ZGS
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C01 | C02 | sing | 1.53Å | 1.54Å | |
| C03 | C02 | sing | 1.51Å | 1.51Å | |
| C03 | C04 | doub | 1.31Å | 1.34Å | |
| C04 | C05 | sing | 1.51Å | 1.55Å | |
| C05 | C06 | sing | 1.51Å | 1.56Å | |
| C06 | C07 | doub | 1.31Å | 1.36Å | |
| C08 | C07 | sing | 1.51Å | 1.54Å | |
| C08 | C09 | sing | 1.51Å | 1.55Å | |
| C09 | C10 | doub | 1.31Å | 1.36Å | |
| C10 | C11 | sing | 1.51Å | 1.55Å | |
| C11 | C12 | sing | 1.53Å | 1.57Å | |
| C12 | C13 | sing | 1.53Å | 1.55Å | |
| C13 | C14 | sing | 1.53Å | 1.55Å | |
| C14 | C15 | sing | 1.53Å | 1.56Å | |
| O19 | C18 | doub | 1.21Å | 1.18Å | |
| C16 | C17 | sing | 1.53Å | 1.55Å | |
| C16 | C15 | sing | 1.53Å | 1.55Å | |
| C17 | C18 | sing | 1.51Å | 1.55Å | |
| C18 | O20 | sing | 1.34Å | 1.42Å | |
| O20 | C21 | sing | 1.45Å | 1.42Å | |
| O35 | C22 | sing | 1.43Å | 1.39Å | |
| C21 | C22 | sing | 1.53Å | 1.54Å | |
| O26 | P25 | doub | 1.48Å | 1.52Å | |
| C22 | C23 | sing | 1.53Å | 1.54Å | |
| O27 | P25 | sing | 1.61Å | 1.52Å | |
| P25 | O24 | sing | 1.61Å | 1.67Å | |
| P25 | O28 | sing | 1.61Å | 1.67Å | |
| C23 | O24 | sing | 1.43Å | 1.42Å | |
| O28 | C29 | sing | 1.43Å | 1.43Å | |
| C29 | C30 | sing | 1.53Å | 1.54Å | |
| C30 | N31 | sing | 1.47Å | 1.48Å | |
| C32 | N31 | sing | 1.47Å | 1.44Å | |
| N31 | C33 | sing | 1.47Å | 1.46Å | |
| N31 | C34 | sing | 1.47Å | 1.45Å | |
| C01 | H1 | sing | 1.09Å | 1.10Å | |
| C01 | H2 | sing | 1.09Å | 1.10Å | |
| C01 | H3 | sing | 1.09Å | 1.10Å | |
| C02 | H4 | sing | 1.09Å | 1.10Å | |
| C02 | H5 | sing | 1.09Å | 1.10Å | |
| C03 | H6 | sing | 1.08Å | 1.08Å | |
| C04 | H7 | sing | 1.08Å | 1.08Å | |
| C05 | H8 | sing | 1.09Å | 1.10Å | |
| C05 | H9 | sing | 1.09Å | 1.10Å | |
| C06 | H10 | sing | 1.08Å | 1.08Å | |
| C07 | H11 | sing | 1.08Å | 1.08Å | |
| C08 | H12 | sing | 1.09Å | 1.10Å | |
| C08 | H13 | sing | 1.09Å | 1.10Å | |
| C09 | H14 | sing | 1.08Å | 1.08Å | |
| C10 | H15 | sing | 1.08Å | 1.08Å | |
| C11 | H16 | sing | 1.09Å | 1.10Å | |
| C11 | H17 | sing | 1.09Å | 1.10Å | |
| C12 | H18 | sing | 1.09Å | 1.10Å | |
| C12 | H19 | sing | 1.09Å | 1.10Å | |
| C13 | H20 | sing | 1.09Å | 1.10Å | |
| C13 | H21 | sing | 1.09Å | 1.10Å | |
| C14 | H22 | sing | 1.09Å | 1.10Å | |
| C14 | H23 | sing | 1.09Å | 1.10Å | |
| C15 | H24 | sing | 1.09Å | 1.10Å | |
| C15 | H25 | sing | 1.09Å | 1.10Å | |
| C16 | H26 | sing | 1.09Å | 1.10Å | |
| C16 | H27 | sing | 1.09Å | 1.10Å | |
| C17 | H28 | sing | 1.09Å | 1.10Å | |
| C17 | H29 | sing | 1.09Å | 1.10Å | |
| C21 | H30 | sing | 1.09Å | 1.10Å | |
| C21 | H31 | sing | 1.09Å | 1.10Å | |
| C22 | H32 | sing | 1.09Å | 1.10Å | |
| C23 | H33 | sing | 1.09Å | 1.10Å | |
| C23 | H34 | sing | 1.09Å | 1.10Å | |
| C29 | H35 | sing | 1.09Å | 1.10Å | |
| C29 | H36 | sing | 1.09Å | 1.10Å | |
| C30 | H37 | sing | 1.09Å | 1.10Å | |
| C30 | H38 | sing | 1.09Å | 1.10Å | |
| C32 | H39 | sing | 1.09Å | 1.10Å | |
| C32 | H40 | sing | 1.09Å | 1.10Å | |
| C32 | H41 | sing | 1.09Å | 1.10Å | |
| C33 | H42 | sing | 1.09Å | 1.10Å | |
| C33 | H43 | sing | 1.09Å | 1.10Å | |
| C33 | H44 | sing | 1.09Å | 1.10Å | |
| C34 | H45 | sing | 1.09Å | 1.10Å | |
| C34 | H46 | sing | 1.09Å | 1.10Å | |
| C34 | H47 | sing | 1.09Å | 1.10Å | |
| O27 | H48 | sing | 0.97Å | 0.95Å | |
| O35 | H49 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C01 | C02 | C03 | 108.9° | 109.5° |
| C02 | C01 | H1 | 109.5° | 109.5° |
| C02 | C01 | H2 | 109.5° | 109.5° |
| C02 | C01 | H3 | 109.4° | 109.5° |
| C01 | C02 | H4 | 109.6° | 109.5° |
| C01 | C02 | H5 | 109.6° | 109.5° |
| C02 | C03 | C04 | 121.8° | 120.0° |
| C03 | C02 | H4 | 109.6° | 109.5° |
| C03 | C02 | H5 | 109.6° | 109.4° |
| C02 | C03 | H6 | 119.1° | 120.0° |
| C03 | C04 | C05 | 122.5° | 120.0° |
| C04 | C03 | H6 | 119.1° | 120.0° |
| C03 | C04 | H7 | 118.7° | 120.0° |
| C04 | C05 | C06 | 108.5° | 109.5° |
| C05 | C04 | H7 | 118.8° | 120.0° |
| C04 | C05 | H8 | 109.7° | 109.5° |
| C04 | C05 | H9 | 109.7° | 109.4° |
| C05 | C06 | C07 | 121.4° | 120.0° |
| C06 | C05 | H8 | 109.7° | 109.5° |
| C06 | C05 | H9 | 109.7° | 109.5° |
| C05 | C06 | H10 | 119.3° | 120.0° |
| C06 | C07 | C08 | 121.5° | 120.0° |
| C07 | C06 | H10 | 119.3° | 120.0° |
| C06 | C07 | H11 | 119.3° | 119.9° |
| C07 | C08 | C09 | 110.1° | 109.5° |
| C08 | C07 | H11 | 119.2° | 120.0° |
| C07 | C08 | H12 | 109.3° | 109.5° |
| C07 | C08 | H13 | 109.3° | 109.5° |
| C08 | C09 | C10 | 120.7° | 120.0° |
| C09 | C08 | H12 | 109.3° | 109.5° |
| C09 | C08 | H13 | 109.3° | 109.5° |
| C08 | C09 | H14 | 119.6° | 120.0° |
| C09 | C10 | C11 | 121.0° | 120.0° |
| C10 | C09 | H14 | 119.7° | 120.0° |
| C09 | C10 | H15 | 119.5° | 120.0° |
| C10 | C11 | C12 | 109.2° | 109.5° |
| C11 | C10 | H15 | 119.5° | 120.0° |
| C10 | C11 | H16 | 109.6° | 109.5° |
| C10 | C11 | H17 | 109.5° | 109.5° |
| C11 | C12 | C13 | 111.8° | 109.5° |
| C12 | C11 | H16 | 109.5° | 109.4° |
| C12 | C11 | H17 | 109.6° | 109.5° |
| C11 | C12 | H18 | 108.9° | 109.5° |
| C11 | C12 | H19 | 108.9° | 109.5° |
| C12 | C13 | C14 | 112.5° | 109.5° |
| C13 | C12 | H18 | 108.9° | 109.5° |
| C13 | C12 | H19 | 108.9° | 109.4° |
| C12 | C13 | H20 | 108.7° | 109.5° |
| C12 | C13 | H21 | 108.7° | 109.4° |
| C13 | C14 | C15 | 112.4° | 109.5° |
| C14 | C13 | H20 | 108.7° | 109.5° |
| C14 | C13 | H21 | 108.7° | 109.5° |
| C13 | C14 | H22 | 108.7° | 109.5° |
| C13 | C14 | H23 | 108.8° | 109.4° |
| C14 | C15 | C16 | 112.6° | 109.4° |
| C15 | C14 | H22 | 108.7° | 109.5° |
| C15 | C14 | H23 | 108.7° | 109.5° |
| C14 | C15 | H24 | 108.7° | 109.5° |
| C14 | C15 | H25 | 108.7° | 109.5° |
| O19 | C18 | C17 | 120.5° | 120.0° |
| O19 | C18 | O20 | 119.9° | 120.0° |
| C17 | C16 | C15 | 111.9° | 109.4° |
| C16 | C17 | C18 | 113.1° | 109.4° |
| C17 | C16 | H26 | 108.9° | 109.5° |
| C17 | C16 | H27 | 108.9° | 109.5° |
| C16 | C17 | H28 | 108.6° | 109.4° |
| C16 | C17 | H29 | 108.5° | 109.5° |
| C16 | C15 | H24 | 108.7° | 109.5° |
| C16 | C15 | H25 | 108.7° | 109.4° |
| C15 | C16 | H26 | 108.9° | 109.5° |
| C15 | C16 | H27 | 108.9° | 109.5° |
| C17 | C18 | O20 | 119.6° | 119.9° |
| C18 | C17 | H28 | 108.5° | 109.5° |
| C18 | C17 | H29 | 108.6° | 109.5° |
| C18 | O20 | C21 | 113.2° | 117.0° |
| O20 | C21 | C22 | 107.2° | 109.5° |
| O20 | C21 | H30 | 110.0° | 109.5° |
| O20 | C21 | H31 | 110.0° | 109.4° |
| O35 | C22 | C21 | 108.7° | 109.5° |
| O35 | C22 | C23 | 109.2° | 109.5° |
| O35 | C22 | H32 | 111.0° | 109.5° |
| C22 | O35 | H49 | 109.5° | 114.0° |
| C21 | C22 | C23 | 110.0° | 109.5° |
| C22 | C21 | H30 | 110.1° | 109.5° |
| C22 | C21 | H31 | 110.0° | 109.4° |
| C21 | C22 | H32 | 109.0° | 109.4° |
| O26 | P25 | O27 | 109.1° | 109.5° |
| O26 | P25 | O24 | 109.8° | 109.4° |
| O26 | P25 | O28 | 110.4° | 109.5° |
| C22 | C23 | O24 | 107.8° | 109.5° |
| C23 | C22 | H32 | 108.9° | 109.5° |
| C22 | C23 | H33 | 109.8° | 109.5° |
| C22 | C23 | H34 | 109.9° | 109.5° |
| O27 | P25 | O24 | 109.2° | 109.5° |
| O27 | P25 | O28 | 109.3° | 109.5° |
| P25 | O27 | H48 | 109.5° | 114.0° |
| O24 | P25 | O28 | 109.0° | 109.5° |
| P25 | O24 | C23 | 118.3° | 123.1° |
| P25 | O28 | C29 | 117.6° | 123.0° |
| O24 | C23 | H33 | 109.9° | 109.4° |
| O24 | C23 | H34 | 109.9° | 109.4° |
| O28 | C29 | C30 | 109.0° | 109.5° |
| O28 | C29 | H35 | 109.6° | 109.5° |
| O28 | C29 | H36 | 109.6° | 109.4° |
| C29 | C30 | N31 | 110.9° | 109.4° |
| C30 | C29 | H35 | 109.6° | 109.5° |
| C30 | C29 | H36 | 109.6° | 109.5° |
| C29 | C30 | H37 | 109.1° | 109.5° |
| C29 | C30 | H38 | 109.1° | 109.5° |
| C30 | N31 | C32 | 109.6° | 109.5° |
| C30 | N31 | C33 | 110.0° | 109.4° |
| C30 | N31 | C34 | 109.6° | 109.5° |
| N31 | C30 | H37 | 109.1° | 109.5° |
| N31 | C30 | H38 | 109.1° | 109.5° |
| C32 | N31 | C33 | 109.4° | 109.5° |
| C32 | N31 | C34 | 109.2° | 109.5° |
| N31 | C32 | H39 | 109.5° | 109.4° |
| N31 | C32 | H40 | 109.5° | 109.4° |
| N31 | C32 | H41 | 109.5° | 109.5° |
| C33 | N31 | C34 | 109.1° | 109.5° |
| N31 | C33 | H42 | 109.5° | 109.5° |
| N31 | C33 | H43 | 109.5° | 109.5° |
| N31 | C33 | H44 | 109.4° | 109.4° |
| N31 | C34 | H45 | 109.5° | 109.5° |
| N31 | C34 | H46 | 109.5° | 109.4° |
| N31 | C34 | H47 | 109.4° | 109.5° |
| H1 | C01 | H2 | 109.5° | 109.5° |
| H1 | C01 | H3 | 109.5° | 109.5° |
| H2 | C01 | H3 | 109.5° | 109.4° |
| H4 | C02 | H5 | 109.5° | 109.5° |
| H8 | C05 | H9 | 109.4° | 109.5° |
| H12 | C08 | H13 | 109.5° | 109.5° |
| H16 | C11 | H17 | 109.4° | 109.5° |
| H18 | C12 | H19 | 109.5° | 109.4° |
| H20 | C13 | H21 | 109.5° | 109.4° |
| H22 | C14 | H23 | 109.5° | 109.4° |
| H24 | C15 | H25 | 109.4° | 109.5° |
| H26 | C16 | H27 | 109.4° | 109.5° |
| H28 | C17 | H29 | 109.5° | 109.5° |
| H30 | C21 | H31 | 109.5° | 109.4° |
| H33 | C23 | H34 | 109.5° | 109.4° |
| H35 | C29 | H36 | 109.5° | 109.5° |
| H37 | C30 | H38 | 109.5° | 109.5° |
| H39 | C32 | H40 | 109.5° | 109.5° |
| H39 | C32 | H41 | 109.5° | 109.4° |
| H40 | C32 | H41 | 109.5° | 109.5° |
| H42 | C33 | H43 | 109.4° | 109.5° |
| H42 | C33 | H44 | 109.5° | 109.5° |
| H43 | C33 | H44 | 109.5° | 109.4° |
| H45 | C34 | H46 | 109.5° | 109.5° |
| H45 | C34 | H47 | 109.5° | 109.5° |
| H46 | C34 | H47 | 109.5° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C01 | C02 | C03 | H4 | 119.9° | 120.1° |
| C01 | C02 | C03 | H5 | 119.9° | 120.0° |
| C01 | C02 | C03 | C04 | 168.3° | 128.1° |
| C02 | C01 | H1 | H2 | 120.0° | 120.1° |
| C02 | C01 | H1 | H3 | 120.0° | 120.0° |
| C02 | C01 | H2 | H3 | 120.0° | 120.0° |
| C01 | C02 | H4 | H5 | 120.3° | 120.0° |
| C01 | C02 | C03 | H6 | 11.7° | 51.8° |
| C02 | C03 | C04 | H6 | 180.0° | 179.9° |
| C02 | C03 | C04 | C05 | 0.2° | 6.9° |
| C03 | C02 | C01 | H1 | 180.0° | 59.9° |
| C03 | C02 | C01 | H2 | 60.0° | 180.0° |
| C03 | C02 | C01 | H3 | 60.0° | 60.1° |
| C03 | C02 | H4 | H5 | 120.2° | 119.9° |
| C02 | C03 | C04 | H7 | 179.8° | 173.1° |
| C03 | C04 | C05 | H7 | 180.0° | 180.0° |
| C03 | C04 | C05 | C06 | 119.1° | 126.4° |
| C04 | C03 | C02 | H4 | 71.8° | 8.0° |
| C04 | C03 | C02 | H5 | 48.4° | 111.9° |
| C03 | C04 | C05 | H8 | 121.1° | 113.6° |
| C03 | C04 | C05 | H9 | 0.8° | 6.4° |
| C04 | C05 | C06 | H8 | 119.9° | 120.0° |
| C04 | C05 | C06 | H9 | 119.8° | 120.0° |
| C04 | C05 | C06 | C07 | 101.0° | 128.1° |
| C05 | C04 | C03 | H6 | 179.8° | 173.2° |
| C04 | C05 | H8 | H9 | 120.4° | 120.0° |
| C04 | C05 | C06 | H10 | 79.0° | 51.9° |
| C05 | C06 | C07 | H10 | 180.0° | 179.9° |
| C05 | C06 | C07 | C08 | 0.1° | 6.8° |
| C06 | C05 | C04 | H7 | 60.9° | 53.5° |
| C06 | C05 | H8 | H9 | 120.5° | 120.0° |
| C05 | C06 | C07 | H11 | 180.0° | 173.1° |
| C06 | C07 | C08 | H11 | 180.0° | 179.9° |
| C06 | C07 | C08 | C09 | 88.4° | 126.5° |
| C07 | C06 | C05 | H8 | 18.8° | 8.1° |
| C07 | C06 | C05 | H9 | 139.1° | 111.9° |
| C06 | C07 | C08 | H12 | 151.5° | 113.5° |
| C06 | C07 | C08 | H13 | 31.7° | 6.5° |
| C07 | C08 | C09 | H12 | 120.1° | 120.0° |
| C07 | C08 | C09 | H13 | 120.1° | 120.0° |
| C07 | C08 | C09 | C10 | 86.4° | 127.0° |
| C08 | C07 | C06 | H10 | 179.9° | 173.2° |
| C07 | C08 | H12 | H13 | 119.7° | 120.0° |
| C07 | C08 | C09 | H14 | 93.6° | 53.1° |
| C08 | C09 | C10 | H14 | 180.0° | 179.9° |
| C08 | C09 | C10 | C11 | 0.2° | 7.7° |
| C09 | C08 | C07 | H11 | 91.6° | 53.6° |
| C09 | C08 | H12 | H13 | 119.7° | 120.0° |
| C08 | C09 | C10 | H15 | 179.8° | 172.2° |
| C09 | C10 | C11 | H15 | 180.0° | 180.0° |
| C09 | C10 | C11 | C12 | 166.7° | 127.0° |
| C10 | C09 | C08 | H12 | 33.6° | 7.0° |
| C10 | C09 | C08 | H13 | 153.4° | 113.0° |
| C09 | C10 | C11 | H16 | 73.4° | 113.1° |
| C09 | C10 | C11 | H17 | 46.7° | 7.0° |
| C10 | C11 | C12 | H16 | 120.0° | 120.0° |
| C10 | C11 | C12 | H17 | 120.0° | 120.0° |
| C10 | C11 | C12 | C13 | 113.2° | 180.0° |
| C11 | C10 | C09 | H14 | 179.8° | 172.2° |
| C10 | C11 | H16 | H17 | 120.1° | 120.0° |
| C10 | C11 | C12 | H18 | 126.5° | 60.0° |
| C10 | C11 | C12 | H19 | 7.1° | 60.0° |
| C11 | C12 | C13 | H18 | 120.3° | 120.0° |
| C11 | C12 | C13 | H19 | 120.3° | 120.0° |
| C11 | C12 | C13 | C14 | 172.6° | 180.0° |
| C12 | C11 | C10 | H15 | 13.4° | 53.1° |
| C12 | C11 | H16 | H17 | 120.2° | 120.0° |
| C11 | C12 | H18 | H19 | 118.9° | 120.0° |
| C11 | C12 | C13 | H20 | 66.9° | 60.0° |
| C11 | C12 | C13 | H21 | 52.2° | 60.0° |
| C12 | C13 | C14 | H20 | 120.4° | 120.0° |
| C12 | C13 | C14 | H21 | 120.4° | 120.0° |
| C12 | C13 | C14 | C15 | 136.8° | 180.0° |
| C13 | C12 | C11 | H16 | 6.8° | 60.0° |
| C13 | C12 | C11 | H17 | 126.8° | 60.0° |
| C13 | C12 | H18 | H19 | 118.9° | 119.9° |
| C12 | C13 | H20 | H21 | 118.6° | 119.9° |
| C12 | C13 | C14 | H22 | 102.8° | 60.0° |
| C12 | C13 | C14 | H23 | 16.3° | 60.0° |
| C13 | C14 | C15 | H22 | 120.4° | 120.0° |
| C13 | C14 | C15 | H23 | 120.5° | 120.0° |
| C13 | C14 | C15 | C16 | 38.6° | 180.0° |
| C14 | C13 | C12 | H18 | 52.3° | 59.9° |
| C14 | C13 | C12 | H19 | 67.0° | 60.0° |
| C14 | C13 | H20 | H21 | 118.6° | 120.0° |
| C13 | C14 | H22 | H23 | 118.7° | 119.9° |
| C13 | C14 | C15 | H24 | 81.9° | 60.0° |
| C13 | C14 | C15 | H25 | 159.1° | 60.1° |
| C14 | C15 | C16 | C17 | 85.6° | 180.0° |
| C14 | C15 | C16 | H24 | 120.5° | 120.0° |
| C14 | C15 | C16 | H25 | 120.5° | 120.0° |
| C15 | C14 | C13 | H20 | 16.3° | 60.0° |
| C15 | C14 | C13 | H21 | 102.8° | 60.0° |
| C15 | C14 | H22 | H23 | 118.6° | 120.1° |
| C14 | C15 | H24 | H25 | 118.5° | 120.1° |
| C14 | C15 | C16 | H26 | 154.0° | 60.0° |
| C14 | C15 | C16 | H27 | 34.8° | 60.1° |
| O19 | C18 | C17 | C16 | 93.9° | 0.0° |
| O19 | C18 | C17 | O20 | 179.5° | 180.0° |
| O19 | C18 | O20 | C21 | 29.5° | 0.0° |
| O19 | C18 | C17 | H28 | 145.6° | 120.0° |
| O19 | C18 | C17 | H29 | 26.6° | 120.0° |
| C17 | C16 | C15 | H26 | 120.4° | 120.0° |
| C17 | C16 | C15 | H27 | 120.4° | 120.0° |
| C16 | C17 | C18 | H28 | 120.6° | 119.9° |
| C16 | C17 | C18 | H29 | 120.5° | 120.0° |
| C16 | C17 | C18 | O20 | 86.6° | 180.0° |
| C17 | C16 | C15 | H24 | 153.9° | 60.0° |
| C17 | C16 | C15 | H25 | 34.9° | 60.0° |
| C17 | C16 | H26 | H27 | 118.9° | 120.0° |
| C16 | C17 | H28 | H29 | 118.3° | 120.0° |
| C15 | C16 | C17 | C18 | 149.1° | 180.0° |
| C16 | C15 | C14 | H22 | 159.1° | 60.0° |
| C16 | C15 | C14 | H23 | 81.8° | 60.0° |
| C16 | C15 | H24 | H25 | 118.6° | 120.0° |
| C15 | C16 | H26 | H27 | 118.8° | 120.0° |
| C15 | C16 | C17 | H28 | 28.5° | 60.0° |
| C15 | C16 | C17 | H29 | 90.4° | 60.0° |
| C17 | C18 | O20 | C21 | 150.1° | 180.0° |
| C18 | C17 | C16 | H26 | 28.7° | 60.0° |
| C18 | C17 | C16 | H27 | 90.6° | 60.0° |
| C18 | C17 | H28 | H29 | 118.3° | 120.1° |
| C18 | O20 | C21 | C22 | 108.5° | 180.0° |
| O20 | C18 | C17 | H28 | 34.0° | 60.1° |
| O20 | C18 | C17 | H29 | 152.9° | 60.0° |
| C18 | O20 | C21 | H30 | 11.2° | 59.9° |
| C18 | O20 | C21 | H31 | 131.9° | 60.0° |
| O20 | C21 | C22 | O35 | 81.2° | 64.9° |
| O20 | C21 | C22 | H30 | 119.7° | 120.1° |
| O20 | C21 | C22 | H31 | 119.6° | 119.9° |
| O20 | C21 | C22 | C23 | 159.2° | 175.0° |
| O20 | C21 | H30 | H31 | 121.0° | 120.0° |
| O20 | C21 | C22 | H32 | 39.9° | 55.1° |
| O35 | C22 | C21 | C23 | 119.6° | 120.1° |
| O35 | C22 | C21 | H32 | 121.1° | 120.0° |
| O35 | C22 | C23 | H32 | 121.4° | 120.1° |
| O35 | C22 | C23 | O24 | 28.5° | 65.0° |
| O35 | C22 | C21 | H30 | 38.4° | 175.0° |
| O35 | C22 | C21 | H31 | 159.1° | 55.0° |
| O35 | C22 | C23 | H33 | 91.3° | 55.0° |
| O35 | C22 | C23 | H34 | 148.2° | 175.0° |
| C21 | C22 | C23 | H32 | 119.4° | 119.9° |
| C21 | C22 | C23 | O24 | 147.8° | 175.0° |
| C22 | C21 | H30 | H31 | 121.0° | 120.0° |
| C21 | C22 | C23 | H33 | 28.0° | 65.0° |
| C21 | C22 | C23 | H34 | 92.5° | 55.0° |
| C21 | C22 | O35 | H49 | 180.0° | 60.1° |
| O26 | P25 | O27 | O24 | 120.0° | 120.0° |
| O26 | P25 | O27 | O28 | 120.8° | 120.0° |
| O26 | P25 | O24 | O28 | 121.0° | 120.0° |
| O26 | P25 | O24 | C23 | 123.4° | 55.0° |
| O26 | P25 | O28 | C29 | 176.5° | 55.1° |
| O26 | P25 | O27 | H48 | 0.0° | 179.9° |
| C22 | C23 | O24 | P25 | 142.1° | 180.0° |
| C22 | C23 | O24 | H33 | 119.7° | 120.1° |
| C22 | C23 | O24 | H34 | 119.7° | 120.1° |
| C23 | C22 | C21 | H30 | 81.1° | 54.9° |
| C23 | C22 | C21 | H31 | 39.6° | 65.0° |
| C22 | C23 | H33 | H34 | 120.8° | 120.1° |
| C23 | C22 | O35 | H49 | 59.9° | 59.9° |
| O27 | P25 | O24 | O28 | 119.3° | 120.0° |
| O27 | P25 | O24 | C23 | 3.8° | 65.0° |
| O27 | P25 | O28 | C29 | 56.5° | 65.0° |
| O24 | P25 | O28 | C29 | 62.8° | 175.0° |
| P25 | O24 | C23 | H33 | 22.4° | 59.9° |
| P25 | O24 | C23 | H34 | 98.1° | 59.9° |
| O24 | P25 | O27 | H48 | 120.0° | 60.0° |
| O28 | P25 | O24 | C23 | 115.5° | 175.0° |
| P25 | O28 | C29 | C30 | 159.5° | 180.0° |
| P25 | O28 | C29 | H35 | 39.5° | 59.9° |
| P25 | O28 | C29 | H36 | 80.6° | 60.0° |
| O28 | P25 | O27 | H48 | 120.8° | 60.1° |
| O24 | C23 | C22 | H32 | 92.9° | 55.0° |
| O24 | C23 | H33 | H34 | 120.8° | 119.9° |
| O28 | C29 | C30 | H35 | 119.9° | 120.0° |
| O28 | C29 | C30 | H36 | 119.9° | 120.0° |
| O28 | C29 | C30 | N31 | 175.3° | 68.3° |
| O28 | C29 | H35 | H36 | 120.2° | 119.9° |
| O28 | C29 | C30 | H37 | 64.5° | 171.7° |
| O28 | C29 | C30 | H38 | 55.0° | 51.7° |
| C29 | C30 | N31 | H37 | 120.2° | 120.0° |
| C29 | C30 | N31 | H38 | 120.2° | 120.0° |
| C29 | C30 | N31 | C32 | 58.6° | 63.9° |
| C29 | C30 | N31 | C33 | 61.7° | 176.1° |
| C29 | C30 | N31 | C34 | 178.3° | 56.1° |
| C30 | C29 | H35 | H36 | 120.2° | 120.0° |
| C29 | C30 | H37 | H38 | 119.3° | 120.0° |
| C30 | N31 | C32 | C33 | 120.7° | 120.0° |
| C30 | N31 | C32 | C34 | 120.0° | 120.0° |
| C30 | N31 | C33 | C34 | 120.2° | 120.0° |
| N31 | C30 | C29 | H35 | 55.3° | 171.7° |
| N31 | C30 | C29 | H36 | 64.8° | 51.6° |
| N31 | C30 | H37 | H38 | 119.4° | 120.0° |
| C30 | N31 | C32 | H39 | 180.0° | 59.9° |
| C30 | N31 | C32 | H40 | 60.0° | 180.0° |
| C30 | N31 | C32 | H41 | 60.0° | 60.0° |
| C30 | N31 | C33 | H42 | 180.0° | 60.0° |
| C30 | N31 | C33 | H43 | 60.0° | 180.0° |
| C30 | N31 | C33 | H44 | 60.0° | 60.0° |
| C30 | N31 | C34 | H45 | 180.0° | 71.1° |
| C30 | N31 | C34 | H46 | 60.0° | 168.8° |
| C30 | N31 | C34 | H47 | 60.0° | 48.9° |
| C32 | N31 | C33 | C34 | 119.4° | 120.0° |
| C32 | N31 | C30 | H37 | 178.8° | 56.1° |
| C32 | N31 | C30 | H38 | 61.6° | 176.1° |
| N31 | C32 | H39 | H40 | 120.0° | 120.0° |
| N31 | C32 | H39 | H41 | 120.0° | 120.0° |
| N31 | C32 | H40 | H41 | 120.0° | 120.0° |
| C32 | N31 | C33 | H42 | 59.6° | 180.0° |
| C32 | N31 | C33 | H43 | 60.4° | 60.0° |
| C32 | N31 | C33 | H44 | 179.6° | 59.9° |
| C32 | N31 | C34 | H45 | 60.0° | 48.9° |
| C32 | N31 | C34 | H46 | 180.0° | 71.1° |
| C32 | N31 | C34 | H47 | 60.0° | 168.9° |
| C33 | N31 | C30 | H37 | 58.5° | 63.9° |
| C33 | N31 | C30 | H38 | 178.1° | 56.1° |
| C33 | N31 | C32 | H39 | 59.4° | 60.0° |
| C33 | N31 | C32 | H40 | 179.4° | 60.0° |
| C33 | N31 | C32 | H41 | 60.7° | 180.0° |
| N31 | C33 | H42 | H43 | 120.0° | 120.0° |
| N31 | C33 | H42 | H44 | 120.0° | 120.0° |
| N31 | C33 | H43 | H44 | 120.0° | 119.9° |
| C33 | N31 | C34 | H45 | 59.5° | 168.9° |
| C33 | N31 | C34 | H46 | 60.5° | 48.9° |
| C33 | N31 | C34 | H47 | 179.5° | 71.0° |
| C34 | N31 | C30 | H37 | 61.5° | 176.1° |
| C34 | N31 | C30 | H38 | 58.1° | 63.9° |
| C34 | N31 | C32 | H39 | 60.0° | 180.0° |
| C34 | N31 | C32 | H40 | 60.0° | 60.0° |
| C34 | N31 | C32 | H41 | 180.0° | 60.0° |
| C34 | N31 | C33 | H42 | 59.8° | 60.0° |
| C34 | N31 | C33 | H43 | 179.8° | 60.1° |
| C34 | N31 | C33 | H44 | 60.3° | 180.0° |
| N31 | C34 | H45 | H46 | 120.0° | 120.0° |
| N31 | C34 | H45 | H47 | 120.0° | 120.0° |
| N31 | C34 | H46 | H47 | 120.0° | 120.0° |
| H1 | C01 | H2 | H3 | 120.0° | 119.9° |
| H1 | C01 | C02 | H4 | 60.1° | 180.0° |
| H1 | C01 | C02 | H5 | 60.1° | 60.0° |
| H2 | C01 | C02 | H4 | 60.0° | 59.9° |
| H2 | C01 | C02 | H5 | 179.9° | 60.1° |
| H3 | C01 | C02 | H4 | 179.9° | 60.0° |
| H3 | C01 | C02 | H5 | 59.9° | 180.0° |
| H4 | C02 | C03 | H6 | 108.2° | 171.9° |
| H5 | C02 | C03 | H6 | 131.6° | 68.1° |
| H6 | C03 | C04 | H7 | 0.2° | 6.8° |
| H7 | C04 | C05 | H8 | 59.0° | 66.5° |
| H7 | C04 | C05 | H9 | 179.2° | 173.6° |
| H8 | C05 | C06 | H10 | 161.2° | 171.9° |
| H9 | C05 | C06 | H10 | 40.9° | 68.1° |
| H10 | C06 | C07 | H11 | 0.0° | 6.9° |
| H11 | C07 | C08 | H12 | 28.5° | 66.4° |
| H11 | C07 | C08 | H13 | 148.3° | 173.6° |
| H12 | C08 | C09 | H14 | 146.3° | 173.1° |
| H13 | C08 | C09 | H14 | 26.5° | 66.9° |
| H14 | C09 | C10 | H15 | 0.1° | 7.8° |
| H15 | C10 | C11 | H16 | 106.6° | 66.9° |
| H15 | C10 | C11 | H17 | 133.3° | 173.1° |
| H16 | C11 | C12 | H18 | 113.6° | 180.0° |
| H16 | C11 | C12 | H19 | 127.1° | 60.0° |
| H17 | C11 | C12 | H18 | 6.5° | 60.0° |
| H17 | C11 | C12 | H19 | 112.8° | 180.0° |
| H18 | C12 | C13 | H20 | 172.7° | 180.0° |
| H18 | C12 | C13 | H21 | 68.1° | 60.1° |
| H19 | C12 | C13 | H20 | 53.4° | 60.1° |
| H19 | C12 | C13 | H21 | 172.6° | 180.0° |
| H20 | C13 | C14 | H22 | 136.7° | 180.0° |
| H20 | C13 | C14 | H23 | 104.1° | 60.1° |
| H21 | C13 | C14 | H22 | 17.6° | 60.0° |
| H21 | C13 | C14 | H23 | 136.8° | 180.0° |
| H22 | C14 | C15 | H24 | 38.6° | 180.0° |
| H22 | C14 | C15 | H25 | 80.4° | 59.9° |
| H23 | C14 | C15 | H24 | 157.7° | 60.0° |
| H23 | C14 | C15 | H25 | 38.7° | 180.0° |
| H24 | C15 | C16 | H26 | 33.5° | 180.0° |
| H24 | C15 | C16 | H27 | 85.7° | 60.0° |
| H25 | C15 | C16 | H26 | 85.5° | 60.0° |
| H25 | C15 | C16 | H27 | 155.2° | 180.0° |
| H26 | C16 | C17 | H28 | 91.9° | 180.0° |
| H26 | C16 | C17 | H29 | 149.2° | 60.0° |
| H27 | C16 | C17 | H28 | 148.9° | 60.0° |
| H27 | C16 | C17 | H29 | 30.0° | 180.0° |
| H30 | C21 | C22 | H32 | 159.5° | 65.0° |
| H31 | C21 | C22 | H32 | 79.8° | 175.0° |
| H32 | C22 | C23 | H33 | 147.4° | 175.1° |
| H32 | C22 | C23 | H34 | 26.9° | 65.0° |
| H32 | C22 | O35 | H49 | 60.2° | 180.0° |
| H35 | C29 | C30 | H37 | 175.5° | 51.7° |
| H35 | C29 | C30 | H38 | 64.9° | 68.3° |
| H36 | C29 | C30 | H37 | 55.4° | 68.4° |
| H36 | C29 | C30 | H38 | 174.9° | 171.6° |
| H39 | C32 | H40 | H41 | 120.0° | 120.0° |
| H42 | C33 | H43 | H44 | 120.0° | 120.0° |
| H45 | C34 | H46 | H47 | 120.0° | 120.0° |
