°	59.9°
H352	C35	C36	H361	65.4°	60.1°
H352	C35	C36	H362	174.8°	180.0°
C37	C36	H361	H362	118.3°	120.0°
C36	C37	C38	H371	125.3°	120.0°
C36	C37	C38	H372	125.3°	120.1°
C36	C37	H371	H372	117.0°	120.0°
C36	C37	C38	C39	39.9°	180.0°
C36	C37	C38	H381	85.4°	60.1°
C36	C37	C38	H382	165.1°	60.0°
H361	C36	C37	C38	34.3°	60.0°
H361	C36	C37	H371	159.5°	180.0°
H361	C36	C37	H372	91.0°	60.0°
H362	C36	C37	C38	75.2°	60.0°
H362	C36	C37	H371	50.1°	60.0°
H362	C36	C37	H372	159.5°	180.0°
C38	C37	H371	H372	117.1°	120.0°
C37	C38	C39	H381	125.2°	119.9°
C37	C38	C39	H382	125.3°	120.0°
C37	C38	H381	H382	118.8°	120.1°
C37	C38	C39	C3A	159.7°	180.0°
C37	C38	C39	H391	75.0°	60.1°
C37	C38	C39	H392	34.4°	59.9°
H371	C37	C38	C39	165.1°	60.0°
H371	C37	C38	H381	39.9°	179.9°
H371	C37	C38	H382	69.6°	60.0°
H372	C37	C38	C39	85.4°	59.9°
H372	C37	C38	H381	149.4°	59.9°
H372	C37	C38	H382	39.8°	179.9°
C39	C38	H381	H382	118.8°	120.0°
C38	C39	C3A	H391	125.3°	120.0°
C38	C39	C3A	H392	125.3°	120.1°
C38	C39	H391	H392	117.7°	120.0°
C38	C39	C3A	C3B	22.9°	180.0°
C38	C39	C3A	H3A1	148.2°	60.0°
C38	C39	C3A	H3A2	102.3°	60.0°
H381	C38	C39	C3A	34.5°	60.1°
H381	C38	C39	H391	159.8°	180.0°
H381	C38	C39	H392	90.8°	60.0°
H382	C38	C39	C3A	75.0°	60.0°
H382	C38	C39	H391	50.3°	59.9°
H382	C38	C39	H392	159.7°	179.9°
C3A	C39	H391	H392	117.8°	120.0°
C39	C3A	C3B	H3A1	125.3°	120.1°
C39	C3A	C3B	H3A2	125.3°	120.0°
C39	C3A	H3A1	H3A2	118.9°	120.0°
C39	C3A	C3B	C3C	164.3°	180.0°
C39	C3A	C3B	H3B1	70.4°	60.0°
C39	C3A	C3B	H3B2	39.0°	59.9°
H391	C39	C3A	C3B	102.4°	60.0°
H391	C39	C3A	H3A1	22.9°	180.0°
H391	C39	C3A	H3A2	132.4°	60.0°
H392	C39	C3A	C3B	148.2°	60.0°
H392	C39	C3A	H3A1	86.5°	60.1°
H392	C39	C3A	H3A2	22.9°	179.9°
C3B	C3A	H3A1	H3A2	118.9°	119.9°
C3A	C3B	C3C	H3B1	125.2°	120.0°
C3A	C3B	C3C	H3B2	125.3°	120.0°
C3A	C3B	H3B1	H3B2	117.8°	119.9°
C3A	C3B	C3C	C3D	153.6°	180.0°
C3A	C3B	C3C	H3C1	81.1°	60.0°
C3A	C3B	C3C	H3C2	28.3°	60.0°
H3A1	C3A	C3B	C3C	39.1°	59.9°
H3A1	C3A	C3B	H3B1	164.3°	179.9°
H3A1	C3A	C3B	H3B2	86.3°	60.1°
H3A2	C3A	C3B	C3C	70.4°	60.0°
H3A2	C3A	C3B	H3B1	54.8°	60.0°
H3A2	C3A	C3B	H3B2	164.3°	180.0°
C3C	C3B	H3B1	H3B2	117.9°	120.0°
C3B	C3C	C3D	H3C1	125.3°	120.0°
C3B	C3C	C3D	H3C2	125.2°	120.0°
C3B	C3C	H3C1	H3C2	118.8°	120.0°
C3B	C3C	C3D	C3E	172.2°	180.0°
C3B	C3C	C3D	H3D1	62.5°	60.0°
C3B	C3C	C3D	H3D2	46.9°	59.9°
H3B1	C3B	C3C	C3D	28.4°	60.0°
H3B1	C3B	C3C	H3C1	153.7°	180.0°
H3B1	C3B	C3C	H3C2	96.9°	60.0°
H3B2	C3B	C3C	C3D	81.2°	60.0°
H3B2	C3B	C3C	H3C1	44.2°	60.0°
H3B2	C3B	C3C	H3C2	153.6°	180.0°
C3D	C3C	H3C1	H3C2	119.0°	119.9°
C3C	C3D	C3E	H3D1	125.3°	120.0°
C3C	C3D	C3E	H3D2	125.3°	120.0°
C3C	C3D	H3D1	H3D2	116.0°	119.9°
C3C	C3D	C3E	C3F	63.1°	180.0°
C3C	C3D	C3E	H3E1	171.6°	60.0°
C3C	C3D	C3E	H3E2	62.1°	60.0°
H3C1	C3C	C3D	C3E	46.9°	60.0°
H3C1	C3C	C3D	H3D1	172.2°	180.0°
H3C1	C3C	C3D	H3D2	78.4°	60.1°
H3C2	C3C	C3D	C3E	62.6°	60.0°
H3C2	C3C	C3D	H3D1	62.7°	60.0°
H3C2	C3C	C3D	H3D2	172.1°	180.0°
C3E	C3D	H3D1	H3D2	116.0°	120.0°
C3D	C3E	C3F	H3E1	125.2°	120.0°
C3D	C3E	C3F	H3E2	125.2°	120.0°
C3D	C3E	H3E1	H3E2	117.9°	120.0°
C3D	C3E	C3F	C3G	147.4°	180.0°
C3D	C3E	C3F	H3F1	22.1°	60.0°
C3D	C3E	C3F	H3F2	87.3°	60.0°
H3D1	C3D	C3E	C3F	62.1°	60.0°
H3D1	C3D	C3E	H3E1	63.1°	180.0°
H3D1	C3D	C3E	H3E2	172.6°	60.0°
H3D2	C3D	C3E	C3F	171.6°	60.0°
H3D2	C3D	C3E	H3E1	46.3°	60.0°
H3D2	C3D	C3E	H3E2	63.2°	180.0°
C3F	C3E	H3E1	H3E2	117.9°	120.0°
C3E	C3F	C3G	H3F1	125.3°	120.0°
C3E	C3F	C3G	H3F2	125.3°	119.9°
C3E	C3F	H3F1	H3F2	116.5°	120.0°
C3E	C3F	C3G	C3H	76.9°	180.0°
C3E	C3F	C3G	H3G1	48.4°	60.0°
C3E	C3F	C3G	H3G2	157.9°	60.1°
H3E1	C3E	C3F	C3G	87.4°	59.9°
H3E1	C3E	C3F	H3F1	147.4°	179.9°
H3E1	C3E	C3F	H3F2	38.0°	60.0°
H3E2	C3E	C3F	C3G	22.2°	60.0°
H3E2	C3E	C3F	H3F1	103.1°	60.0°
H3E2	C3E	C3F	H3F2	147.5°	180.0°
C3G	C3F	H3F1	H3F2	116.6°	120.0°
C3F	C3G	C3H	H3G1	125.3°	120.0°
C3F	C3G	C3H	H3G2	125.2°	120.0°
C3F	C3G	H3G1	H3G2	117.2°	120.0°
C3F	C3G	C3H	C3I	51.1°	180.0°
C3F	C3G	C3H	H3H1	176.4°	60.0°
C3F	C3G	C3H	H3H2	74.2°	60.1°
H3F1	C3F	C3G	C3H	157.9°	60.0°
H3F1	C3F	C3G	H3G1	76.8°	180.0°
H3F1	C3F	C3G	H3G2	32.6°	59.9°
H3F2	C3F	C3G	C3H	48.5°	60.1°
H3F2	C3F	C3G	H3G1	173.7°	59.9°
H3F2	C3F	C3G	H3G2	76.8°	180.0°
C3H	C3G	H3G1	H3G2	117.3°	120.0°
C3G	C3H	C3I	H3H1	125.3°	120.0°
C3G	C3H	C3I	H3H2	125.2°	119.9°
C3G	C3H	H3H1	H3H2	118.9°	120.0°
C3G	C3H	C3I	H3I1	180.0°	180.0°
C3G	C3H	C3I	H3I2	54.8°	60.0°
C3G	C3H	C3I	H3I3	54.7°	59.9°
H3G1	C3G	C3H	C3I	74.2°	60.0°
H3G1	C3G	C3H	H3H1	51.1°	180.0°
H3G1	C3G	C3H	H3H2	160.6°	59.9°
H3G2	C3G	C3H	C3I	176.3°	60.0°
H3G2	C3G	C3H	H3H1	58.4°	60.0°
H3G2	C3G	C3H	H3H2	51.0°	180.0°
C3I	C3H	H3H1	H3H2	119.0°	120.0°
C3H	C3I	H3I1	H3I2	125.2°	120.0°
C3H	C3I	H3I1	H3I3	125.3°	120.0°
C3H	C3I	H3I2	H3I3	118.9°	120.0°
H3H1	C3H	C3I	H3I1	54.8°	60.0°
H3H1	C3H	C3I	H3I2	180.0°	60.0°
H3H1	C3H	C3I	H3I3	70.6°	180.0°
H3H2	C3H	C3I	H3I1	54.8°	60.0°
H3H2	C3H	C3I	H3I2	70.4°	179.9°
H3H2	C3H	C3I	H3I3	179.9°	60.0°
H3I1	C3I	H3I2	H3I3	119.0°	120.0°
O21	C21	O22	C22	179.9°	180.0°
O21	C21	C22	C23	86.9°	180.0°
O21	C21	C22	H221	38.3°	60.0°
O21	C21	C22	H222	147.8°	60.0°
O22	C21	C22	C23	93.2°	0.0°
O22	C21	C22	H221	141.6°	120.0°
O22	C21	C22	H222	32.1°	120.0°
C21	C22	C23	H221	125.2°	120.0°
C21	C22	C23	H222	125.3°	120.0°
C21	C22	H221	H222	116.7°	120.0°
C21	C22	C23	C24	150.0°	180.0°
C21	C22	C23	H231	24.7°	60.1°
C21	C22	C23	H232	84.7°	60.0°
C23	C22	H221	H222	116.7°	120.0°
C22	C23	C24	H231	125.3°	119.9°
C22	C23	C24	H232	125.3°	120.0°
C22	C23	H231	H232	115.2°	120.1°
C22	C23	C24	C25	42.6°	180.0°
C22	C23	C24	H241	82.7°	60.0°
C22	C23	C24	H242	167.8°	60.0°
H221	C22	C23	C24	84.8°	60.0°
H221	C22	C23	H231	149.9°	180.0°
H221	C22	C23	H232	40.5°	60.0°
H222	C22	C23	C24	24.7°	60.0°
H222	C22	C23	H231	100.6°	60.0°
H222	C22	C23	H232	150.0°	NaN°
C24	C23	H231	H232	115.1°	120.0°
C23	C24	C25	H241	125.3°	120.0°
C23	C24	C25	H242	125.2°	119.9°
C23	C24	H241	H242	116.7°	119.9°
C23	C24	C25	C26	135.8°	180.0°
C23	C24	C25	H251	10.5°	60.0°
C23	C24	C25	H252	99.0°	60.0°
H231	C23	C24	C25	167.9°	60.0°
H231	C23	C24	H241	42.6°	179.9°
H231	C23	C24	H242	66.9°	59.9°
H232	C23	C24	C25	82.7°	60.0°
H232	C23	C24	H241	152.1°	60.0°
H232	C23	C24	H242	42.5°	180.0°
C25	C24	H241	H242	116.6°	120.1°
C24	C25	C26	H251	125.2°	120.0°
C24	C25	C26	H252	125.3°	120.0°
C24	C25	H251	H252	117.6°	120.0°
C24	C25	C26	C27	171.1°	180.0°
C24	C25	C26	H261	63.6°	60.0°
C24	C25	C26	H262	45.9°	60.0°
H241	C24	C25	C26	99.0°	60.0°
H241	C24	C25	H251	135.8°	180.0°
H241	C24	C25	H252	26.3°	59.9°
H242	C24	C25	C26	10.5°	60.1°
H242	C24	C25	H251	114.7°	59.9°
H242	C24	C25	H252	135.8°	179.9°
C26	C25	H251	H252	117.6°	119.9°
C25	C26	C27	H261	125.3°	120.0°
C25	C26	C27	H262	125.3°	120.0°
C25	C26	H261	H262	117.1°	120.0°
C25	C26	C27	C28	146.0°	180.0°
C25	C26	C27	H271	88.6°	60.0°
C25	C26	C27	H272	20.8°	60.1°
H251	C25	C26	C27	45.9°	60.0°
H251	C25	C26	H261	171.2°	180.0°
H251	C25	C26	H262	79.4°	60.1°
H252	C25	C26	C27	63.6°	60.0°
H252	C25	C26	H261	61.7°	60.0°
H252	C25	C26	H262	171.2°	180.0°
C27	C26	H261	H262	117.2°	120.0°
C26	C27	C28	H271	125.3°	120.0°
C26	C27	C28	H272	125.2°	119.9°
C26	C27	H271	H272	116.6°	120.0°
C26	C27	C28	C29	141.6°	180.0°
C26	C27	C28	H281	93.1°	60.0°
C26	C27	C28	H282	16.4°	60.0°
H261	C26	C27	C28	20.7°	60.0°
H261	C26	C27	H271	146.0°	180.0°
H261	C26	C27	H272	104.5°	59.9°
H262	C26	C27	C28	88.7°	60.0°
H262	C26	C27	H271	36.6°	60.0°
H262	C26	C27	H272	146.0°	179.9°
C28	C27	H271	H272	116.7°	120.0°
C27	C28	C29	H281	125.2°	120.0°
C27	C28	C29	H282	125.2°	120.0°
C27	C28	H281	H282	117.8°	120.1°
C27	C28	C29	C2A	174.5°	180.0°
C27	C28	C29	H291	49.2°	60.0°
C27	C28	C29	H292	60.2°	60.0°
H271	C27	C28	C29	16.4°	60.0°
H271	C27	C28	H281	141.6°	180.0°
H271	C27	C28	H282	108.9°	60.0°
H272	C27	C28	C29	93.1°	60.0°
H272	C27	C28	H281	32.1°	59.9°
H272	C27	C28	H282	141.6°	180.0°
C29	C28	H281	H282	117.9°	120.0°
C28	C29	C2A	H291	125.2°	120.0°
C28	C29	C2A	H292	125.3°	120.0°
C28	C29	H291	H292	115.6°	120.0°
C28	C29	C2A	C2B	83.6°	180.0°
C28	C29	C2A	H2A1	151.2°	60.0°
C28	C29	C2A	H2A2	41.7°	60.0°
H281	C28	C29	C2A	60.3°	60.0°
H281	C28	C29	H291	174.4°	180.0°
H281	C28	C29	H292	65.0°	60.0°
H282	C28	C29	C2A	49.2°	60.0°
H282	C28	C29	H291	76.0°	60.1°
H282	C28	C29	H292	174.5°	180.0°
C2A	C29	H291	H292	115.7°	119.9°
C29	C2A	C2B	H2A1	125.2°	120.0°
C29	C2A	C2B	H2A2	125.2°	120.0°
C29	C2A	H2A1	H2A2	118.0°	120.0°
C29	C2A	C2B	C2C	174.8°	180.0°
C29	C2A	C2B	H2B1	49.5°	60.0°
C29	C2A	C2B	H2B2	59.9°	60.0°
H291	C29	C2A	C2B	41.6°	59.9°
H291	C29	C2A	H2A1	83.6°	180.0°
H291	C29	C2A	H2A2	166.9°	60.1°
H292	C29	C2A	C2B	151.1°	60.0°
H292	C29	C2A	H2A1	25.9°	60.0°
H292	C29	C2A	H2A2	83.6°	180.0°
C2B	C2A	H2A1	H2A2	118.1°	120.0°
C2A	C2B	C2C	H2B1	125.3°	120.0°
C2A	C2B	C2C	H2B2	125.3°	120.0°
C2A	C2B	H2B1	H2B2	118.3°	120.0°
C2A	C2B	C2C	C2D	160.8°	180.0°
C2A	C2B	C2C	H2C1	35.6°	60.0°
C2A	C2B	C2C	H2C2	73.9°	60.1°
H2A1	C2A	C2B	C2C	60.0°	59.9°
H2A1	C2A	C2B	H2B1	174.7°	180.0°
H2A1	C2A	C2B	H2B2	65.3°	60.0°
H2A2	C2A	C2B	C2C	49.6°	60.1°
H2A2	C2A	C2B	H2B1	75.7°	60.0°
H2A2	C2A	C2B	H2B2	174.9°	180.0°
C2C	C2B	H2B1	H2B2	118.3°	120.0°
C2B	C2C	C2D	H2C1	125.2°	120.1°
C2B	C2C	C2D	H2C2	125.2°	120.0°
C2B	C2C	H2C1	H2C2	117.4°	120.0°
C2B	C2C	C2D	C2E	166.6°	180.0°
C2B	C2C	C2D	H2D1	41.3°	59.9°
C2B	C2C	C2D	H2D2	68.1°	60.0°
H2B1	C2B	C2C	C2D	73.9°	60.0°
H2B1	C2B	C2C	H2C1	160.8°	180.0°
H2B1	C2B	C2C	H2C2	51.3°	59.9°
H2B2	C2B	C2C	C2D	35.6°	60.0°
H2B2	C2B	C2C	H2C1	89.7°	60.0°
H2B2	C2B	C2C	H2C2	160.8°	179.9°
C2D	C2C	H2C1	H2C2	117.5°	119.9°
C2C	C2D	C2E	H2D1	125.3°	120.1°
C2C	C2D	C2E	H2D2	125.3°	120.0°
C2C	C2D	H2D1	H2D2	118.4°	120.0°
C2C	C2D	C2E	C2F	131.6°	180.0°
C2C	C2D	C2E	H2E1	6.3°	59.9°
C2C	C2D	C2E	H2E2	103.2°	60.0°
H2C1	C2C	C2D	C2E	68.2°	59.9°
H2C1	C2C	C2D	H2D1	166.5°	180.0°
H2C1	C2C	C2D	H2D2	57.1°	60.1°
H2C2	C2C	C2D	C2E	41.4°	60.0°
H2C2	C2C	C2D	H2D1	83.9°	60.0°
H2C2	C2C	C2D	H2D2	166.7°	180.0°
C2E	C2D	H2D1	H2D2	118.5°	119.9°
C2D	C2E	C2F	H2E1	125.2°	120.0°
C2D	C2E	C2F	H2E2	125.2°	120.0°
C2D	C2E	H2E1	H2E2	117.4°	119.9°
C2D	C2E	C2F	C2G	151.8°	180.0°
C2D	C2E	C2F	H2F1	26.5°	60.0°
C2D	C2E	C2F	H2F2	82.9°	60.0°
H2D1	C2D	C2E	C2F	103.2°	60.0°
H2D1	C2D	C2E	H2E1	131.6°	NaN°
H2D1	C2D	C2E	H2E2	22.1°	60.1°
H2D2	C2D	C2E	C2F	6.3°	60.0°
H2D2	C2D	C2E	H2E1	119.0°	60.1°
H2D2	C2D	C2E	H2E2	131.6°	180.0°
C2F	C2E	H2E1	H2E2	117.5°	120.0°
C2E	C2F	C2G	H2F1	125.2°	119.9°
C2E	C2F	C2G	H2F2	125.3°	120.0°
C2E	C2F	H2F1	H2F2	117.0°	120.0°
C2E	C2F	C2G	C2H	159.8°	180.0°
C2E	C2F	C2G	H2G1	34.5°	60.1°
C2E	C2F	C2G	H2G2	74.9°	60.0°
H2E1	C2E	C2F	C2G	83.0°	60.0°
H2E1	C2E	C2F	H2F1	151.7°	180.0°
H2E1	C2E	C2F	H2F2	42.3°	60.0°
H2E2	C2E	C2F	C2G	26.5°	60.0°
H2E2	C2E	C2F	H2F1	98.7°	60.0°
H2E2	C2E	C2F	H2F2	151.8°	180.0°
C2G	C2F	H2F1	H2F2	117.1°	120.1°
C2F	C2G	C2H	H2G1	125.3°	120.0°
C2F	C2G	C2H	H2G2	125.2°	120.1°
C2F	C2G	H2G1	H2G2	117.9°	120.0°
C2F	C2G	C2H	C2I	134.2°	180.0°
C2F	C2G	C2H	H2H1	100.5°	60.0°
C2F	C2G	C2H	H2H2	9.0°	59.9°
H2F1	C2F	C2G	C2H	74.9°	60.1°
H2F1	C2F	C2G	H2G1	159.8°	180.0°
H2F1	C2F	C2G	H2G2	50.3°	60.0°
H2F2	C2F	C2G	C2H	34.6°	60.0°
H2F2	C2F	C2G	H2G1	90.8°	60.0°
H2F2	C2F	C2G	H2G2	159.8°	180.0°
C2H	C2G	H2G1	H2G2	118.0°	120.0°
C2G	C2H	C2I	H2H1	125.2°	120.0°
C2G	C2H	C2I	H2H2	125.2°	120.1°
C2G	C2H	H2H1	H2H2	117.3°	120.0°
C2G	C2H	C2I	H2I1	180.0°	179.9°
C2G	C2H	C2I	H2I2	54.7°	60.0°
C2G	C2H	C2I	H2I3	54.7°	60.0°
H2G1	C2G	C2H	C2I	9.0°	60.0°
H2G1	C2G	C2H	H2H1	134.2°	180.0°
H2G1	C2G	C2H	H2H2	116.3°	60.0°
H2G2	C2G	C2H	C2I	100.5°	60.0°
H2G2	C2G	C2H	H2H1	24.7°	60.0°
H2G2	C2G	C2H	H2H2	134.2°	180.0°
C2I	C2H	H2H1	H2H2	117.4°	120.0°
C2H	C2I	H2I1	H2I2	125.2°	120.0°
C2H	C2I	H2I1	H2I3	125.2°	120.0°
C2H	C2I	H2I2	H2I3	117.3°	119.9°
H2H1	C2H	C2I	H2I1	54.7°	60.0°
H2H1	C2H	C2I	H2I2	180.0°	179.9°
H2H1	C2H	C2I	H2I3	70.5°	60.0°
H2H2	C2H	C2I	H2I1	54.8°	60.0°
H2H2	C2H	C2I	H2I2	70.5°	60.1°
H2H2	C2H	C2I	H2I3	180.0°	180.0°
H2I1	C2I	H2I2	H2I3	117.5°	120.0°

Definition date:	2002-07-11
Last modified:	2021-07-08
Release status:	OBS
Processing site:	RCSB
Replaced by:	3PE
Derived from:	1M56