L9J
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C46 | C31 | sing | 1.53Å | 1.51Å | |
| C46 | C30 | sing | 1.53Å | 1.50Å | |
| C32 | C31 | sing | 1.53Å | 1.51Å | |
| C32 | C45 | sing | 1.53Å | 1.53Å | |
| C31 | C30 | sing | 1.53Å | 1.51Å | |
| C44 | C45 | sing | 1.53Å | 1.52Å | |
| C44 | C43 | sing | 1.53Å | 1.54Å | |
| C18 | C17 | sing | 1.53Å | 1.50Å | |
| C18 | C09 | sing | 1.53Å | 1.51Å | |
| C30 | O29 | sing | 1.45Å | 1.44Å | |
| C42 | C43 | sing | 1.53Å | 1.53Å | |
| C42 | C37 | sing | 1.51Å | 1.51Å | |
| O29 | C27 | sing | 1.35Å | 1.35Å | |
| F48 | C47 | sing | 1.40Å | 1.36Å | |
| C17 | C09 | sing | 1.53Å | 1.53Å | |
| C17 | C47 | sing | 1.53Å | 1.49Å | |
| N36 | C37 | doub | 1.31Å | 1.36Å | Aromatic |
| N36 | C35 | sing | 1.34Å | 1.35Å | Aromatic |
| C09 | N08 | sing | 1.47Å | 1.43Å | |
| C09 | C10 | sing | 1.51Å | 1.48Å | |
| C47 | F52 | sing | 1.40Å | 1.37Å | |
| C37 | C22 | sing | 1.40Å | 1.38Å | Aromatic |
| N08 | C06 | sing | 1.35Å | 1.37Å | |
| O16 | C10 | doub | 1.21Å | 1.23Å | |
| C27 | N26 | sing | 1.36Å | 1.36Å | |
| C27 | O28 | doub | 1.22Å | 1.23Å | |
| C41 | C35 | doub | 1.41Å | 1.40Å | Aromatic |
| C41 | C40 | sing | 1.36Å | 1.40Å | Aromatic |
| O24 | C23 | doub | 1.21Å | 1.24Å | |
| C10 | N11 | sing | 1.35Å | 1.38Å | |
| C35 | C34 | sing | 1.42Å | 1.41Å | Aromatic |
| N26 | C25 | sing | 1.48Å | 1.45Å | |
| O15 | S12 | doub | 1.42Å | 1.46Å | |
| C22 | O21 | sing | 1.35Å | 1.38Å | |
| C22 | N33 | doub | 1.32Å | 1.35Å | Aromatic |
| C23 | N03 | sing | 1.34Å | 1.37Å | |
| C23 | C25 | sing | 1.51Å | 1.55Å | |
| C04 | C06 | sing | 1.51Å | 1.54Å | |
| C04 | N03 | sing | 1.46Å | 1.49Å | |
| C04 | C05 | sing | 1.54Å | 1.53Å | |
| C40 | C39 | doub | 1.40Å | 1.39Å | Aromatic |
| O21 | C01 | sing | 1.43Å | 1.44Å | |
| C06 | O07 | doub | 1.21Å | 1.23Å | |
| N11 | S12 | sing | 1.66Å | 1.67Å | |
| N03 | C02 | sing | 1.47Å | 1.46Å | |
| C25 | C49 | sing | 1.53Å | 1.56Å | |
| C34 | N33 | sing | 1.34Å | 1.36Å | Aromatic |
| C34 | C38 | doub | 1.41Å | 1.39Å | Aromatic |
| S12 | O14 | doub | 1.42Å | 1.47Å | |
| S12 | C13 | sing | 1.81Å | 1.82Å | |
| C50 | C49 | sing | 1.53Å | 1.54Å | |
| C05 | C01 | sing | 1.55Å | 1.53Å | |
| C05 | C57 | sing | 1.53Å | 1.53Å | |
| C39 | C38 | sing | 1.38Å | 1.41Å | Aromatic |
| C39 | O54 | sing | 1.36Å | 1.36Å | |
| C01 | C02 | sing | 1.55Å | 1.54Å | |
| C20 | C13 | sing | 1.53Å | 1.50Å | |
| C20 | C19 | sing | 1.53Å | 1.50Å | |
| C49 | C53 | sing | 1.53Å | 1.54Å | |
| C49 | C51 | sing | 1.53Å | 1.55Å | |
| C13 | C19 | sing | 1.53Å | 1.49Å | |
| C13 | C56 | sing | 1.53Å | 1.54Å | |
| O54 | C55 | sing | 1.43Å | 1.42Å | |
| C57 | C58 | sing | 1.53Å | 1.54Å | |
| C01 | H1 | sing | 1.08Å | 1.10Å | |
| C02 | H2 | sing | 1.09Å | 1.10Å | |
| C02 | H3 | sing | 1.09Å | 1.10Å | |
| C04 | H4 | sing | 1.09Å | 1.10Å | |
| C05 | H5 | sing | 1.09Å | 1.10Å | |
| C17 | H6 | sing | 1.09Å | 1.10Å | |
| C18 | H7 | sing | 1.09Å | 1.10Å | |
| C18 | H8 | sing | 1.09Å | 1.10Å | |
| C19 | H9 | sing | 1.09Å | 1.10Å | |
| C19 | H10 | sing | 1.09Å | 1.10Å | |
| C20 | H11 | sing | 1.09Å | 1.10Å | |
| C20 | H12 | sing | 1.09Å | 1.10Å | |
| C25 | H13 | sing | 1.09Å | 1.10Å | |
| C30 | H14 | sing | 1.09Å | 1.10Å | |
| C31 | H15 | sing | 1.09Å | 1.10Å | |
| C32 | H16 | sing | 1.09Å | 1.10Å | |
| C32 | H17 | sing | 1.09Å | 1.10Å | |
| C38 | H18 | sing | 1.08Å | 1.08Å | |
| C40 | H19 | sing | 1.08Å | 1.08Å | |
| C41 | H20 | sing | 1.08Å | 1.08Å | |
| C42 | H21 | sing | 1.09Å | 1.10Å | |
| C42 | H22 | sing | 1.09Å | 1.10Å | |
| C43 | H23 | sing | 1.09Å | 1.10Å | |
| C43 | H24 | sing | 1.09Å | 1.10Å | |
| C44 | H25 | sing | 1.09Å | 1.10Å | |
| C44 | H26 | sing | 1.09Å | 1.10Å | |
| C45 | H27 | sing | 1.09Å | 1.10Å | |
| C45 | H28 | sing | 1.09Å | 1.10Å | |
| C46 | H29 | sing | 1.09Å | 1.10Å | |
| C46 | H30 | sing | 1.09Å | 1.10Å | |
| C47 | H31 | sing | 1.09Å | 1.10Å | |
| C50 | H32 | sing | 1.09Å | 1.10Å | |
| C50 | H33 | sing | 1.09Å | 1.10Å | |
| C50 | H34 | sing | 1.09Å | 1.10Å | |
| C51 | H35 | sing | 1.09Å | 1.10Å | |
| C51 | H36 | sing | 1.09Å | 1.10Å | |
| C51 | H37 | sing | 1.09Å | 1.10Å | |
| C53 | H38 | sing | 1.09Å | 1.10Å | |
| C53 | H39 | sing | 1.09Å | 1.10Å | |
| C53 | H40 | sing | 1.09Å | 1.10Å | |
| C55 | H41 | sing | 1.09Å | 1.10Å | |
| C55 | H42 | sing | 1.09Å | 1.10Å | |
| C55 | H43 | sing | 1.09Å | 1.10Å | |
| C56 | H44 | sing | 1.09Å | 1.10Å | |
| C56 | H45 | sing | 1.09Å | 1.10Å | |
| C56 | H46 | sing | 1.09Å | 1.10Å | |
| C57 | H47 | sing | 1.09Å | 1.10Å | |
| C57 | H48 | sing | 1.09Å | 1.10Å | |
| C58 | H49 | sing | 1.09Å | 1.10Å | |
| C58 | H50 | sing | 1.09Å | 1.10Å | |
| C58 | H51 | sing | 1.09Å | 1.10Å | |
| N08 | H52 | sing | 0.97Å | 1.00Å | |
| N11 | H53 | sing | 0.97Å | 1.00Å | |
| N26 | H54 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C31 | C46 | C30 | 60.2° | 60.0° |
| C46 | C31 | C32 | 120.5° | 117.7° |
| C46 | C31 | C30 | 59.7° | 60.0° |
| C46 | C31 | H15 | 115.4° | 118.4° |
| C31 | C46 | H29 | 120.0° | 117.6° |
| C31 | C46 | H30 | 120.0° | 117.5° |
| C46 | C30 | C31 | 60.0° | 60.0° |
| C46 | C30 | O29 | 112.6° | 117.5° |
| C46 | C30 | H14 | 118.1° | 117.8° |
| C30 | C46 | H29 | 120.0° | 117.5° |
| C30 | C46 | H30 | 120.0° | 117.5° |
| C31 | C32 | C45 | 109.9° | 108.9° |
| C32 | C31 | C30 | 119.0° | 117.3° |
| C32 | C31 | H15 | 115.4° | 115.3° |
| C31 | C32 | H16 | 109.4° | 109.6° |
| C31 | C32 | H17 | 109.4° | 109.6° |
| C32 | C45 | C44 | 111.4° | 110.0° |
| C45 | C32 | H16 | 109.4° | 109.5° |
| C45 | C32 | H17 | 109.3° | 109.6° |
| C32 | C45 | H27 | 109.0° | 109.4° |
| C32 | C45 | H28 | 109.0° | 109.4° |
| C31 | C30 | O29 | 114.9° | 117.8° |
| C31 | C30 | H14 | 117.9° | 117.3° |
| C30 | C31 | H15 | 115.4° | 116.9° |
| C45 | C44 | C43 | 111.8° | 109.7° |
| C45 | C44 | H25 | 108.9° | 109.4° |
| C45 | C44 | H26 | 108.9° | 109.5° |
| C44 | C45 | H27 | 109.0° | 109.4° |
| C44 | C45 | H28 | 109.0° | 109.4° |
| C44 | C43 | C42 | 110.9° | 109.6° |
| C44 | C43 | H23 | 109.1° | 109.4° |
| C44 | C43 | H24 | 109.1° | 109.4° |
| C43 | C44 | H25 | 108.9° | 109.5° |
| C43 | C44 | H26 | 108.9° | 109.5° |
| C17 | C18 | C09 | 61.0° | 60.0° |
| C18 | C17 | C09 | 59.8° | 60.0° |
| C18 | C17 | C47 | 121.0° | 117.5° |
| C18 | C17 | H6 | 113.0° | 117.5° |
| C17 | C18 | H7 | 119.8° | 117.5° |
| C17 | C18 | H8 | 119.8° | 117.5° |
| C18 | C09 | C17 | 59.1° | 60.0° |
| C18 | C09 | N08 | 112.6° | 117.5° |
| C18 | C09 | C10 | 115.6° | 117.5° |
| C09 | C18 | H7 | 119.8° | 117.5° |
| C09 | C18 | H8 | 119.8° | 117.5° |
| C30 | O29 | C27 | 115.7° | 117.5° |
| O29 | C30 | H14 | 119.5° | 115.3° |
| C43 | C42 | C37 | 111.9° | 109.9° |
| C43 | C42 | H21 | 108.9° | 109.4° |
| C43 | C42 | H22 | 108.9° | 109.4° |
| C42 | C43 | H23 | 109.1° | 109.5° |
| C42 | C43 | H24 | 109.1° | 109.5° |
| C42 | C37 | N36 | 116.3° | 119.7° |
| C42 | C37 | C22 | 122.3° | 119.6° |
| C37 | C42 | H21 | 108.9° | 109.4° |
| C37 | C42 | H22 | 108.8° | 109.4° |
| O29 | C27 | N26 | 109.5° | 119.2° |
| O29 | C27 | O28 | 124.7° | 120.4° |
| F48 | C47 | C17 | 107.3° | 109.5° |
| F48 | C47 | F52 | 107.6° | 109.5° |
| F48 | C47 | H31 | 111.8° | 109.5° |
| C09 | C17 | C47 | 126.9° | 117.5° |
| C17 | C09 | N08 | 111.6° | 117.5° |
| C17 | C09 | C10 | 115.2° | 117.5° |
| C09 | C17 | H6 | 112.6° | 117.5° |
| C17 | C47 | F52 | 108.6° | 109.4° |
| C47 | C17 | H6 | 113.2° | 115.5° |
| C17 | C47 | H31 | 109.8° | 109.5° |
| C37 | N36 | C35 | 117.2° | 120.0° |
| N36 | C37 | C22 | 121.4° | 120.7° |
| N36 | C35 | C41 | 118.5° | 121.0° |
| N36 | C35 | C34 | 121.0° | 119.4° |
| N08 | C09 | C10 | 124.7° | 115.5° |
| C09 | N08 | C06 | 124.8° | 120.0° |
| C09 | N08 | H52 | 117.6° | 120.0° |
| C09 | C10 | O16 | 121.0° | 120.0° |
| C09 | C10 | N11 | 115.4° | 120.0° |
| F52 | C47 | H31 | 111.6° | 109.4° |
| C37 | C22 | O21 | 116.7° | 119.3° |
| C37 | C22 | N33 | 123.0° | 120.4° |
| N08 | C06 | C04 | 113.4° | 120.0° |
| N08 | C06 | O07 | 122.5° | 120.0° |
| C06 | N08 | H52 | 117.6° | 120.0° |
| O16 | C10 | N11 | 123.7° | 120.0° |
| N26 | C27 | O28 | 125.8° | 120.4° |
| C27 | N26 | C25 | 117.7° | 116.3° |
| C27 | N26 | H54 | 121.1° | 121.8° |
| C35 | C41 | C40 | 119.5° | 119.7° |
| C41 | C35 | C34 | 120.6° | 119.6° |
| C35 | C41 | H20 | 120.2° | 120.1° |
| C41 | C40 | C39 | 120.0° | 121.1° |
| C41 | C40 | H19 | 120.0° | 119.4° |
| C40 | C41 | H20 | 120.3° | 120.2° |
| O24 | C23 | N03 | 122.5° | 119.7° |
| O24 | C23 | C25 | 119.9° | 119.7° |
| C10 | N11 | S12 | 112.2° | 120.0° |
| C10 | N11 | H53 | 123.9° | 120.0° |
| C35 | C34 | N33 | 121.7° | 119.7° |
| C35 | C34 | C38 | 119.7° | 119.4° |
| N26 | C25 | C23 | 107.2° | 108.6° |
| N26 | C25 | C49 | 112.9° | 109.6° |
| N26 | C25 | H13 | 109.4° | 109.7° |
| C25 | N26 | H54 | 121.2° | 121.9° |
| O15 | S12 | N11 | 113.0° | 104.3° |
| O15 | S12 | O14 | 114.7° | 121.0° |
| O15 | S12 | C13 | 107.8° | 110.5° |
| O21 | C22 | N33 | 120.2° | 120.3° |
| C22 | O21 | C01 | 118.7° | 118.8° |
| C22 | N33 | C34 | 115.8° | 119.7° |
| N03 | C23 | C25 | 117.6° | 120.6° |
| C23 | N03 | C04 | 123.2° | 126.4° |
| C23 | N03 | C02 | 126.9° | 125.0° |
| C23 | C25 | C49 | 111.1° | 109.7° |
| C23 | C25 | H13 | 108.1° | 109.6° |
| C06 | C04 | N03 | 105.9° | 109.7° |
| C06 | C04 | C05 | 117.3° | 109.7° |
| C04 | C06 | O07 | 124.0° | 120.0° |
| C06 | C04 | H4 | 109.5° | 109.6° |
| N03 | C04 | C05 | 103.9° | 108.9° |
| C04 | N03 | C02 | 109.9° | 108.6° |
| N03 | C04 | H4 | 110.3° | 109.6° |
| C04 | C05 | C01 | 101.3° | 105.4° |
| C04 | C05 | C57 | 112.3° | 110.2° |
| C05 | C04 | H4 | 109.6° | 109.4° |
| C04 | C05 | H5 | 110.8° | 110.2° |
| C40 | C39 | C38 | 121.0° | 120.7° |
| C40 | C39 | O54 | 114.6° | 119.7° |
| C39 | C40 | H19 | 120.0° | 119.5° |
| O21 | C01 | C05 | 108.1° | 109.8° |
| O21 | C01 | C02 | 109.2° | 109.1° |
| O21 | C01 | H1 | 113.7° | 111.9° |
| N11 | S12 | O14 | 109.8° | 104.2° |
| N11 | S12 | C13 | 105.0° | 104.4° |
| S12 | N11 | H53 | 123.9° | 120.0° |
| N03 | C02 | C01 | 103.0° | 106.6° |
| N03 | C02 | H2 | 111.0° | 110.1° |
| N03 | C02 | H3 | 111.1° | 110.0° |
| C25 | C49 | C50 | 112.6° | 109.5° |
| C25 | C49 | C53 | 111.7° | 109.4° |
| C25 | C49 | C51 | 109.1° | 109.5° |
| C49 | C25 | H13 | 108.0° | 109.7° |
| N33 | C34 | C38 | 118.7° | 120.9° |
| C34 | C38 | C39 | 119.3° | 119.5° |
| C34 | C38 | H18 | 120.3° | 120.3° |
| O14 | S12 | C13 | 105.8° | 110.5° |
| S12 | C13 | C20 | 114.3° | 117.5° |
| S12 | C13 | C19 | 109.8° | 117.5° |
| S12 | C13 | C56 | 102.3° | 115.6° |
| C50 | C49 | C53 | 107.5° | 109.5° |
| C50 | C49 | C51 | 107.1° | 109.5° |
| C49 | C50 | H32 | 109.5° | 109.5° |
| C49 | C50 | H33 | 109.5° | 109.5° |
| C49 | C50 | H34 | 109.5° | 109.5° |
| C01 | C05 | C57 | 110.5° | 110.3° |
| C05 | C01 | C02 | 100.6° | 104.8° |
| C05 | C01 | H1 | 112.3° | 110.6° |
| C01 | C05 | H5 | 110.8° | 110.2° |
| C05 | C57 | C58 | 109.6° | 109.4° |
| C57 | C05 | H5 | 110.8° | 110.4° |
| C05 | C57 | H47 | 109.5° | 109.5° |
| C05 | C57 | H48 | 109.5° | 109.5° |
| C38 | C39 | O54 | 124.4° | 119.6° |
| C39 | C38 | H18 | 120.4° | 120.3° |
| C39 | O54 | C55 | 117.7° | 117.0° |
| C02 | C01 | H1 | 112.1° | 110.4° |
| C01 | C02 | H2 | 111.0° | 110.0° |
| C01 | C02 | H3 | 111.1° | 110.0° |
| C13 | C20 | C19 | 59.4° | 60.0° |
| C20 | C13 | C19 | 60.5° | 60.0° |
| C20 | C13 | C56 | 132.3° | 117.5° |
| C13 | C20 | H11 | 120.1° | 117.5° |
| C13 | C20 | H12 | 120.1° | 117.5° |
| C20 | C19 | C13 | 60.1° | 60.0° |
| C20 | C19 | H9 | 120.0° | 117.5° |
| C20 | C19 | H10 | 120.0° | 117.5° |
| C19 | C20 | H11 | 120.1° | 117.5° |
| C19 | C20 | H12 | 120.1° | 117.5° |
| C53 | C49 | C51 | 108.6° | 109.4° |
| C49 | C53 | H38 | 109.5° | 109.4° |
| C49 | C53 | H39 | 109.5° | 109.5° |
| C49 | C53 | H40 | 109.5° | 109.5° |
| C49 | C51 | H35 | 109.5° | 109.5° |
| C49 | C51 | H36 | 109.5° | 109.5° |
| C49 | C51 | H37 | 109.4° | 109.4° |
| C19 | C13 | C56 | 133.2° | 117.5° |
| C13 | C19 | H9 | 120.0° | 117.5° |
| C13 | C19 | H10 | 120.0° | 117.5° |
| C13 | C56 | H44 | 109.5° | 109.5° |
| C13 | C56 | H45 | 109.5° | 109.5° |
| C13 | C56 | H46 | 109.4° | 109.5° |
| O54 | C55 | H41 | 109.5° | 109.4° |
| O54 | C55 | H42 | 109.5° | 109.5° |
| O54 | C55 | H43 | 109.5° | 109.5° |
| C58 | C57 | H47 | 109.4° | 109.4° |
| C58 | C57 | H48 | 109.5° | 109.5° |
| C57 | C58 | H49 | 109.5° | 109.5° |
| C57 | C58 | H50 | 109.5° | 109.5° |
| C57 | C58 | H51 | 109.5° | 109.5° |
| H2 | C02 | H3 | 109.5° | 110.1° |
| H7 | C18 | H8 | 109.5° | 115.6° |
| H9 | C19 | H10 | 109.4° | 115.6° |
| H11 | C20 | H12 | 109.5° | 115.6° |
| H16 | C32 | H17 | 109.5° | 109.6° |
| H21 | C42 | H22 | 109.5° | 109.3° |
| H23 | C43 | H24 | 109.5° | 109.4° |
| H25 | C44 | H26 | 109.5° | 109.4° |
| H27 | C45 | H28 | 109.5° | 109.3° |
| H29 | C46 | H30 | 109.5° | 115.5° |
| H32 | C50 | H33 | 109.5° | 109.4° |
| H32 | C50 | H34 | 109.5° | 109.4° |
| H33 | C50 | H34 | 109.5° | 109.5° |
| H35 | C51 | H36 | 109.5° | 109.5° |
| H35 | C51 | H37 | 109.5° | 109.4° |
| H36 | C51 | H37 | 109.5° | 109.5° |
| H38 | C53 | H39 | 109.5° | 109.6° |
| H38 | C53 | H40 | 109.5° | 109.5° |
| H39 | C53 | H40 | 109.5° | 109.5° |
| H41 | C55 | H42 | 109.5° | 109.4° |
| H41 | C55 | H43 | 109.5° | 109.5° |
| H42 | C55 | H43 | 109.4° | 109.5° |
| H44 | C56 | H45 | 109.5° | 109.4° |
| H44 | C56 | H46 | 109.5° | 109.5° |
| H45 | C56 | H46 | 109.5° | 109.4° |
| H47 | C57 | H48 | 109.5° | 109.5° |
| H49 | C58 | H50 | 109.5° | 109.4° |
| H49 | C58 | H51 | 109.5° | 109.4° |
| H50 | C58 | H51 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C31 | C46 | C30 | H29 | 109.5° | 107.5° |
| C31 | C46 | C30 | H30 | 109.5° | 107.5° |
| C46 | C31 | C32 | C30 | 70.0° | 68.6° |
| C46 | C31 | C32 | H15 | 146.3° | 147.4° |
| C46 | C31 | C32 | C45 | 145.3° | 117.1° |
| C46 | C31 | C30 | H15 | 105.9° | 108.9° |
| C31 | C46 | C30 | O29 | 106.6° | 107.8° |
| C31 | C46 | C30 | H14 | 107.7° | 107.2° |
| C46 | C31 | C32 | H16 | 94.6° | 123.0° |
| C46 | C31 | C32 | H17 | 25.2° | 2.7° |
| C31 | C46 | H29 | H30 | 144.6° | 145.7° |
| C46 | C30 | O29 | H14 | 145.1° | 145.8° |
| C46 | C30 | O29 | C27 | 159.6° | 120.9° |
| C30 | C46 | H29 | H30 | 144.6° | 145.7° |
| C31 | C32 | C45 | H16 | 120.1° | 119.8° |
| C31 | C32 | C45 | H17 | 120.1° | 119.9° |
| C32 | C31 | C30 | H15 | 143.7° | 143.4° |
| C31 | C32 | C45 | C44 | 71.5° | 144.9° |
| C32 | C31 | C30 | O29 | 146.8° | 144.8° |
| C32 | C31 | C30 | H14 | 2.4° | 0.1° |
| C31 | C32 | H16 | H17 | 119.8° | 120.3° |
| C31 | C32 | C45 | H27 | 168.2° | 95.0° |
| C31 | C32 | C45 | H28 | 48.8° | 24.7° |
| C32 | C31 | C46 | H29 | 1.6° | 145.3° |
| C32 | C31 | C46 | H30 | 142.6° | 0.2° |
| C45 | C32 | C31 | C30 | 75.3° | 48.5° |
| C32 | C45 | C44 | H27 | 120.3° | 120.1° |
| C32 | C45 | C44 | H28 | 120.3° | 120.1° |
| C32 | C45 | C44 | C43 | 174.1° | 150.4° |
| C45 | C32 | C31 | H15 | 68.4° | 95.5° |
| C45 | C32 | H16 | H17 | 119.8° | 120.3° |
| C32 | C45 | C44 | H25 | 53.8° | 89.5° |
| C32 | C45 | C44 | H26 | 65.5° | 30.3° |
| C32 | C45 | H27 | H28 | 119.1° | 119.7° |
| C31 | C30 | O29 | H14 | 148.7° | 145.4° |
| C31 | C30 | O29 | C27 | 93.5° | 52.2° |
| C30 | C31 | C32 | H16 | 164.6° | 168.3° |
| C30 | C31 | C32 | H17 | 44.7° | 71.4° |
| C45 | C44 | C43 | H25 | 120.3° | 120.0° |
| C45 | C44 | C43 | H26 | 120.4° | 120.1° |
| C45 | C44 | C43 | C42 | 175.5° | 130.1° |
| C44 | C45 | C32 | H16 | 48.6° | 25.0° |
| C44 | C45 | C32 | H17 | 168.4° | 95.2° |
| C45 | C44 | C43 | H23 | 64.3° | 10.0° |
| C45 | C44 | C43 | H24 | 55.3° | 109.9° |
| C45 | C44 | H25 | H26 | 118.9° | 119.9° |
| C44 | C45 | H27 | H28 | 119.1° | 119.8° |
| C44 | C43 | C42 | H23 | 120.2° | 120.0° |
| C44 | C43 | C42 | H24 | 120.2° | 120.0° |
| C44 | C43 | C42 | C37 | 179.2° | 167.2° |
| C44 | C43 | C42 | H21 | 60.4° | 47.1° |
| C44 | C43 | C42 | H22 | 58.9° | 72.6° |
| C44 | C43 | H23 | H24 | 119.4° | 119.9° |
| C43 | C44 | H25 | H26 | 119.0° | 119.9° |
| C43 | C44 | C45 | H27 | 65.6° | 89.4° |
| C43 | C44 | C45 | H28 | 53.8° | 30.3° |
| C17 | C18 | C09 | H7 | 109.8° | 107.5° |
| C17 | C18 | C09 | H8 | 109.8° | 107.5° |
| C18 | C17 | C47 | F48 | 95.3° | 128.6° |
| C18 | C17 | C09 | C47 | 107.9° | 107.5° |
| C18 | C17 | C09 | H6 | 104.4° | 107.5° |
| C18 | C17 | C47 | H6 | 138.9° | 145.8° |
| C17 | C18 | C09 | N08 | 102.5° | 107.5° |
| C17 | C18 | C09 | C10 | 105.3° | 107.5° |
| C18 | C17 | C47 | F52 | 148.7° | 111.4° |
| C17 | C18 | H7 | H8 | 144.2° | 145.7° |
| C18 | C17 | C47 | H31 | 26.4° | 8.6° |
| C18 | C09 | N08 | C10 | 149.2° | 145.7° |
| C18 | C09 | N08 | C06 | 135.7° | 83.8° |
| C18 | C09 | C10 | O16 | 31.3° | 6.9° |
| C18 | C09 | C10 | N11 | 148.2° | 173.1° |
| C09 | C18 | H7 | H8 | 144.1° | 145.7° |
| C18 | C09 | N08 | H52 | 44.3° | 96.1° |
| C30 | O29 | C27 | N26 | 179.4° | 176.9° |
| C30 | O29 | C27 | O28 | 0.4° | 3.1° |
| O29 | C30 | C31 | H15 | 3.1° | 1.5° |
| O29 | C30 | C46 | H29 | 143.9° | 0.3° |
| O29 | C30 | C46 | H30 | 2.9° | 144.7° |
| C43 | C42 | C37 | H21 | 120.3° | 120.1° |
| C43 | C42 | C37 | H22 | 120.4° | 120.2° |
| C43 | C42 | C37 | N36 | 97.8° | 92.2° |
| C43 | C42 | C37 | C22 | 82.6° | 88.2° |
| C43 | C42 | H21 | H22 | 118.9° | 119.8° |
| C42 | C43 | H23 | H24 | 119.3° | 120.0° |
| C42 | C43 | C44 | H25 | 55.2° | 109.9° |
| C42 | C43 | C44 | H26 | 64.1° | 10.0° |
| C42 | C37 | N36 | C22 | 179.6° | 179.6° |
| C42 | C37 | N36 | C35 | 179.3° | 178.9° |
| C42 | C37 | C22 | O21 | 0.6° | 0.7° |
| C42 | C37 | C22 | N33 | 179.5° | 178.8° |
| C37 | C42 | H21 | H22 | 118.9° | 119.8° |
| C37 | C42 | C43 | H23 | 59.0° | 72.7° |
| C37 | C42 | C43 | H24 | 60.5° | 47.2° |
| O29 | C27 | N26 | O28 | 179.7° | 179.9° |
| O29 | C27 | N26 | C25 | 179.5° | 179.8° |
| C27 | O29 | C30 | H14 | 55.2° | 93.2° |
| O29 | C27 | N26 | H54 | 0.5° | 0.2° |
| F48 | C47 | C17 | C09 | 168.8° | 60.0° |
| F48 | C47 | C17 | F52 | 116.0° | 120.0° |
| F48 | C47 | C17 | H31 | 121.7° | 120.0° |
| F48 | C47 | F52 | H31 | 123.0° | 120.0° |
| F48 | C47 | C17 | H6 | 43.6° | 85.7° |
| C09 | C17 | C47 | H6 | 147.5° | 145.7° |
| C17 | C09 | N08 | C10 | 146.4° | 145.6° |
| C09 | C17 | C47 | F52 | 75.1° | 180.0° |
| C17 | C09 | N08 | C06 | 71.3° | 152.5° |
| C17 | C09 | C10 | O16 | 35.0° | 75.6° |
| C17 | C09 | C10 | N11 | 145.6° | 104.4° |
| C09 | C17 | C47 | H31 | 47.2° | 60.0° |
| C17 | C09 | N08 | H52 | 108.7° | 27.5° |
| C47 | C17 | C09 | N08 | 147.9° | 145.0° |
| C47 | C17 | C09 | C10 | 2.0° | 0.0° |
| C17 | C47 | F52 | H31 | 121.2° | 120.0° |
| C47 | C17 | C18 | H7 | 7.7° | 145.0° |
| C47 | C17 | C18 | H8 | 132.9° | 0.0° |
| C37 | N36 | C35 | C41 | 179.9° | 179.9° |
| C37 | N36 | C35 | C34 | 0.9° | 0.5° |
| N36 | C37 | C22 | O21 | 179.8° | 179.7° |
| N36 | C37 | C22 | N33 | 0.1° | 0.8° |
| N36 | C37 | C42 | H21 | 141.9° | 27.9° |
| N36 | C37 | C42 | H22 | 22.6° | 147.6° |
| C35 | N36 | C37 | C22 | 0.3° | 0.6° |
| N36 | C35 | C41 | C34 | 179.0° | 179.6° |
| N36 | C35 | C41 | C40 | 179.6° | 178.9° |
| N36 | C35 | C34 | N33 | 1.4° | 1.5° |
| N36 | C35 | C34 | C38 | 179.5° | 178.5° |
| N36 | C35 | C41 | H20 | 0.4° | 1.2° |
| C09 | N08 | C06 | H52 | 180.0° | 179.9° |
| N08 | C09 | C10 | O16 | 179.7° | 138.8° |
| N08 | C09 | C10 | N11 | 0.2° | 41.2° |
| C09 | N08 | C06 | C04 | 176.1° | 171.2° |
| C09 | N08 | C06 | O07 | 2.4° | 8.8° |
| N08 | C09 | C17 | H6 | 0.2° | 0.0° |
| N08 | C09 | C18 | H7 | 147.7° | 0.0° |
| N08 | C09 | C18 | H8 | 7.2° | 145.0° |
| C10 | C09 | N08 | C06 | 75.2° | 61.9° |
| C09 | C10 | O16 | N11 | 179.4° | 180.0° |
| C09 | C10 | N11 | S12 | 179.0° | 175.6° |
| C10 | C09 | C17 | H6 | 149.6° | 145.0° |
| C10 | C09 | C18 | H7 | 4.5° | 145.0° |
| C10 | C09 | C18 | H8 | 144.9° | 0.0° |
| C10 | C09 | N08 | H52 | 104.9° | 118.2° |
| C09 | C10 | N11 | H53 | 1.0° | 4.3° |
| F52 | C47 | C17 | H6 | 72.4° | 34.4° |
| C37 | C22 | O21 | N33 | 179.9° | 179.5° |
| C37 | C22 | O21 | C01 | 178.5° | 176.8° |
| C37 | C22 | N33 | C34 | 0.4° | 0.2° |
| C22 | C37 | C42 | H21 | 37.8° | 151.7° |
| C22 | C37 | C42 | H22 | 157.1° | 32.0° |
| N08 | C06 | C04 | O07 | 178.5° | 180.0° |
| N08 | C06 | C04 | N03 | 132.3° | 166.9° |
| N08 | C06 | C04 | C05 | 112.4° | 73.6° |
| N08 | C06 | C04 | H4 | 13.3° | 46.6° |
| O16 | C10 | N11 | S12 | 1.6° | 4.3° |
| O16 | C10 | N11 | H53 | 178.5° | 175.7° |
| C27 | N26 | C25 | H54 | 180.0° | 179.9° |
| C27 | N26 | C25 | C23 | 97.7° | 63.0° |
| C27 | N26 | C25 | C49 | 139.6° | 56.8° |
| C27 | N26 | C25 | H13 | 19.3° | 177.2° |
| O28 | C27 | N26 | C25 | 0.8° | 0.3° |
| O28 | C27 | N26 | H54 | 179.3° | 179.8° |
| C35 | C41 | C40 | H20 | 180.0° | 179.9° |
| C35 | C41 | C40 | C39 | 0.3° | 0.0° |
| C41 | C35 | C34 | N33 | 179.7° | 178.9° |
| C41 | C35 | C34 | C38 | 0.5° | 1.1° |
| C35 | C41 | C40 | H19 | 179.8° | 180.0° |
| C40 | C41 | C35 | C34 | 0.6° | 0.7° |
| C41 | C40 | C39 | H19 | 180.0° | 180.0° |
| C41 | C40 | C39 | C38 | 0.2° | 0.2° |
| C41 | C40 | C39 | O54 | 179.8° | 179.8° |
| O24 | C23 | C25 | N26 | 48.3° | 33.4° |
| O24 | C23 | N03 | C25 | 178.0° | 180.0° |
| O24 | C23 | N03 | C04 | 0.8° | 173.7° |
| O24 | C23 | N03 | C02 | 179.0° | 8.2° |
| O24 | C23 | C25 | C49 | 75.4° | 153.2° |
| O24 | C23 | C25 | H13 | 166.2° | 86.4° |
| C10 | N11 | S12 | O15 | 63.9° | 178.9° |
| C10 | N11 | S12 | H53 | 180.0° | 180.0° |
| C10 | N11 | S12 | O14 | 65.5° | 51.1° |
| C10 | N11 | S12 | C13 | 178.9° | 65.0° |
| C35 | C34 | N33 | C22 | 1.1° | 1.3° |
| C35 | C34 | N33 | C38 | 179.1° | 180.0° |
| C35 | C34 | C38 | C39 | 0.1° | 0.9° |
| C35 | C34 | C38 | H18 | 179.9° | 179.1° |
| C34 | C35 | C41 | H20 | 179.4° | 179.2° |
| N26 | C25 | C23 | N03 | 133.6° | 146.5° |
| N26 | C25 | C23 | C49 | 123.8° | 119.8° |
| N26 | C25 | C23 | H13 | 117.9° | 119.8° |
| N26 | C25 | C49 | H13 | 121.1° | 120.4° |
| N26 | C25 | C49 | C50 | 61.0° | 36.9° |
| N26 | C25 | C49 | C53 | 60.1° | 156.9° |
| N26 | C25 | C49 | C51 | 179.8° | 83.2° |
| O15 | S12 | N11 | O14 | 129.4° | 127.9° |
| O15 | S12 | N11 | C13 | 117.2° | 116.1° |
| O15 | S12 | O14 | C13 | 118.7° | 131.5° |
| O15 | S12 | C13 | C20 | 27.4° | 137.0° |
| O15 | S12 | C13 | C19 | 38.3° | 68.4° |
| O15 | S12 | C13 | C56 | 176.2° | 77.3° |
| O15 | S12 | N11 | H53 | 116.1° | 1.1° |
| O21 | C22 | N33 | C34 | 179.4° | 179.2° |
| C22 | O21 | C01 | C05 | 91.2° | 128.7° |
| C22 | O21 | C01 | C02 | 160.1° | 117.0° |
| C22 | O21 | C01 | H1 | 34.1° | 5.5° |
| N33 | C22 | O21 | C01 | 1.7° | 3.8° |
| C22 | N33 | C34 | C38 | 179.8° | 178.6° |
| C23 | N03 | C04 | C06 | 48.1° | 74.6° |
| C23 | N03 | C04 | C02 | 178.5° | 178.4° |
| C23 | N03 | C04 | C05 | 172.3° | 165.4° |
| N03 | C23 | C25 | C49 | 102.6° | 26.8° |
| C23 | N03 | C02 | C01 | 159.0° | 155.3° |
| C23 | N03 | C02 | H2 | 40.1° | 85.4° |
| C23 | N03 | C02 | H3 | 82.0° | 36.1° |
| C23 | N03 | C04 | H4 | 70.3° | 45.8° |
| N03 | C23 | C25 | H13 | 15.8° | 93.7° |
| C25 | C23 | N03 | C04 | 178.8° | 6.3° |
| C25 | C23 | N03 | C02 | 3.0° | 171.8° |
| C23 | C25 | C49 | H13 | 118.4° | 120.4° |
| C23 | C25 | C49 | C50 | 59.5° | 156.0° |
| C23 | C25 | C49 | C53 | 179.4° | 84.0° |
| C23 | C25 | C49 | C51 | 59.3° | 36.0° |
| C23 | C25 | N26 | H54 | 82.2° | 117.1° |
| C06 | C04 | N03 | C05 | 124.2° | 120.0° |
| C06 | C04 | N03 | H4 | 118.4° | 120.4° |
| C06 | C04 | C05 | H4 | 125.7° | 120.2° |
| C06 | C04 | N03 | C02 | 133.4° | 107.0° |
| C06 | C04 | C05 | C01 | 150.5° | 122.5° |
| C06 | C04 | C05 | C57 | 32.6° | 3.5° |
| C06 | C04 | C05 | H5 | 91.9° | 118.6° |
| C04 | C06 | N08 | H52 | 3.9° | 8.7° |
| N03 | C04 | C05 | H4 | 117.8° | 119.8° |
| N03 | C04 | C06 | O07 | 46.2° | 13.1° |
| N03 | C04 | C05 | C01 | 34.0° | 2.5° |
| N03 | C04 | C05 | C57 | 83.9° | 116.5° |
| C04 | N03 | C02 | C01 | 19.4° | 23.1° |
| C04 | N03 | C02 | H2 | 138.3° | 96.2° |
| C04 | N03 | C02 | H3 | 99.6° | 142.3° |
| N03 | C04 | C05 | H5 | 151.6° | 121.4° |
| C04 | C05 | C01 | O21 | 69.1° | 101.1° |
| C05 | C04 | C06 | O07 | 69.1° | 106.4° |
| C05 | C04 | N03 | C02 | 9.2° | 12.9° |
| C04 | C05 | C01 | C57 | 119.2° | 118.9° |
| C04 | C05 | C01 | H5 | 117.6° | 118.9° |
| C04 | C05 | C57 | H5 | 124.5° | 122.0° |
| C04 | C05 | C01 | C02 | 45.3° | 15.9° |
| C04 | C05 | C57 | C58 | 177.6° | 175.0° |
| C04 | C05 | C01 | H1 | 164.8° | 134.9° |
| C04 | C05 | C57 | H47 | 62.4° | 65.0° |
| C04 | C05 | C57 | H48 | 57.6° | 55.0° |
| C40 | C39 | C38 | C34 | 0.2° | 0.2° |
| C40 | C39 | C38 | O54 | 179.5° | 180.0° |
| C40 | C39 | O54 | C55 | 179.6° | 0.0° |
| C40 | C39 | C38 | H18 | 179.8° | 179.8° |
| C39 | C40 | C41 | H20 | 179.7° | 179.9° |
| O21 | C01 | C02 | N03 | 73.5° | 93.5° |
| O21 | C01 | C05 | C02 | 114.5° | 117.0° |
| O21 | C01 | C05 | H1 | 126.1° | 124.0° |
| O21 | C01 | C05 | C57 | 171.7° | 140.0° |
| O21 | C01 | C02 | H1 | 126.9° | 123.4° |
| O21 | C01 | C02 | H2 | 45.4° | 147.2° |
| O21 | C01 | C02 | H3 | 167.5° | 25.8° |
| O21 | C01 | C05 | H5 | 48.5° | 17.9° |
| O07 | C06 | C04 | H4 | 165.1° | 133.5° |
| O07 | C06 | N08 | H52 | 177.6° | 171.3° |
| N11 | S12 | O14 | C13 | 112.8° | 111.7° |
| N11 | S12 | C13 | C20 | 93.3° | 111.3° |
| N11 | S12 | C13 | C19 | 159.0° | 180.0° |
| N11 | S12 | C13 | C56 | 55.5° | 34.4° |
| N03 | C02 | C01 | C05 | 40.0° | 24.0° |
| N03 | C02 | C01 | H2 | 119.0° | 119.3° |
| N03 | C02 | C01 | H3 | 119.0° | 119.3° |
| N03 | C02 | C01 | H1 | 159.5° | 143.1° |
| N03 | C02 | H2 | H3 | 123.0° | 121.5° |
| C02 | N03 | C04 | H4 | 108.2° | 132.6° |
| C25 | C49 | C50 | C53 | 123.5° | 120.0° |
| C25 | C49 | C50 | C51 | 120.0° | 120.0° |
| C25 | C49 | C53 | C51 | 120.4° | 120.0° |
| C25 | C49 | C50 | H32 | 180.0° | 60.0° |
| C25 | C49 | C50 | H33 | 60.0° | 180.0° |
| C25 | C49 | C50 | H34 | 60.0° | 60.0° |
| C25 | C49 | C51 | H35 | 180.0° | 18.6° |
| C25 | C49 | C51 | H36 | 60.0° | 138.7° |
| C25 | C49 | C51 | H37 | 60.0° | 101.3° |
| C25 | C49 | C53 | H38 | 180.0° | 110.9° |
| C25 | C49 | C53 | H39 | 60.0° | 129.0° |
| C25 | C49 | C53 | H40 | 60.0° | 9.0° |
| C49 | C25 | N26 | H54 | 40.4° | 123.1° |
| N33 | C34 | C38 | C39 | 179.3° | 179.1° |
| N33 | C34 | C38 | H18 | 0.7° | 0.8° |
| C34 | C38 | C39 | H18 | 180.0° | 179.9° |
| C34 | C38 | C39 | O54 | 179.8° | 179.7° |
| O14 | S12 | C13 | C20 | 150.6° | 0.2° |
| O14 | S12 | C13 | C19 | 84.9° | 68.4° |
| O14 | S12 | C13 | C56 | 60.6° | 145.9° |
| O14 | S12 | N11 | H53 | 114.5° | 129.0° |
| S12 | C13 | C20 | C19 | 99.9° | 107.5° |
| S12 | C13 | C20 | C56 | 136.8° | 145.0° |
| S12 | C13 | C19 | C56 | 130.6° | 145.0° |
| S12 | C13 | C19 | H9 | 2.1° | 145.0° |
| S12 | C13 | C19 | H10 | 143.1° | 0.0° |
| S12 | C13 | C20 | H11 | 9.4° | 0.0° |
| S12 | C13 | C20 | H12 | 150.8° | 145.0° |
| S12 | C13 | C56 | H44 | 180.0° | 154.3° |
| S12 | C13 | C56 | H45 | 60.0° | 34.3° |
| S12 | C13 | C56 | H46 | 60.0° | 85.6° |
| C13 | S12 | N11 | H53 | 1.1° | 115.0° |
| C50 | C49 | C53 | C51 | 115.6° | 120.0° |
| C50 | C49 | C25 | H13 | 177.9° | 83.5° |
| C49 | C50 | H32 | H33 | 120.0° | 120.0° |
| C49 | C50 | H32 | H34 | 120.0° | 120.1° |
| C49 | C50 | H33 | H34 | 120.0° | 120.1° |
| C50 | C49 | C51 | H35 | 57.9° | 138.6° |
| C50 | C49 | C51 | H36 | 62.1° | 101.3° |
| C50 | C49 | C51 | H37 | 177.8° | 18.7° |
| C50 | C49 | C53 | H38 | 56.0° | 9.1° |
| C50 | C49 | C53 | H39 | 176.0° | 111.0° |
| C50 | C49 | C53 | H40 | 64.0° | 129.0° |
| C01 | C05 | C57 | H5 | 123.2° | 122.1° |
| C05 | C01 | C02 | H1 | 119.5° | 119.1° |
| C01 | C05 | C57 | C58 | 70.1° | 69.0° |
| C05 | C01 | C02 | H2 | 159.0° | 95.3° |
| C05 | C01 | C02 | H3 | 79.0° | 143.2° |
| C01 | C05 | C04 | H4 | 83.8° | 117.3° |
| C01 | C05 | C57 | H47 | 49.9° | 50.9° |
| C01 | C05 | C57 | H48 | 169.8° | 170.9° |
| C57 | C05 | C01 | C02 | 73.8° | 103.0° |
| C05 | C57 | C58 | H47 | 120.0° | 119.9° |
| C05 | C57 | C58 | H48 | 120.0° | 120.0° |
| C57 | C05 | C01 | H1 | 45.6° | 16.0° |
| C57 | C05 | C04 | H4 | 158.3° | 123.8° |
| C05 | C57 | H47 | H48 | 120.0° | 120.1° |
| C05 | C57 | C58 | H49 | 180.0° | 180.0° |
| C05 | C57 | C58 | H50 | 60.0° | 60.0° |
| C05 | C57 | C58 | H51 | 60.0° | 60.0° |
| C38 | C39 | O54 | C55 | 0.9° | 180.0° |
| C38 | C39 | C40 | H19 | 179.8° | 179.8° |
| O54 | C39 | C38 | H18 | 0.2° | 0.2° |
| O54 | C39 | C40 | H19 | 0.2° | 0.2° |
| C39 | O54 | C55 | H41 | 180.0° | 180.0° |
| C39 | O54 | C55 | H42 | 60.0° | 60.0° |
| C39 | O54 | C55 | H43 | 60.0° | 60.0° |
| C01 | C02 | H2 | H3 | 123.0° | 121.4° |
| C02 | C01 | C05 | H5 | 163.0° | 134.8° |
| C13 | C20 | C19 | H11 | 109.3° | 107.5° |
| C13 | C20 | C19 | H12 | 109.3° | 107.4° |
| C20 | C13 | C19 | C56 | 122.0° | 107.5° |
| C13 | C20 | C19 | H9 | 109.5° | 107.5° |
| C13 | C20 | C19 | H10 | 109.5° | 107.5° |
| C13 | C20 | H11 | H12 | 145.0° | 145.6° |
| C20 | C13 | C56 | H44 | 39.7° | 8.6° |
| C20 | C13 | C56 | H45 | 80.4° | 111.4° |
| C20 | C13 | C56 | H46 | 159.7° | 128.7° |
| C20 | C19 | H9 | H10 | 144.7° | 145.7° |
| C19 | C20 | H11 | H12 | 145.1° | 145.8° |
| C53 | C49 | C25 | H13 | 61.0° | 36.4° |
| C53 | C49 | C50 | H32 | 56.5° | 180.0° |
| C53 | C49 | C50 | H33 | 63.5° | 60.1° |
| C53 | C49 | C50 | H34 | 176.5° | 60.0° |
| C53 | C49 | C51 | H35 | 58.0° | 101.3° |
| C53 | C49 | C51 | H36 | 178.0° | 18.7° |
| C53 | C49 | C51 | H37 | 62.0° | 138.7° |
| C49 | C53 | H38 | H39 | 120.0° | 120.0° |
| C49 | C53 | H38 | H40 | 120.0° | 119.9° |
| C49 | C53 | H39 | H40 | 120.0° | 120.0° |
| C51 | C49 | C25 | H13 | 59.1° | 156.4° |
| C51 | C49 | C50 | H32 | 60.0° | 60.0° |
| C51 | C49 | C50 | H33 | 180.0° | 59.9° |
| C51 | C49 | C50 | H34 | 60.0° | 180.0° |
| C49 | C51 | H35 | H36 | 120.0° | 120.1° |
| C49 | C51 | H35 | H37 | 120.0° | 119.9° |
| C49 | C51 | H36 | H37 | 120.0° | 120.0° |
| C51 | C49 | C53 | H38 | 59.6° | 129.1° |
| C51 | C49 | C53 | H39 | 60.4° | 9.1° |
| C51 | C49 | C53 | H40 | 179.6° | 110.9° |
| C13 | C19 | H9 | H10 | 144.7° | 145.7° |
| C19 | C13 | C56 | H44 | 47.0° | 60.1° |
| C19 | C13 | C56 | H45 | 167.0° | 180.0° |
| C19 | C13 | C56 | H46 | 73.0° | 60.0° |
| C56 | C13 | C19 | H9 | 128.5° | 0.0° |
| C56 | C13 | C19 | H10 | 12.5° | 145.0° |
| C56 | C13 | C20 | H11 | 127.4° | 145.0° |
| C56 | C13 | C20 | H12 | 14.0° | 0.0° |
| C13 | C56 | H44 | H45 | 120.0° | 120.0° |
| C13 | C56 | H44 | H46 | 120.0° | 120.1° |
| C13 | C56 | H45 | H46 | 119.9° | 120.0° |
| O54 | C55 | H41 | H42 | 120.0° | 120.0° |
| O54 | C55 | H41 | H43 | 120.0° | 120.0° |
| O54 | C55 | H42 | H43 | 120.0° | 120.0° |
| C58 | C57 | C05 | H5 | 53.1° | 53.0° |
| C58 | C57 | H47 | H48 | 120.0° | 120.0° |
| C57 | C58 | H49 | H50 | 120.0° | 120.0° |
| C57 | C58 | H49 | H51 | 120.0° | 120.1° |
| C57 | C58 | H50 | H51 | 120.0° | 120.1° |
| H1 | C01 | C02 | H2 | 81.5° | 23.8° |
| H1 | C01 | C02 | H3 | 40.6° | 97.6° |
| H1 | C01 | C05 | H5 | 77.6° | 106.1° |
| H4 | C04 | C05 | H5 | 33.8° | 1.7° |
| H5 | C05 | C57 | H47 | 173.1° | 172.9° |
| H5 | C05 | C57 | H48 | 66.9° | 67.0° |
| H6 | C17 | C18 | H7 | 146.7° | 0.0° |
| H6 | C17 | C18 | H8 | 6.1° | 145.1° |
| H6 | C17 | C47 | H31 | 165.3° | 154.3° |
| H9 | C19 | C20 | H11 | 0.2° | 145.1° |
| H9 | C19 | C20 | H12 | 141.2° | 0.0° |
| H10 | C19 | C20 | H11 | 141.2° | 0.0° |
| H10 | C19 | C20 | H12 | 0.2° | 145.1° |
| H13 | C25 | N26 | H54 | 160.7° | 2.7° |
| H14 | C30 | C31 | H15 | 146.1° | 143.2° |
| H14 | C30 | C46 | H29 | 1.8° | 145.3° |
| H14 | C30 | C46 | H30 | 142.7° | 0.3° |
| H15 | C31 | C32 | H16 | 51.7° | 24.4° |
| H15 | C31 | C32 | H17 | 171.6° | 144.7° |
| H15 | C31 | C46 | H29 | 144.7° | 1.1° |
| H15 | C31 | C46 | H30 | 3.7° | 146.1° |
| H16 | C32 | C45 | H27 | 71.7° | 145.2° |
| H16 | C32 | C45 | H28 | 168.9° | 95.1° |
| H17 | C32 | C45 | H27 | 48.2° | 24.9° |
| H17 | C32 | C45 | H28 | 71.3° | 144.6° |
| H19 | C40 | C41 | H20 | 0.2° | 0.1° |
| H21 | C42 | C43 | H23 | 179.4° | 167.1° |
| H21 | C42 | C43 | H24 | 59.8° | 72.9° |
| H22 | C42 | C43 | H23 | 61.3° | 47.5° |
| H22 | C42 | C43 | H24 | 179.1° | 167.4° |
| H23 | C43 | C44 | H25 | 175.4° | 130.0° |
| H23 | C43 | C44 | H26 | 56.1° | 110.1° |
| H24 | C43 | C44 | H25 | 65.0° | 10.2° |
| H24 | C43 | C44 | H26 | 175.6° | 130.0° |
| H25 | C44 | C45 | H27 | 174.1° | 30.7° |
| H25 | C44 | C45 | H28 | 66.5° | 150.4° |
| H26 | C44 | C45 | H27 | 54.8° | 150.5° |
| H26 | C44 | C45 | H28 | 174.2° | 89.8° |
| H32 | C50 | H33 | H34 | 120.0° | 119.9° |
| H35 | C51 | H36 | H37 | 120.0° | 120.0° |
| H38 | C53 | H39 | H40 | 120.0° | 120.0° |
| H41 | C55 | H42 | H43 | 120.0° | 120.1° |
| H44 | C56 | H45 | H46 | 120.0° | 120.0° |
| H47 | C57 | C58 | H49 | 60.0° | 60.1° |
| H47 | C57 | C58 | H50 | 180.0° | 180.0° |
| H47 | C57 | C58 | H51 | 60.0° | 60.0° |
| H48 | C57 | C58 | H49 | 60.0° | 59.9° |
| H48 | C57 | C58 | H50 | 60.0° | 60.0° |
| H48 | C57 | C58 | H51 | 180.0° | 180.0° |
| H49 | C58 | H50 | H51 | 120.0° | 119.9° |
