M43
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| N09 | NI | sing | 2.18Å | 2.04Å | |
| N13 | NI | sing | 2.12Å | 2.21Å | |
| NI | N17 | sing | 2.07Å | 1.98Å | |
| N21 | NI | sing | 2.10Å | 2.16Å | |
| O01 | C02 | sing | 1.32Å | 1.26Å | |
| C02 | O03 | doub | 1.22Å | 1.25Å | |
| C02 | C04 | sing | 1.51Å | 1.51Å | |
| C04 | C05 | sing | 1.54Å | 1.49Å | |
| C04 | H04 | sing | 0.98Å | 1.10Å | |
| C04 | H04A | sing | 0.98Å | 1.10Å | |
| C05 | C06 | sing | 1.54Å | 1.65Å | |
| C05 | C22 | sing | 1.55Å | 1.51Å | |
| C05 | H05 | sing | 0.99Å | 1.10Å | |
| C06 | C07 | sing | 1.53Å | 1.51Å | |
| C06 | N21 | sing | 1.48Å | 1.36Å | |
| C06 | H06 | sing | 0.99Å | 1.10Å | |
| C07 | C08 | sing | 1.50Å | 1.52Å | |
| C07 | H07 | sing | 0.98Å | 1.10Å | |
| C07 | H07A | sing | 0.98Å | 1.10Å | |
| C08 | N09 | doub | 1.28Å | 1.43Å | |
| C08 | C58 | sing | 1.55Å | 1.53Å | |
| N09 | C10 | sing | 1.47Å | 1.44Å | |
| C10 | C11 | sing | 1.56Å | 1.54Å | |
| C10 | C52 | sing | 1.56Å | 1.65Å | |
| C10 | H10 | sing | 0.99Å | 1.10Å | |
| C11 | C12 | sing | 1.55Å | 1.54Å | |
| C11 | H11 | sing | 0.98Å | 1.10Å | |
| C11 | H11A | sing | 0.98Å | 1.10Å | |
| C12 | N13 | sing | 1.48Å | 1.45Å | |
| C12 | C46 | sing | 1.58Å | 1.60Å | |
| C12 | N51 | sing | 1.47Å | 1.46Å | |
| N13 | C14 | doub | 1.30Å | 1.39Å | |
| C14 | C15 | sing | 1.39Å | 1.52Å | |
| C14 | C40 | sing | 1.53Å | 1.49Å | |
| C15 | C16 | doub | 1.39Å | 1.40Å | |
| C15 | H15 | sing | 0.95Å | 1.08Å | |
| C16 | N17 | sing | 1.36Å | 1.45Å | |
| C16 | C35 | sing | 1.52Å | 1.49Å | |
| N17 | C18 | sing | 1.37Å | 1.43Å | |
| C18 | C19 | doub | 1.51Å | 1.43Å | |
| C18 | C29 | sing | 1.52Å | 1.49Å | |
| C19 | C20 | sing | 1.40Å | 1.50Å | |
| C19 | C27 | sing | 1.44Å | 1.47Å | |
| C20 | N21 | doub | 1.28Å | 1.39Å | |
| C20 | C22 | sing | 1.53Å | 1.49Å | |
| C22 | C23 | sing | 1.53Å | 1.58Å | |
| C22 | H22 | sing | 0.99Å | 1.10Å | |
| C23 | C24 | sing | 1.53Å | 1.50Å | |
| C23 | H23 | sing | 0.98Å | 1.10Å | |
| C23 | H23A | sing | 0.98Å | 1.10Å | |
| C24 | S25 | sing | 1.84Å | 1.77Å | |
| C24 | C27 | sing | 1.52Å | 1.51Å | |
| C24 | H24 | sing | 0.99Å | 1.10Å | |
| S25 | C26 | sing | 1.79Å | 1.79Å | |
| C26 | H26 | sing | 0.98Å | 1.10Å | |
| C26 | H26A | sing | 0.98Å | 1.10Å | |
| C26 | H26B | sing | 0.98Å | 1.10Å | |
| C27 | O28 | doub | 1.22Å | 1.22Å | |
| C29 | C30 | sing | 1.55Å | 1.51Å | |
| C29 | C35 | sing | 1.55Å | 1.58Å | |
| C29 | H29 | sing | 0.99Å | 1.10Å | |
| C30 | C31 | sing | 1.53Å | 1.52Å | |
| C30 | H30 | sing | 0.99Å | 1.10Å | |
| C30 | H30A | sing | 0.98Å | 1.10Å | |
| C31 | C32 | sing | 1.51Å | 1.51Å | |
| C31 | H31 | sing | 0.98Å | 1.10Å | |
| C31 | H31A | sing | 0.98Å | 1.10Å | |
| C32 | O33 | sing | 1.31Å | 1.28Å | |
| C32 | O34 | doub | 1.22Å | 1.25Å | |
| C35 | C36 | sing | 1.54Å | 1.50Å | |
| C35 | H35 | sing | 0.99Å | 1.10Å | |
| C36 | C37 | sing | 1.50Å | 1.49Å | |
| C36 | H36 | sing | 0.98Å | 1.10Å | |
| C36 | H36A | sing | 0.98Å | 1.10Å | |
| C37 | O38 | doub | 1.22Å | 1.26Å | |
| C37 | O39 | sing | 1.32Å | 1.27Å | |
| C40 | C41 | sing | 1.56Å | 1.52Å | |
| C40 | C46 | sing | 1.57Å | 1.61Å | |
| C40 | H40 | sing | 0.99Å | 1.10Å | |
| C41 | C42 | sing | 1.53Å | 1.51Å | |
| C41 | H41 | sing | 0.99Å | 1.10Å | |
| C41 | H41A | sing | 0.99Å | 1.10Å | |
| C42 | C43 | sing | 1.50Å | 1.48Å | |
| C42 | H42 | sing | 0.98Å | 1.10Å | |
| C42 | H42A | sing | 0.98Å | 1.10Å | |
| C43 | O44 | doub | 1.22Å | 1.25Å | |
| C43 | O45 | sing | 1.31Å | 1.27Å | |
| C46 | C47 | sing | 1.55Å | 1.45Å | |
| C46 | C48 | sing | 1.55Å | 1.48Å | |
| C47 | H47 | sing | 0.97Å | 1.10Å | |
| C47 | H47A | sing | 0.97Å | 1.10Å | |
| C47 | H47B | sing | 0.97Å | 1.10Å | |
| C48 | C49 | sing | 1.50Å | 1.38Å | |
| C48 | H48 | sing | 0.98Å | 1.10Å | |
| C48 | H48A | sing | 0.98Å | 1.10Å | |
| C49 | O50 | doub | 1.24Å | 1.22Å | |
| C49 | N51 | sing | 1.33Å | 1.36Å | |
| N51 | HN51 | sing | 0.86Å | 1.00Å | |
| C52 | C53 | sing | 1.54Å | 1.56Å | |
| C52 | C58 | sing | 1.62Å | 1.63Å | |
| C52 | H52 | sing | 0.99Å | 1.10Å | |
| C53 | C54 | sing | 1.53Å | 1.51Å | |
| C53 | H53 | sing | 0.98Å | 1.10Å | |
| C53 | H53A | sing | 0.98Å | 1.10Å | |
| C54 | C55 | sing | 1.50Å | 1.49Å | |
| C54 | H54 | sing | 0.98Å | 1.10Å | |
| C54 | H54A | sing | 0.98Å | 1.10Å | |
| C55 | O56 | doub | 1.22Å | 1.26Å | |
| C55 | O57 | sing | 1.31Å | 1.26Å | |
| C58 | C59 | sing | 1.55Å | 1.66Å | |
| C58 | C60 | sing | 1.57Å | 1.65Å | |
| C59 | H59 | sing | 0.98Å | 1.10Å | |
| C59 | H59A | sing | 0.98Å | 1.10Å | |
| C59 | H59B | sing | 0.98Å | 1.10Å | |
| C60 | C61 | sing | 1.52Å | 1.52Å | |
| C60 | H60 | sing | 0.97Å | 1.10Å | |
| C60 | H60A | sing | 0.97Å | 1.10Å | |
| C61 | N62 | sing | 1.33Å | 1.44Å | |
| C61 | O63 | doub | 1.24Å | 1.25Å | |
| N62 | HN62 | sing | 0.89Å | 1.00Å | |
| N62 | HN6A | sing | 0.89Å | 1.00Å | |
| O01 | H49 | sing | 0.88Å | 0.95Å | |
| O33 | H50 | sing | 0.88Å | 0.95Å | |
| O39 | H51 | sing | 0.88Å | 0.95Å | |
| O45 | H521 | sing | 0.88Å | 0.95Å | |
| O57 | H531 | sing | 0.88Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| N09 | NI | N13 | 85.8° | 90.2° |
| N09 | NI | N17 | 174.3° | 178.2° |
| N09 | NI | N21 | 94.9° | 93.5° |
| NI | N09 | C08 | 118.7° | 122.9° |
| NI | N09 | C10 | 132.6° | 127.7° |
| N13 | NI | N17 | 93.0° | 91.7° |
| N13 | NI | N21 | 175.2° | 174.3° |
| NI | N13 | C12 | 122.1° | 127.4° |
| NI | N13 | C14 | 114.0° | 120.7° |
| N17 | NI | N21 | 85.9° | 84.7° |
| NI | N17 | C16 | 126.0° | 122.3° |
| NI | N17 | C18 | 133.9° | 128.9° |
| NI | N21 | C06 | 115.6° | 117.7° |
| NI | N21 | C20 | 126.1° | 132.6° |
| O01 | C02 | O03 | 120.4° | 119.4° |
| O01 | C02 | C04 | 121.2° | 117.4° |
| C02 | O01 | H49 | 109.5° | 117.0° |
| O03 | C02 | C04 | 118.4° | 123.2° |
| C02 | C04 | C05 | 112.5° | 114.7° |
| C02 | C04 | H04 | 108.5° | 108.1° |
| C02 | C04 | H04A | 108.5° | 109.0° |
| C05 | C04 | H04 | 108.5° | 108.7° |
| C05 | C04 | H04A | 108.5° | 108.8° |
| C04 | C05 | C06 | 114.8° | 115.6° |
| C04 | C05 | C22 | 115.6° | 117.7° |
| C04 | C05 | H05 | 99.3° | 105.8° |
| H04 | C04 | H04A | 110.4° | 107.3° |
| C06 | C05 | C22 | 102.9° | 101.6° |
| C06 | C05 | H05 | 112.7° | 107.6° |
| C05 | C06 | C07 | 116.9° | 118.5° |
| C05 | C06 | N21 | 101.7° | 108.7° |
| C05 | C06 | H06 | 110.4° | 107.3° |
| C22 | C05 | H05 | 112.0° | 108.1° |
| C05 | C22 | C20 | 104.7° | 103.7° |
| C05 | C22 | C23 | 117.3° | 116.3° |
| C05 | C22 | H22 | 108.4° | 108.5° |
| C07 | C06 | N21 | 110.9° | 106.0° |
| C07 | C06 | H06 | 101.1° | 108.4° |
| C06 | C07 | C08 | 104.7° | 113.9° |
| C06 | C07 | H07 | 111.1° | 108.7° |
| C06 | C07 | H07A | 111.1° | 109.2° |
| N21 | C06 | H06 | 116.5° | 107.6° |
| C06 | N21 | C20 | 113.7° | 109.8° |
| C08 | C07 | H07 | 111.1° | 108.8° |
| C08 | C07 | H07A | 111.1° | 109.3° |
| C07 | C08 | N09 | 118.1° | 116.8° |
| C07 | C08 | C58 | 122.8° | 128.4° |
| H07 | C07 | H07A | 107.8° | 106.7° |
| N09 | C08 | C58 | 119.1° | 114.8° |
| C08 | N09 | C10 | 106.2° | 109.3° |
| C08 | C58 | C52 | 92.9° | 97.0° |
| C08 | C58 | C59 | 110.0° | 110.0° |
| C08 | C58 | C60 | 115.4° | 114.1° |
| N09 | C10 | C11 | 113.7° | 111.0° |
| N09 | C10 | C52 | 100.8° | 101.7° |
| N09 | C10 | H10 | 117.0° | 109.4° |
| C11 | C10 | C52 | 120.1° | 124.1° |
| C11 | C10 | H10 | 96.2° | 102.6° |
| C10 | C11 | C12 | 109.1° | 122.2° |
| C10 | C11 | H11 | 109.6° | 106.5° |
| C10 | C11 | H11A | 109.6° | 107.8° |
| C52 | C10 | H10 | 110.1° | 107.7° |
| C10 | C52 | C53 | 111.5° | 117.9° |
| C10 | C52 | C58 | 104.0° | 100.0° |
| C10 | C52 | H52 | 119.6° | 103.9° |
| C12 | C11 | H11 | 109.6° | 107.1° |
| C12 | C11 | H11A | 109.6° | 106.5° |
| C11 | C12 | N13 | 112.1° | 104.3° |
| C11 | C12 | C46 | 114.9° | 122.1° |
| C11 | C12 | N51 | 104.7° | 112.4° |
| H11 | C11 | H11A | 109.3° | 105.6° |
| N13 | C12 | C46 | 102.3° | 104.8° |
| N13 | C12 | N51 | 119.1° | 109.6° |
| C12 | N13 | C14 | 113.8° | 110.9° |
| C46 | C12 | N51 | 103.9° | 103.2° |
| C12 | C46 | C40 | 103.0° | 100.8° |
| C12 | C46 | C47 | 116.3° | 117.2° |
| C12 | C46 | C48 | 101.8° | 102.1° |
| C12 | N51 | C49 | 105.1° | 114.2° |
| C12 | N51 | HN51 | 127.4° | 124.0° |
| N13 | C14 | C15 | 119.4° | 125.8° |
| N13 | C14 | C40 | 110.7° | 111.7° |
| C15 | C14 | C40 | 122.2° | 122.5° |
| C14 | C15 | C16 | 122.5° | 129.1° |
| C14 | C15 | H15 | 118.7° | 115.4° |
| C14 | C40 | C41 | 109.1° | 109.7° |
| C14 | C40 | C46 | 103.5° | 99.7° |
| C14 | C40 | H40 | 117.7° | 108.0° |
| C16 | C15 | H15 | 118.8° | 115.5° |
| C15 | C16 | N17 | 124.8° | 125.3° |
| C15 | C16 | C35 | 118.5° | 122.8° |
| N17 | C16 | C35 | 116.6° | 111.9° |
| C16 | N17 | C18 | 100.0° | 108.8° |
| C16 | C35 | C29 | 100.1° | 100.4° |
| C16 | C35 | C36 | 114.8° | 112.8° |
| C16 | C35 | H35 | 115.6° | 109.7° |
| N17 | C18 | C19 | 121.4° | 124.9° |
| N17 | C18 | C29 | 115.6° | 111.0° |
| C19 | C18 | C29 | 120.4° | 123.7° |
| C18 | C19 | C20 | 121.4° | 119.8° |
| C18 | C19 | C27 | 119.8° | 124.2° |
| C18 | C29 | C30 | 113.6° | 112.9° |
| C18 | C29 | C35 | 100.5° | 101.9° |
| C18 | C29 | H29 | 115.8° | 107.9° |
| C20 | C19 | C27 | 117.3° | 115.5° |
| C19 | C20 | N21 | 118.4° | 126.1° |
| C19 | C20 | C22 | 123.6° | 120.6° |
| C19 | C27 | C24 | 117.1° | 121.9° |
| C19 | C27 | O28 | 123.1° | 121.3° |
| N21 | C20 | C22 | 109.4° | 113.0° |
| C20 | C22 | C23 | 111.8° | 112.1° |
| C20 | C22 | H22 | 114.2° | 107.1° |
| C23 | C22 | H22 | 100.8° | 108.7° |
| C22 | C23 | C24 | 108.2° | 112.1° |
| C22 | C23 | H23 | 109.9° | 109.4° |
| C22 | C23 | H23A | 109.9° | 109.7° |
| C24 | C23 | H23 | 109.9° | 109.0° |
| C24 | C23 | H23A | 109.9° | 108.8° |
| C23 | C24 | S25 | 110.0° | 108.2° |
| C23 | C24 | C27 | 114.0° | 111.9° |
| C23 | C24 | H24 | 105.5° | 108.5° |
| H23 | C23 | H23A | 109.0° | 107.8° |
| S25 | C24 | C27 | 108.3° | 111.2° |
| S25 | C24 | H24 | 111.6° | 108.4° |
| C24 | S25 | C26 | 103.6° | 103.6° |
| C27 | C24 | H24 | 107.4° | 108.5° |
| C24 | C27 | O28 | 119.8° | 116.6° |
| S25 | C26 | H26 | 109.5° | 109.4° |
| S25 | C26 | H26A | 109.4° | 109.5° |
| S25 | C26 | H26B | 109.4° | 109.5° |
| H26 | C26 | H26A | 109.5° | 109.5° |
| H26 | C26 | H26B | 109.5° | 109.4° |
| H26A | C26 | H26B | 109.5° | 109.5° |
| C30 | C29 | C35 | 117.3° | 116.9° |
| C30 | C29 | H29 | 98.5° | 108.4° |
| C29 | C30 | C31 | 117.9° | 115.9° |
| C29 | C30 | H30 | 106.8° | 108.6° |
| C29 | C30 | H30A | 106.8° | 108.4° |
| C35 | C29 | H29 | 112.0° | 108.4° |
| C29 | C35 | C36 | 117.7° | 116.5° |
| C29 | C35 | H35 | 112.5° | 110.2° |
| C31 | C30 | H30 | 106.8° | 108.4° |
| C31 | C30 | H30A | 106.8° | 108.1° |
| C30 | C31 | C32 | 115.4° | 114.9° |
| C30 | C31 | H31 | 107.5° | 109.2° |
| C30 | C31 | H31A | 107.6° | 108.6° |
| H30 | C30 | H30A | 112.0° | 107.1° |
| C32 | C31 | H31 | 107.5° | 108.4° |
| C32 | C31 | H31A | 107.5° | 108.3° |
| C31 | C32 | O33 | 120.3° | 113.4° |
| C31 | C32 | O34 | 118.5° | 123.3° |
| H31 | C31 | H31A | 111.3° | 107.2° |
| O33 | C32 | O34 | 121.2° | 123.3° |
| C32 | O33 | H50 | 109.5° | 112.1° |
| C36 | C35 | H35 | 97.1° | 107.1° |
| C35 | C36 | C37 | 112.5° | 114.3° |
| C35 | C36 | H36 | 108.5° | 109.2° |
| C35 | C36 | H36A | 108.5° | 108.8° |
| C37 | C36 | H36 | 108.4° | 108.4° |
| C37 | C36 | H36A | 108.5° | 108.5° |
| C36 | C37 | O38 | 117.4° | 125.1° |
| C36 | C37 | O39 | 121.9° | 111.4° |
| H36 | C36 | H36A | 110.4° | 107.5° |
| O38 | C37 | O39 | 120.6° | 123.5° |
| C37 | O39 | H51 | 109.5° | 112.6° |
| C41 | C40 | C46 | 119.6° | 124.0° |
| C41 | C40 | H40 | 101.0° | 107.1° |
| C40 | C41 | C42 | 115.0° | 116.6° |
| C40 | C41 | H41 | 107.6° | 108.6° |
| C40 | C41 | H41A | 107.6° | 108.6° |
| C46 | C40 | H40 | 106.8° | 107.4° |
| C40 | C46 | C47 | 108.2° | 114.3° |
| C40 | C46 | C48 | 118.1° | 114.0° |
| C42 | C41 | H41 | 107.7° | 108.4° |
| C42 | C41 | H41A | 107.7° | 107.8° |
| C41 | C42 | C43 | 114.8° | 113.6° |
| C41 | C42 | H42 | 107.7° | 108.9° |
| C41 | C42 | H42A | 107.7° | 109.2° |
| H41 | C41 | H41A | 111.2° | 106.4° |
| C43 | C42 | H42 | 107.7° | 108.6° |
| C43 | C42 | H42A | 107.8° | 108.7° |
| C42 | C43 | O44 | 120.0° | 123.3° |
| C42 | C43 | O45 | 119.1° | 113.5° |
| H42 | C42 | H42A | 111.1° | 107.6° |
| O44 | C43 | O45 | 120.9° | 123.3° |
| C43 | O45 | H521 | 109.5° | 112.1° |
| C47 | C46 | C48 | 109.5° | 107.9° |
| C46 | C47 | H47 | 109.5° | 110.0° |
| C46 | C47 | H47A | 109.4° | 110.2° |
| C46 | C47 | H47B | 109.4° | 110.7° |
| C46 | C48 | C49 | 103.6° | 104.7° |
| C46 | C48 | H48 | 111.5° | 111.5° |
| C46 | C48 | H48A | 111.5° | 111.4° |
| H47 | C47 | H47A | 109.5° | 109.3° |
| H47 | C47 | H47B | 109.5° | 108.6° |
| H47A | C47 | H47B | 109.5° | 108.0° |
| C49 | C48 | H48 | 111.5° | 110.5° |
| C49 | C48 | H48A | 111.5° | 110.3° |
| C48 | C49 | O50 | 120.8° | 126.6° |
| C48 | C49 | N51 | 117.8° | 108.9° |
| H48 | C48 | H48A | 107.3° | 108.4° |
| O50 | C49 | N51 | 121.4° | 124.5° |
| C49 | N51 | HN51 | 127.5° | 121.7° |
| C53 | C52 | C58 | 125.3° | 121.9° |
| C53 | C52 | H52 | 94.1° | 105.4° |
| C52 | C53 | C54 | 116.2° | 116.2° |
| C52 | C53 | H53 | 107.3° | 109.0° |
| C52 | C53 | H53A | 107.3° | 108.8° |
| C58 | C52 | H52 | 103.2° | 106.1° |
| C52 | C58 | C59 | 102.3° | 115.3° |
| C52 | C58 | C60 | 100.5° | 112.0° |
| C54 | C53 | H53 | 107.3° | 107.3° |
| C54 | C53 | H53A | 107.3° | 108.5° |
| C53 | C54 | C55 | 114.7° | 114.6° |
| C53 | C54 | H54 | 107.7° | 109.1° |
| C53 | C54 | H54A | 107.8° | 108.8° |
| H53 | C53 | H53A | 111.6° | 106.7° |
| C55 | C54 | H54 | 107.7° | 108.3° |
| C55 | C54 | H54A | 107.7° | 108.4° |
| C54 | C55 | O56 | 120.1° | 123.4° |
| C54 | C55 | O57 | 119.4° | 113.4° |
| H54 | C54 | H54A | 111.2° | 107.4° |
| O56 | C55 | O57 | 120.5° | 123.2° |
| C55 | O57 | H531 | 109.5° | 112.1° |
| C59 | C58 | C60 | 127.4° | 108.3° |
| C58 | C59 | H59 | 109.5° | 110.1° |
| C58 | C59 | H59A | 109.5° | 109.7° |
| C58 | C59 | H59B | 109.4° | 109.7° |
| C58 | C60 | C61 | 114.7° | 119.0° |
| C58 | C60 | H60 | 107.8° | 107.9° |
| C58 | C60 | H60A | 107.8° | 108.5° |
| H59 | C59 | H59A | 109.4° | 108.7° |
| H59 | C59 | H59B | 109.5° | 109.3° |
| H59A | C59 | H59B | 109.5° | 109.4° |
| C61 | C60 | H60 | 107.8° | 107.5° |
| C61 | C60 | H60A | 107.8° | 107.1° |
| C60 | C61 | N62 | 118.3° | 119.2° |
| C60 | C61 | O63 | 123.3° | 119.4° |
| H60 | C60 | H60A | 111.1° | 106.3° |
| N62 | C61 | O63 | 118.4° | 121.4° |
| C61 | N62 | HN62 | 120.0° | 119.9° |
| C61 | N62 | HN6A | 120.0° | 120.6° |
| HN62 | N62 | HN6A | 120.0° | 119.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| N09 | NI | N13 | N17 | 174.4° | 179.7° |
| N09 | NI | N13 | N21 | 98.6° | 130.5° |
| N09 | NI | N17 | N21 | 98.3° | 5.1° |
| N09 | NI | N21 | C06 | 5.4° | 8.2° |
| NI | N09 | C08 | C07 | 22.8° | 14.5° |
| NI | N09 | C08 | C10 | 164.4° | 176.2° |
| NI | N09 | C08 | C58 | 157.4° | 163.7° |
| NI | N09 | C10 | C11 | 2.4° | 7.6° |
| NI | N09 | C10 | C52 | 132.3° | 141.4° |
| NI | N09 | C10 | H10 | 108.4° | 104.9° |
| N09 | NI | N13 | C12 | 3.0° | 10.0° |
| N09 | NI | N13 | C14 | 146.0° | 157.8° |
| N09 | NI | N17 | C16 | 77.4° | 164.4° |
| N09 | NI | N17 | C18 | 108.2° | 15.3° |
| N09 | NI | N21 | C20 | 159.8° | 169.9° |
| N13 | NI | N17 | N21 | 175.3° | 175.7° |
| N13 | NI | N21 | C06 | 92.8° | 122.2° |
| N13 | NI | N09 | C08 | 176.0° | 173.5° |
| N13 | NI | N09 | C10 | 24.6° | 11.1° |
| NI | N13 | C12 | C11 | 42.1° | 44.6° |
| NI | N13 | C12 | C14 | 143.1° | 168.8° |
| NI | N13 | C12 | C46 | 165.6° | 174.0° |
| NI | N13 | C12 | N51 | 80.6° | 75.9° |
| NI | N13 | C14 | C15 | 54.1° | 25.9° |
| NI | N13 | C14 | C40 | 155.9° | 151.7° |
| N13 | NI | N17 | C16 | 0.3° | 6.2° |
| N13 | NI | N17 | C18 | 174.7° | 174.1° |
| N13 | NI | N21 | C20 | 61.5° | 59.8° |
| N17 | NI | N21 | C06 | 168.8° | 171.7° |
| N17 | NI | N09 | C08 | 106.6° | 15.9° |
| N17 | NI | N09 | C10 | 52.9° | 159.5° |
| N17 | NI | N13 | C12 | 171.3° | 170.3° |
| N17 | NI | N13 | C14 | 28.3° | 21.9° |
| NI | N17 | C16 | C15 | 7.4° | 7.7° |
| NI | N17 | C16 | C18 | 175.9° | 179.8° |
| NI | N17 | C16 | C35 | 171.4° | 169.6° |
| NI | N17 | C18 | C19 | 8.3° | 0.0° |
| NI | N17 | C18 | C29 | 170.0° | 173.5° |
| N17 | NI | N21 | C20 | 14.5° | 10.3° |
| NI | N21 | C06 | C05 | 176.2° | 175.9° |
| NI | N21 | C06 | C07 | 51.2° | 47.6° |
| NI | N21 | C06 | C20 | 157.5° | 178.4° |
| NI | N21 | C06 | H06 | 63.7° | 68.2° |
| N21 | NI | N09 | C08 | 8.8° | 10.8° |
| N21 | NI | N09 | C10 | 150.7° | 164.6° |
| N21 | NI | N13 | C12 | 95.6° | 140.5° |
| N21 | NI | N13 | C14 | 47.4° | 27.4° |
| N21 | NI | N17 | C16 | 175.7° | 169.5° |
| N21 | NI | N17 | C18 | 9.9° | 10.2° |
| NI | N21 | C20 | C19 | 39.8° | 1.6° |
| NI | N21 | C20 | C22 | 171.2° | 172.3° |
| O01 | C02 | O03 | C04 | 177.7° | 179.9° |
| O01 | C02 | C04 | C05 | 142.8° | 86.3° |
| O01 | C02 | C04 | H04 | 22.8° | 152.3° |
| O01 | C02 | C04 | H04A | 97.2° | 36.0° |
| O03 | C02 | C04 | C05 | 34.9° | 93.7° |
| O03 | C02 | C04 | H04 | 154.9° | 27.7° |
| O03 | C02 | C04 | H04A | 85.1° | 144.1° |
| O03 | C02 | O01 | H49 | 0.0° | 180.0° |
| C02 | C04 | C05 | H04 | 120.0° | 121.1° |
| C02 | C04 | C05 | H04A | 120.0° | 122.4° |
| C02 | C04 | H04 | H04A | 118.7° | 117.4° |
| C02 | C04 | C05 | C06 | 162.6° | 163.0° |
| C02 | C04 | C05 | C22 | 77.7° | 76.7° |
| C02 | C04 | C05 | H05 | 42.2° | 44.1° |
| C04 | C02 | O01 | H49 | 177.6° | 0.1° |
| C05 | C04 | H04 | H04A | 118.8° | 117.5° |
| C04 | C05 | C06 | C22 | 126.5° | 128.6° |
| C04 | C05 | C06 | H05 | 112.7° | 117.9° |
| C04 | C05 | C22 | H05 | 112.7° | 119.6° |
| C04 | C05 | C06 | C07 | 86.5° | 97.8° |
| C04 | C05 | C06 | N21 | 152.6° | 141.2° |
| C04 | C05 | C06 | H06 | 28.4° | 25.2° |
| C04 | C05 | C22 | C20 | 143.2° | 144.0° |
| C04 | C05 | C22 | C23 | 92.2° | 92.5° |
| C04 | C05 | C22 | H22 | 20.9° | 30.4° |
| H04 | C04 | C05 | C06 | 77.3° | 42.0° |
| H04 | C04 | C05 | C22 | 42.3° | 162.2° |
| H04 | C04 | C05 | H05 | 162.2° | 77.0° |
| H04A | C04 | C05 | C06 | 42.7° | 74.6° |
| H04A | C04 | C05 | C22 | 162.3° | 45.6° |
| H04A | C04 | C05 | H05 | 77.8° | 166.4° |
| C06 | C05 | C22 | H05 | 121.3° | 113.1° |
| C05 | C06 | C07 | N21 | 115.9° | 122.3° |
| C05 | C06 | C07 | H06 | 119.9° | 122.4° |
| C05 | C06 | N21 | H06 | 120.0° | 115.9° |
| C05 | C06 | C07 | C08 | 154.7° | 151.9° |
| C05 | C06 | C07 | H07 | 34.7° | 86.6° |
| C05 | C06 | C07 | H07A | 85.3° | 29.4° |
| C05 | C06 | N21 | C20 | 26.3° | 2.5° |
| C06 | C05 | C22 | C20 | 17.2° | 16.8° |
| C06 | C05 | C22 | C23 | 141.8° | 140.2° |
| C06 | C05 | C22 | H22 | 105.1° | 96.9° |
| C22 | C05 | C06 | C07 | 147.1° | 133.6° |
| C22 | C05 | C06 | N21 | 26.1° | 12.6° |
| C22 | C05 | C06 | H06 | 98.1° | 103.5° |
| C05 | C22 | C20 | C19 | 144.0° | 168.2° |
| C05 | C22 | C20 | N21 | 3.1° | 17.5° |
| C05 | C22 | C20 | C23 | 128.0° | 126.2° |
| C05 | C22 | C20 | H22 | 118.4° | 114.6° |
| C05 | C22 | C23 | H22 | 117.3° | 122.8° |
| C05 | C22 | C23 | C24 | 168.9° | 166.9° |
| C05 | C22 | C23 | H23 | 48.9° | 72.1° |
| C05 | C22 | C23 | H23A | 71.0° | 45.9° |
| H05 | C05 | C06 | C07 | 26.2° | 20.1° |
| H05 | C05 | C06 | N21 | 94.7° | 100.8° |
| H05 | C05 | C06 | H06 | 141.1° | 143.1° |
| H05 | C05 | C22 | C20 | 104.1° | 96.3° |
| H05 | C05 | C22 | C23 | 20.5° | 27.2° |
| H05 | C05 | C22 | H22 | 133.6° | 150.0° |
| C07 | C06 | N21 | H06 | 114.9° | 115.8° |
| C06 | C07 | C08 | H07 | 120.0° | 121.4° |
| C06 | C07 | C08 | H07A | 120.0° | 122.4° |
| C06 | C07 | H07 | H07A | 121.9° | 117.6° |
| C06 | C07 | C08 | N09 | 72.5° | 67.9° |
| C06 | C07 | C08 | C58 | 107.7° | 110.0° |
| C07 | C06 | N21 | C20 | 151.3° | 130.8° |
| N21 | C06 | C07 | C08 | 89.3° | 85.8° |
| N21 | C06 | C07 | H07 | 150.7° | 35.7° |
| N21 | C06 | C07 | H07A | 30.7° | 151.8° |
| C06 | N21 | C20 | C19 | 165.5° | 176.5° |
| C06 | N21 | C20 | C22 | 16.4° | 9.5° |
| H06 | C06 | C07 | C08 | 34.8° | 29.5° |
| H06 | C06 | C07 | H07 | 85.2° | 151.0° |
| H06 | C06 | C07 | H07A | 154.8° | 93.0° |
| H06 | C06 | N21 | C20 | 93.8° | 113.4° |
| C08 | C07 | H07 | H07A | 121.9° | 117.8° |
| C07 | C08 | N09 | C58 | 179.8° | 178.1° |
| C07 | C08 | N09 | C10 | 172.8° | 169.3° |
| C07 | C08 | C58 | C52 | 161.2° | 163.9° |
| C07 | C08 | C58 | C59 | 57.0° | 43.8° |
| C07 | C08 | C58 | C60 | 95.8° | 78.2° |
| H07 | C07 | C08 | N09 | 167.5° | 53.6° |
| H07 | C07 | C08 | C58 | 12.3° | 128.6° |
| H07A | C07 | C08 | N09 | 47.5° | 169.7° |
| H07A | C07 | C08 | C58 | 132.3° | 12.4° |
| C08 | N09 | C10 | C11 | 158.9° | 168.3° |
| C08 | N09 | C10 | C52 | 29.0° | 34.5° |
| C08 | N09 | C10 | H10 | 90.3° | 79.2° |
| N09 | C08 | C58 | C52 | 19.0° | 14.0° |
| N09 | C08 | C58 | C59 | 123.2° | 134.1° |
| N09 | C08 | C58 | C60 | 84.0° | 104.0° |
| C58 | C08 | N09 | C10 | 7.0° | 12.5° |
| C08 | C58 | C52 | C10 | 34.0° | 32.1° |
| C08 | C58 | C52 | C53 | 95.6° | 99.9° |
| C08 | C58 | C52 | C59 | 111.2° | 116.0° |
| C08 | C58 | C52 | C60 | 116.5° | 119.5° |
| C08 | C58 | C52 | H52 | 159.5° | 139.8° |
| C08 | C58 | C59 | C60 | 148.6° | 125.3° |
| C08 | C58 | C59 | H59 | 180.0° | 74.4° |
| C08 | C58 | C59 | H59A | 60.0° | 45.1° |
| C08 | C58 | C59 | H59B | 60.0° | 165.3° |
| C08 | C58 | C60 | C61 | 178.0° | 50.9° |
| C08 | C58 | C60 | H60 | 61.9° | 173.6° |
| C08 | C58 | C60 | H60A | 58.1° | 71.6° |
| N09 | C10 | C11 | C52 | 119.4° | 121.4° |
| N09 | C10 | C11 | H10 | 123.1° | 116.7° |
| N09 | C10 | C52 | H10 | 124.2° | 115.0° |
| N09 | C10 | C11 | C12 | 57.5° | 58.5° |
| N09 | C10 | C11 | H11 | 62.5° | 178.1° |
| N09 | C10 | C11 | H11A | 177.5° | 65.2° |
| N09 | C10 | C52 | C53 | 95.8° | 93.9° |
| N09 | C10 | C52 | C58 | 41.8° | 40.6° |
| N09 | C10 | C52 | H52 | 156.1° | 150.1° |
| C11 | C10 | C52 | H10 | 110.1° | 119.5° |
| C10 | C11 | C12 | H11 | 120.0° | 123.1° |
| C10 | C11 | C12 | H11A | 120.0° | 124.3° |
| C10 | C11 | H11 | H11A | 120.1° | 114.5° |
| C10 | C11 | C12 | N13 | 78.9° | 77.0° |
| C10 | C11 | C12 | C46 | 164.9° | 164.9° |
| C10 | C11 | C12 | N51 | 51.6° | 41.6° |
| C11 | C10 | C52 | C53 | 29.9° | 31.6° |
| C11 | C10 | C52 | C58 | 167.5° | 166.1° |
| C11 | C10 | C52 | H52 | 78.2° | 84.4° |
| C52 | C10 | C11 | C12 | 177.0° | 180.0° |
| C52 | C10 | C11 | H11 | 57.0° | 56.7° |
| C52 | C10 | C11 | H11A | 63.0° | 56.2° |
| C10 | C52 | C53 | C58 | 126.6° | 124.1° |
| C10 | C52 | C53 | H52 | 124.1° | 115.3° |
| C10 | C52 | C58 | H52 | 125.5° | 107.7° |
| C10 | C52 | C53 | C54 | 164.4° | 92.8° |
| C10 | C52 | C53 | H53 | 44.4° | 146.0° |
| C10 | C52 | C53 | H53A | 75.6° | 30.0° |
| C10 | C52 | C58 | C59 | 145.3° | 148.2° |
| C10 | C52 | C58 | C60 | 82.5° | 87.4° |
| H10 | C10 | C11 | C12 | 65.5° | 58.2° |
| H10 | C10 | C11 | H11 | 174.4° | 65.1° |
| H10 | C10 | C11 | H11A | 54.5° | 178.1° |
| H10 | C10 | C52 | C53 | 140.1° | 151.2° |
| H10 | C10 | C52 | C58 | 82.4° | 74.4° |
| H10 | C10 | C52 | H52 | 31.9° | 35.1° |
| C12 | C11 | H11 | H11A | 120.1° | 113.3° |
| C11 | C12 | N13 | C46 | 123.6° | 129.4° |
| C11 | C12 | N13 | N51 | 122.6° | 120.5° |
| C11 | C12 | C46 | N51 | 113.8° | 127.5° |
| C11 | C12 | N13 | C14 | 101.0° | 124.2° |
| C11 | C12 | C46 | C40 | 96.5° | 93.6° |
| C11 | C12 | C46 | C47 | 21.7° | 31.1° |
| C11 | C12 | C46 | C48 | 140.6° | 148.7° |
| C11 | C12 | N51 | C49 | 138.5° | 142.4° |
| C11 | C12 | N51 | HN51 | 41.5° | 40.7° |
| H11 | C11 | C12 | N13 | 41.1° | 160.0° |
| H11 | C11 | C12 | C46 | 75.1° | 41.9° |
| H11 | C11 | C12 | N51 | 171.6° | 81.4° |
| H11A | C11 | C12 | N13 | 161.1° | 47.3° |
| H11A | C11 | C12 | C46 | 44.9° | 70.7° |
| H11A | C11 | C12 | N51 | 68.4° | 166.0° |
| N13 | C12 | C46 | N51 | 124.5° | 114.7° |
| C12 | N13 | C14 | C15 | 159.8° | 164.4° |
| C12 | N13 | C14 | C40 | 9.8° | 18.0° |
| N13 | C12 | C46 | C40 | 25.2° | 24.3° |
| N13 | C12 | C46 | C47 | 143.4° | 148.9° |
| N13 | C12 | C46 | C48 | 97.7° | 93.4° |
| N13 | C12 | N51 | C49 | 95.2° | 102.1° |
| N13 | C12 | N51 | HN51 | 84.7° | 74.8° |
| C46 | C12 | N13 | C14 | 22.6° | 5.2° |
| C12 | C46 | C40 | C14 | 20.2° | 32.1° |
| C12 | C46 | C40 | C41 | 101.3° | 89.8° |
| C12 | C46 | C40 | C47 | 123.7° | 126.6° |
| C12 | C46 | C40 | C48 | 111.2° | 108.6° |
| C12 | C46 | C40 | H40 | 145.1° | 144.6° |
| C12 | C46 | C47 | C48 | 114.6° | 114.5° |
| C12 | C46 | C47 | H47 | 180.0° | 179.8° |
| C12 | C46 | C47 | H47A | 60.0° | 59.6° |
| C12 | C46 | C47 | H47B | 60.0° | 59.8° |
| C12 | C46 | C48 | C49 | 25.3° | 25.9° |
| C12 | C46 | C48 | H48 | 94.7° | 145.4° |
| C12 | C46 | C48 | H48A | 145.3° | 93.3° |
| C46 | C12 | N51 | C49 | 17.7° | 9.0° |
| C46 | C12 | N51 | HN51 | 162.4° | 174.0° |
| N51 | C12 | N13 | C14 | 136.3° | 115.3° |
| N51 | C12 | C46 | C40 | 149.7° | 138.9° |
| N51 | C12 | C46 | C47 | 92.1° | 96.4° |
| N51 | C12 | C46 | C48 | 26.8° | 21.2° |
| C12 | N51 | C49 | C48 | 1.4° | 8.1° |
| C12 | N51 | C49 | O50 | 179.8° | 174.4° |
| C12 | N51 | C49 | HN51 | 180.0° | 177.0° |
| N13 | C14 | C15 | C40 | 146.4° | 177.4° |
| N13 | C14 | C15 | C16 | 49.7° | 7.9° |
| N13 | C14 | C15 | H15 | 130.3° | 172.1° |
| N13 | C14 | C40 | C41 | 120.4° | 98.8° |
| N13 | C14 | C40 | C46 | 7.9° | 32.8° |
| N13 | C14 | C40 | H40 | 125.4° | 144.8° |
| C14 | C15 | C16 | H15 | 180.0° | 179.9° |
| C14 | C15 | C16 | N17 | 13.4° | 11.8° |
| C14 | C15 | C16 | C35 | 167.8° | 165.2° |
| C15 | C14 | C40 | C41 | 90.5° | 78.9° |
| C15 | C14 | C40 | C46 | 141.1° | 149.5° |
| C15 | C14 | C40 | H40 | 23.6° | 37.5° |
| C40 | C14 | C15 | C16 | 163.8° | 169.4° |
| C40 | C14 | C15 | H15 | 16.2° | 10.5° |
| C14 | C40 | C41 | C46 | 118.7° | 117.3° |
| C14 | C40 | C41 | H40 | 124.6° | 116.9° |
| C14 | C40 | C46 | H40 | 124.9° | 112.5° |
| C14 | C40 | C41 | C42 | 45.0° | 140.1° |
| C14 | C40 | C41 | H41 | 75.0° | 97.2° |
| C14 | C40 | C41 | H41A | 165.0° | 18.1° |
| C14 | C40 | C46 | C47 | 144.0° | 158.7° |
| C14 | C40 | C46 | C48 | 90.9° | 76.5° |
| C15 | C16 | N17 | C35 | 178.7° | 177.3° |
| C15 | C16 | N17 | C18 | 176.7° | 172.1° |
| C15 | C16 | C35 | C29 | 161.8° | 160.7° |
| C15 | C16 | C35 | C36 | 71.1° | 74.5° |
| C15 | C16 | C35 | H35 | 40.7° | 44.8° |
| H15 | C15 | C16 | N17 | 166.5° | 168.1° |
| H15 | C15 | C16 | C35 | 12.2° | 14.9° |
| C16 | N17 | C18 | C19 | 176.3° | 179.7° |
| C16 | N17 | C18 | C29 | 14.6° | 6.2° |
| N17 | C16 | C35 | C29 | 19.4° | 21.9° |
| N17 | C16 | C35 | C36 | 107.7° | 102.9° |
| N17 | C16 | C35 | H35 | 140.5° | 137.9° |
| C35 | C16 | N17 | C18 | 4.5° | 10.6° |
| C16 | C35 | C29 | C18 | 24.4° | 22.9° |
| C16 | C35 | C29 | C30 | 99.2° | 100.6° |
| C16 | C35 | C29 | C36 | 125.1° | 122.2° |
| C16 | C35 | C29 | H35 | 123.3° | 115.6° |
| C16 | C35 | C29 | H29 | 148.0° | 136.5° |
| C16 | C35 | C36 | H35 | 122.5° | 120.8° |
| C16 | C35 | C36 | C37 | 176.9° | 86.0° |
| C16 | C35 | C36 | H36 | 56.9° | 152.3° |
| C16 | C35 | C36 | H36A | 63.1° | 35.3° |
| N17 | C18 | C19 | C29 | 160.9° | 172.7° |
| N17 | C18 | C19 | C20 | 19.1° | 16.4° |
| N17 | C18 | C19 | C27 | 175.1° | 155.6° |
| N17 | C18 | C29 | C30 | 100.1° | 106.8° |
| N17 | C18 | C29 | C35 | 26.0° | 19.4° |
| N17 | C18 | C29 | H29 | 146.9° | 133.4° |
| C18 | C19 | C20 | C27 | 166.1° | 172.6° |
| C18 | C19 | C20 | N21 | 43.0° | 17.3° |
| C18 | C19 | C20 | C22 | 172.6° | 156.2° |
| C18 | C19 | C27 | C24 | 161.5° | 158.8° |
| C18 | C19 | C27 | O28 | 18.1° | 17.7° |
| C19 | C18 | C29 | C30 | 61.8° | 66.8° |
| C19 | C18 | C29 | C35 | 172.0° | 167.0° |
| C19 | C18 | C29 | H29 | 51.1° | 53.0° |
| C29 | C18 | C19 | C20 | 141.8° | 156.3° |
| C29 | C18 | C19 | C27 | 24.0° | 31.7° |
| C18 | C29 | C30 | C35 | 116.7° | 117.7° |
| C18 | C29 | C30 | H29 | 123.0° | 119.5° |
| C18 | C29 | C35 | H29 | 123.6° | 113.6° |
| C18 | C29 | C30 | C31 | 174.0° | 158.0° |
| C18 | C29 | C30 | H30 | 54.0° | 79.8° |
| C18 | C29 | C30 | H30A | 65.9° | 36.3° |
| C18 | C29 | C35 | C36 | 100.7° | 99.2° |
| C18 | C29 | C35 | H35 | 147.7° | 138.5° |
| C19 | C20 | N21 | C22 | 149.0° | 173.9° |
| C19 | C20 | C22 | C23 | 16.0° | 42.0° |
| C19 | C20 | C22 | H22 | 97.6° | 77.1° |
| C20 | C19 | C27 | C24 | 4.9° | 29.0° |
| C20 | C19 | C27 | O28 | 175.5° | 154.6° |
| C27 | C19 | C20 | N21 | 150.9° | 155.4° |
| C27 | C19 | C20 | C22 | 6.5° | 31.1° |
| C19 | C27 | C24 | C23 | 40.3° | 37.0° |
| C19 | C27 | C24 | S25 | 163.2° | 158.1° |
| C19 | C27 | C24 | O28 | 179.6° | 176.6° |
| C19 | C27 | C24 | H24 | 76.2° | 82.8° |
| N21 | C20 | C22 | C23 | 131.1° | 143.7° |
| N21 | C20 | C22 | H22 | 115.3° | 97.2° |
| C20 | C22 | C23 | H22 | 121.7° | 118.2° |
| C20 | C22 | C23 | C24 | 48.0° | 47.9° |
| C20 | C22 | C23 | H23 | 72.0° | 168.9° |
| C20 | C22 | C23 | H23A | 168.0° | 73.1° |
| C22 | C23 | C24 | H23 | 120.0° | 121.3° |
| C22 | C23 | C24 | H23A | 120.0° | 121.5° |
| C22 | C23 | H23 | H23A | 120.5° | 119.2° |
| C22 | C23 | C24 | S25 | 176.6° | 168.3° |
| C22 | C23 | C24 | C27 | 61.6° | 45.4° |
| C22 | C23 | C24 | H24 | 56.0° | 74.3° |
| H22 | C22 | C23 | C24 | 73.7° | 70.3° |
| H22 | C22 | C23 | H23 | 166.3° | 50.7° |
| H22 | C22 | C23 | H23A | 46.3° | 168.7° |
| C24 | C23 | H23 | H23A | 120.5° | 117.9° |
| C23 | C24 | S25 | C27 | 125.3° | 123.3° |
| C23 | C24 | S25 | H24 | 116.8° | 117.5° |
| C23 | C24 | C27 | H24 | 116.5° | 119.8° |
| C23 | C24 | S25 | C26 | 58.1° | 89.4° |
| C23 | C24 | C27 | O28 | 140.1° | 146.4° |
| H23 | C23 | C24 | S25 | 63.4° | 70.5° |
| H23 | C23 | C24 | C27 | 58.4° | 166.7° |
| H23 | C23 | C24 | H24 | 176.0° | 46.9° |
| H23A | C23 | C24 | S25 | 56.6° | 46.8° |
| H23A | C23 | C24 | C27 | 178.4° | 76.1° |
| H23A | C23 | C24 | H24 | 64.0° | 164.2° |
| S25 | C24 | C27 | H24 | 120.6° | 119.1° |
| C24 | S25 | C26 | H26 | 180.0° | 180.0° |
| C24 | S25 | C26 | H26A | 60.0° | 60.0° |
| C24 | S25 | C26 | H26B | 60.0° | 60.0° |
| S25 | C24 | C27 | O28 | 17.2° | 25.3° |
| C27 | C24 | S25 | C26 | 176.6° | 147.3° |
| H24 | C24 | S25 | C26 | 58.6° | 28.1° |
| H24 | C24 | C27 | O28 | 103.4° | 93.8° |
| S25 | C26 | H26 | H26A | 120.0° | 120.0° |
| S25 | C26 | H26 | H26B | 120.0° | 120.0° |
| S25 | C26 | H26A | H26B | 120.0° | 120.0° |
| H26 | C26 | H26A | H26B | 120.0° | 120.0° |
| C30 | C29 | C35 | H29 | 112.8° | 122.8° |
| C29 | C30 | C31 | H30 | 120.0° | 122.4° |
| C29 | C30 | C31 | H30A | 120.0° | 121.8° |
| C29 | C30 | H30 | H30A | 116.5° | 116.9° |
| C29 | C30 | C31 | C32 | 176.0° | 76.0° |
| C29 | C30 | C31 | H31 | 64.0° | 45.9° |
| C29 | C30 | C31 | H31A | 56.0° | 162.5° |
| C30 | C29 | C35 | C36 | 135.7° | 137.2° |
| C30 | C29 | C35 | H35 | 24.1° | 15.0° |
| C35 | C29 | C30 | C31 | 69.2° | 84.4° |
| C35 | C29 | C30 | H30 | 170.7° | 37.9° |
| C35 | C29 | C30 | H30A | 50.8° | 154.0° |
| C29 | C35 | C36 | H35 | 120.1° | 123.8° |
| C29 | C35 | C36 | C37 | 65.7° | 158.6° |
| C29 | C35 | C36 | H36 | 174.3° | 36.9° |
| C29 | C35 | C36 | H36A | 54.4° | 80.1° |
| H29 | C29 | C30 | C31 | 51.0° | 38.5° |
| H29 | C29 | C30 | H30 | 69.0° | 160.7° |
| H29 | C29 | C30 | H30A | 171.0° | 83.2° |
| H29 | C29 | C35 | C36 | 22.9° | 14.4° |
| H29 | C29 | C35 | H35 | 88.7° | 107.8° |
| C31 | C30 | H30 | H30A | 116.5° | 116.5° |
| C30 | C31 | C32 | H31 | 120.0° | 122.4° |
| C30 | C31 | C32 | H31A | 120.0° | 121.6° |
| C30 | C31 | H31 | H31A | 117.6° | 117.5° |
| C30 | C31 | C32 | O33 | 0.0° | 83.3° |
| C30 | C31 | C32 | O34 | 179.3° | 96.7° |
| H30 | C30 | C31 | C32 | 56.0° | 161.6° |
| H30 | C30 | C31 | H31 | 176.0° | 76.5° |
| H30 | C30 | C31 | H31A | 64.0° | 40.1° |
| H30A | C30 | C31 | C32 | 63.9° | 45.7° |
| H30A | C30 | C31 | H31 | 56.1° | 167.7° |
| H30A | C30 | C31 | H31A | 176.0° | 75.7° |
| C32 | C31 | H31 | H31A | 117.6° | 116.8° |
| C31 | C32 | O33 | O34 | 179.3° | 180.0° |
| C31 | C32 | O33 | H50 | 179.3° | 180.0° |
| H31 | C31 | C32 | O33 | 120.0° | 154.3° |
| H31 | C31 | C32 | O34 | 60.7° | 25.7° |
| H31A | C31 | C32 | O33 | 120.0° | 38.3° |
| H31A | C31 | C32 | O34 | 59.3° | 141.7° |
| O34 | C32 | O33 | H50 | 0.0° | 0.0° |
| C35 | C36 | C37 | H36 | 120.0° | 122.1° |
| C35 | C36 | C37 | H36A | 120.0° | 121.5° |
| C35 | C36 | H36 | H36A | 118.7° | 117.8° |
| C35 | C36 | C37 | O38 | 60.2° | 92.9° |
| C35 | C36 | C37 | O39 | 116.6° | 87.2° |
| H35 | C35 | C36 | C37 | 54.4° | 34.7° |
| H35 | C35 | C36 | H36 | 65.6° | 86.9° |
| H35 | C35 | C36 | H36A | 174.5° | 156.1° |
| C37 | C36 | H36 | H36A | 118.7° | 117.0° |
| C36 | C37 | O38 | O39 | 176.8° | 180.0° |
| C36 | C37 | O39 | H51 | 176.6° | 180.0° |
| H36 | C36 | C37 | O38 | 59.9° | 145.1° |
| H36 | C36 | C37 | O39 | 123.4° | 34.9° |
| H36A | C36 | C37 | O38 | 179.8° | 28.7° |
| H36A | C36 | C37 | O39 | 3.4° | 151.3° |
| O38 | C37 | O39 | H51 | 0.0° | 0.0° |
| C41 | C40 | C46 | H40 | 113.6° | 125.6° |
| C40 | C41 | C42 | H41 | 120.0° | 122.8° |
| C40 | C41 | C42 | H41A | 120.0° | 122.4° |
| C40 | C41 | H41 | H41A | 117.7° | 116.8° |
| C40 | C41 | C42 | C43 | 165.2° | 170.7° |
| C40 | C41 | C42 | H42 | 45.2° | 68.1° |
| C40 | C41 | C42 | H42A | 74.8° | 49.1° |
| C41 | C40 | C46 | C47 | 22.5° | 36.8° |
| C41 | C40 | C46 | C48 | 147.6° | 161.6° |
| C46 | C40 | C41 | C42 | 163.7° | 102.6° |
| C46 | C40 | C41 | H41 | 43.7° | 20.1° |
| C46 | C40 | C41 | H41A | 76.3° | 135.4° |
| C40 | C46 | C47 | C48 | 130.0° | 127.9° |
| C40 | C46 | C47 | H47 | 64.7° | 62.1° |
| C40 | C46 | C47 | H47A | 55.3° | 177.2° |
| C40 | C46 | C47 | H47B | 175.3° | 57.8° |
| C40 | C46 | C48 | C49 | 137.2° | 133.8° |
| C40 | C46 | C48 | H48 | 17.1° | 106.7° |
| C40 | C46 | C48 | H48A | 102.8° | 14.5° |
| H40 | C40 | C41 | C42 | 79.7° | 23.2° |
| H40 | C40 | C41 | H41 | 160.3° | 145.9° |
| H40 | C40 | C41 | H41A | 40.4° | 98.8° |
| H40 | C40 | C46 | C47 | 91.1° | 88.8° |
| H40 | C40 | C46 | C48 | 34.0° | 35.9° |
| C42 | C41 | H41 | H41A | 117.7° | 115.7° |
| C41 | C42 | C43 | H42 | 120.0° | 121.4° |
| C41 | C42 | C43 | H42A | 120.0° | 121.8° |
| C41 | C42 | H42 | H42A | 117.8° | 118.3° |
| C41 | C42 | C43 | O44 | 136.8° | 86.1° |
| C41 | C42 | C43 | O45 | 42.5° | 93.9° |
| H41 | C41 | C42 | C43 | 74.8° | 47.9° |
| H41 | C41 | C42 | H42 | 165.2° | 169.1° |
| H41 | C41 | C42 | H42A | 45.2° | 73.7° |
| H41A | C41 | C42 | C43 | 45.2° | 66.9° |
| H41A | C41 | C42 | H42 | 74.8° | 54.3° |
| H41A | C41 | C42 | H42A | 165.2° | 171.6° |
| C43 | C42 | H42 | H42A | 117.8° | 117.5° |
| C42 | C43 | O44 | O45 | 179.3° | 180.0° |
| C42 | C43 | O45 | H521 | 179.3° | 179.9° |
| H42 | C42 | C43 | O44 | 103.2° | 35.3° |
| H42 | C42 | C43 | O45 | 77.6° | 144.7° |
| H42A | C42 | C43 | O44 | 16.8° | 152.1° |
| H42A | C42 | C43 | O45 | 162.5° | 28.0° |
| O44 | C43 | O45 | H521 | 0.0° | 0.1° |
| C46 | C47 | H47 | H47A | 120.0° | 121.2° |
| C46 | C47 | H47 | H47B | 120.0° | 121.2° |
| C46 | C47 | H47A | H47B | 120.0° | 121.0° |
| C47 | C46 | C48 | C49 | 98.4° | 98.2° |
| C47 | C46 | C48 | H48 | 141.6° | 21.4° |
| C47 | C46 | C48 | H48A | 21.6° | 142.6° |
| C48 | C46 | C47 | H47 | 65.4° | 65.8° |
| C48 | C46 | C47 | H47A | 174.6° | 54.9° |
| C48 | C46 | C47 | H47B | 54.6° | 174.3° |
| C46 | C48 | C49 | H48 | 120.0° | 120.1° |
| C46 | C48 | C49 | H48A | 120.0° | 120.0° |
| C46 | C48 | H48 | H48A | 122.4° | 123.0° |
| C46 | C48 | C49 | O50 | 162.0° | 160.4° |
| C46 | C48 | C49 | N51 | 16.9° | 22.0° |
| H47 | C47 | H47A | H47B | 120.0° | 117.9° |
| C49 | C48 | H48 | H48A | 122.4° | 121.0° |
| C48 | C49 | O50 | N51 | 178.8° | 177.2° |
| C48 | C49 | N51 | HN51 | 178.6° | 169.0° |
| H48 | C48 | C49 | O50 | 78.0° | 40.3° |
| H48 | C48 | C49 | N51 | 103.1° | 142.2° |
| H48A | C48 | C49 | O50 | 41.9° | 79.5° |
| H48A | C48 | C49 | N51 | 136.9° | 98.0° |
| O50 | C49 | N51 | HN51 | 0.2° | 8.6° |
| C53 | C52 | C58 | H52 | 104.8° | 120.3° |
| C52 | C53 | C54 | H53 | 120.0° | 122.1° |
| C52 | C53 | C54 | H53A | 120.0° | 122.9° |
| C52 | C53 | H53 | H53A | 117.2° | 117.4° |
| C52 | C53 | C54 | C55 | 138.9° | 170.7° |
| C52 | C53 | C54 | H54 | 101.1° | 49.2° |
| C52 | C53 | C54 | H54A | 18.9° | 67.7° |
| C53 | C52 | C58 | C59 | 15.6° | 16.1° |
| C53 | C52 | C58 | C60 | 147.8° | 140.6° |
| C58 | C52 | C53 | C54 | 69.0° | 143.1° |
| C58 | C52 | C53 | H53 | 171.0° | 21.9° |
| C58 | C52 | C53 | H53A | 51.0° | 94.1° |
| C52 | C58 | C59 | C60 | 113.6° | 126.4° |
| C52 | C58 | C59 | H59 | 82.3° | 177.3° |
| C52 | C58 | C59 | H59A | 37.7° | 63.2° |
| C52 | C58 | C59 | H59B | 157.7° | 57.0° |
| C52 | C58 | C60 | C61 | 79.8° | 159.9° |
| C52 | C58 | C60 | H60 | 160.2° | 77.5° |
| C52 | C58 | C60 | H60A | 40.2° | 37.3° |
| H52 | C52 | C53 | C54 | 40.3° | 22.5° |
| H52 | C52 | C53 | H53 | 79.7° | 98.7° |
| H52 | C52 | C53 | H53A | 160.3° | 145.2° |
| H52 | C52 | C58 | C59 | 89.2° | 104.1° |
| H52 | C52 | C58 | C60 | 43.0° | 20.3° |
| C54 | C53 | H53 | H53A | 117.2° | 116.1° |
| C53 | C54 | C55 | H54 | 120.0° | 122.0° |
| C53 | C54 | C55 | H54A | 120.0° | 121.7° |
| C53 | C54 | H54 | H54A | 117.8° | 117.7° |
| C53 | C54 | C55 | O56 | 61.7° | 98.7° |
| C53 | C54 | C55 | O57 | 118.6° | 81.4° |
| H53 | C53 | C54 | C55 | 18.9° | 67.2° |
| H53 | C53 | C54 | H54 | 138.8° | 171.3° |
| H53 | C53 | C54 | H54A | 101.1° | 54.4° |
| H53A | C53 | C54 | C55 | 101.1° | 47.8° |
| H53A | C53 | C54 | H54 | 18.8° | 73.8° |
| H53A | C53 | C54 | H54A | 138.9° | 169.3° |
| C55 | C54 | H54 | H54A | 117.8° | 116.9° |
| C54 | C55 | O56 | O57 | 179.6° | 179.9° |
| C54 | C55 | O57 | H531 | 179.6° | 180.0° |
| H54 | C54 | C55 | O56 | 58.2° | 23.3° |
| H54 | C54 | C55 | O57 | 121.4° | 156.6° |
| H54A | C54 | C55 | O56 | 178.3° | 139.6° |
| H54A | C54 | C55 | O57 | 1.3° | 40.3° |
| O56 | C55 | O57 | H531 | 0.0° | 0.2° |
| C58 | C59 | H59 | H59A | 120.0° | 120.1° |
| C58 | C59 | H59 | H59B | 120.0° | 120.5° |
| C58 | C59 | H59A | H59B | 120.0° | 120.3° |
| C59 | C58 | C60 | C61 | 34.7° | 71.9° |
| C59 | C58 | C60 | H60 | 85.3° | 50.8° |
| C59 | C58 | C60 | H60A | 154.7° | 165.5° |
| C60 | C58 | C59 | H59 | 31.4° | 50.9° |
| C60 | C58 | C59 | H59A | 151.4° | 170.4° |
| C60 | C58 | C59 | H59B | 88.6° | 69.4° |
| C58 | C60 | C61 | H60 | 120.0° | 122.9° |
| C58 | C60 | C61 | H60A | 120.0° | 123.3° |
| C58 | C60 | H60 | H60A | 117.9° | 116.2° |
| C58 | C60 | C61 | N62 | 117.4° | 91.0° |
| C58 | C60 | C61 | O63 | 63.1° | 89.9° |
| H59 | C59 | H59A | H59B | 120.0° | 119.3° |
| C61 | C60 | H60 | H60A | 117.9° | 114.3° |
| C60 | C61 | N62 | O63 | 179.5° | 179.2° |
| C60 | C61 | N62 | HN62 | 179.5° | 179.7° |
| C60 | C61 | N62 | HN6A | 0.5° | 0.6° |
| H60 | C60 | C61 | N62 | 122.6° | 146.1° |
| H60 | C60 | C61 | O63 | 56.9° | 33.1° |
| H60A | C60 | C61 | N62 | 2.6° | 32.3° |
| H60A | C60 | C61 | O63 | 176.9° | 146.9° |
| C61 | N62 | HN62 | HN6A | 180.0° | 179.7° |
| O63 | C61 | N62 | HN62 | 0.0° | 0.5° |
| O63 | C61 | N62 | HN6A | 180.0° | 179.8° |
