6NC
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C42 | C43 | sing | 1.53Å | 1.52Å | |
| C01 | C02 | sing | 1.53Å | 1.55Å | |
| N62 | C63 | sing | 1.36Å | 1.30Å | Aromatic |
| N62 | C61 | sing | 1.38Å | 1.38Å | Aromatic |
| C43 | C44 | sing | 1.53Å | 1.54Å | |
| N21 | C20 | sing | 1.38Å | 1.36Å | Aromatic |
| N21 | C22 | sing | 1.36Å | 1.35Å | Aromatic |
| N26 | C20 | doub | 1.33Å | 1.38Å | Aromatic |
| N26 | C25 | sing | 1.31Å | 1.34Å | Aromatic |
| C44 | S45 | sing | 1.81Å | 1.83Å | |
| C63 | C58 | doub | 1.36Å | 1.40Å | Aromatic |
| N67 | C61 | doub | 1.33Å | 1.36Å | Aromatic |
| N67 | C66 | sing | 1.32Å | 1.32Å | Aromatic |
| C61 | C60 | sing | 1.41Å | 1.35Å | Aromatic |
| C02 | C03 | sing | 1.53Å | 1.56Å | |
| C20 | C19 | sing | 1.41Å | 1.38Å | Aromatic |
| C22 | C17 | doub | 1.36Å | 1.38Å | Aromatic |
| C51 | C50 | doub | 1.38Å | 1.41Å | Aromatic |
| C51 | C52 | sing | 1.38Å | 1.40Å | Aromatic |
| C25 | C24 | doub | 1.40Å | 1.42Å | Aromatic |
| F56 | C52 | sing | 1.35Å | 1.37Å | |
| C66 | C65 | doub | 1.40Å | 1.38Å | Aromatic |
| C03 | S04 | sing | 1.81Å | 1.82Å | |
| C50 | C49 | sing | 1.39Å | 1.38Å | Aromatic |
| C52 | C53 | doub | 1.40Å | 1.37Å | Aromatic |
| C58 | C60 | sing | 1.47Å | 1.42Å | Aromatic |
| C58 | C57 | sing | 1.47Å | 1.57Å | |
| C60 | C64 | doub | 1.39Å | 1.43Å | Aromatic |
| C19 | C17 | sing | 1.47Å | 1.45Å | Aromatic |
| C19 | C23 | doub | 1.39Å | 1.45Å | Aromatic |
| C17 | C16 | sing | 1.47Å | 1.51Å | |
| F15 | C11 | sing | 1.35Å | 1.33Å | |
| S45 | O47 | doub | 1.42Å | 1.48Å | |
| S45 | N46 | sing | 1.66Å | 1.68Å | |
| S45 | O48 | doub | 1.42Å | 1.47Å | |
| C49 | C54 | doub | 1.39Å | 1.37Å | Aromatic |
| C49 | N46 | sing | 1.40Å | 1.43Å | |
| C53 | C54 | sing | 1.40Å | 1.40Å | Aromatic |
| C53 | C57 | sing | 1.48Å | 1.53Å | |
| C10 | C11 | doub | 1.38Å | 1.40Å | Aromatic |
| C10 | C09 | sing | 1.38Å | 1.39Å | Aromatic |
| C11 | C12 | sing | 1.40Å | 1.41Å | Aromatic |
| C24 | C23 | sing | 1.40Å | 1.39Å | Aromatic |
| C24 | C27 | sing | 1.48Å | 1.54Å | |
| C65 | C64 | sing | 1.39Å | 1.40Å | Aromatic |
| C65 | C68 | sing | 1.48Å | 1.51Å | |
| C54 | F55 | sing | 1.35Å | 1.36Å | |
| C09 | C08 | doub | 1.39Å | 1.39Å | Aromatic |
| C57 | O59 | doub | 1.22Å | 1.18Å | |
| C12 | C16 | sing | 1.48Å | 1.54Å | |
| C12 | C13 | doub | 1.40Å | 1.38Å | Aromatic |
| C32 | C27 | doub | 1.39Å | 1.36Å | Aromatic |
| C32 | C31 | sing | 1.38Å | 1.37Å | Aromatic |
| S04 | N05 | sing | 1.66Å | 1.68Å | |
| S04 | O06 | doub | 1.42Å | 1.45Å | |
| S04 | O07 | doub | 1.42Å | 1.46Å | |
| C08 | C13 | sing | 1.39Å | 1.40Å | Aromatic |
| C08 | N05 | sing | 1.40Å | 1.45Å | |
| C16 | O18 | doub | 1.22Å | 1.19Å | |
| C73 | C68 | doub | 1.39Å | 1.40Å | Aromatic |
| C73 | C72 | sing | 1.38Å | 1.39Å | Aromatic |
| C13 | F14 | sing | 1.35Å | 1.34Å | |
| C27 | C28 | sing | 1.39Å | 1.42Å | Aromatic |
| C68 | C69 | sing | 1.39Å | 1.40Å | Aromatic |
| C31 | C30 | doub | 1.38Å | 1.42Å | Aromatic |
| C72 | C71 | doub | 1.38Å | 1.40Å | Aromatic |
| C28 | C29 | doub | 1.38Å | 1.37Å | Aromatic |
| O74 | C35 | doub | 1.21Å | 1.19Å | |
| C69 | C70 | doub | 1.38Å | 1.38Å | Aromatic |
| O37 | C36 | sing | 1.43Å | 1.42Å | |
| O37 | C38 | sing | 1.43Å | 1.44Å | |
| C30 | C29 | sing | 1.38Å | 1.36Å | Aromatic |
| C30 | C33 | sing | 1.51Å | 1.54Å | |
| O75 | C39 | doub | 1.21Å | 1.18Å | |
| C71 | C70 | sing | 1.38Å | 1.41Å | Aromatic |
| C71 | C41 | sing | 1.51Å | 1.57Å | |
| C35 | C36 | sing | 1.51Å | 1.51Å | |
| C35 | N34 | sing | 1.35Å | 1.46Å | |
| C38 | C39 | sing | 1.51Å | 1.56Å | |
| C39 | N40 | sing | 1.35Å | 1.46Å | |
| C33 | N34 | sing | 1.47Å | 1.48Å | |
| N40 | C41 | sing | 1.47Å | 1.46Å | |
| C10 | H101 | sing | 1.08Å | 1.08Å | |
| C22 | H221 | sing | 1.08Å | 1.08Å | |
| C28 | H281 | sing | 1.08Å | 1.08Å | |
| C01 | H012 | sing | 1.09Å | 1.10Å | |
| C01 | H011 | sing | 1.09Å | 1.10Å | |
| C01 | H013 | sing | 1.09Å | 1.10Å | |
| C02 | H021 | sing | 1.09Å | 1.10Å | |
| C02 | H022 | sing | 1.09Å | 1.10Å | |
| C03 | H032 | sing | 1.09Å | 1.10Å | |
| C03 | H031 | sing | 1.09Å | 1.10Å | |
| N05 | H051 | sing | 0.97Å | 1.00Å | |
| C09 | H091 | sing | 1.08Å | 1.08Å | |
| N21 | H1 | sing | 0.97Å | 1.00Å | |
| C23 | H231 | sing | 1.08Å | 1.08Å | |
| C25 | H251 | sing | 1.08Å | 1.08Å | |
| C29 | H291 | sing | 1.08Å | 1.08Å | |
| C31 | H311 | sing | 1.08Å | 1.08Å | |
| C32 | H321 | sing | 1.08Å | 1.08Å | |
| C33 | H332 | sing | 1.09Å | 1.10Å | |
| C33 | H331 | sing | 1.09Å | 1.10Å | |
| N34 | H341 | sing | 0.97Å | 1.00Å | |
| C36 | H361 | sing | 1.09Å | 1.10Å | |
| C36 | H362 | sing | 1.09Å | 1.10Å | |
| C38 | H382 | sing | 1.09Å | 1.10Å | |
| C38 | H381 | sing | 1.09Å | 1.10Å | |
| N40 | H401 | sing | 0.97Å | 1.00Å | |
| C41 | H411 | sing | 1.09Å | 1.10Å | |
| C41 | H412 | sing | 1.09Å | 1.10Å | |
| C42 | H421 | sing | 1.09Å | 1.10Å | |
| C42 | H423 | sing | 1.09Å | 1.10Å | |
| C42 | H422 | sing | 1.09Å | 1.10Å | |
| C43 | H431 | sing | 1.09Å | 1.10Å | |
| C43 | H432 | sing | 1.09Å | 1.10Å | |
| C44 | H442 | sing | 1.09Å | 1.10Å | |
| C44 | H441 | sing | 1.09Å | 1.10Å | |
| N46 | H461 | sing | 0.97Å | 1.00Å | |
| C50 | H501 | sing | 1.08Å | 1.08Å | |
| C51 | H511 | sing | 1.08Å | 1.08Å | |
| N62 | H2 | sing | 0.97Å | 1.00Å | |
| C63 | H631 | sing | 1.08Å | 1.08Å | |
| C64 | H641 | sing | 1.08Å | 1.08Å | |
| C66 | H661 | sing | 1.08Å | 1.08Å | |
| C69 | H691 | sing | 1.08Å | 1.08Å | |
| C70 | H701 | sing | 1.08Å | 1.08Å | |
| C72 | H721 | sing | 1.08Å | 1.08Å | |
| C73 | H731 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C42 | C43 | C44 | 112.0° | 109.5° |
| C43 | C42 | H421 | 109.5° | 109.5° |
| C43 | C42 | H423 | 109.5° | 109.5° |
| C43 | C42 | H422 | 109.5° | 109.5° |
| C42 | C43 | H431 | 108.8° | 109.5° |
| C42 | C43 | H432 | 108.8° | 109.5° |
| C01 | C02 | C03 | 110.5° | 109.5° |
| C02 | C01 | H012 | 109.5° | 109.4° |
| C02 | C01 | H011 | 109.4° | 109.5° |
| C02 | C01 | H013 | 109.5° | 109.5° |
| C01 | C02 | H021 | 109.2° | 109.5° |
| C01 | C02 | H022 | 109.2° | 109.5° |
| C63 | N62 | C61 | 108.9° | 110.6° |
| N62 | C63 | C58 | 109.1° | 109.8° |
| C63 | N62 | H2 | 125.5° | 124.7° |
| N62 | C63 | H631 | 125.4° | 125.1° |
| N62 | C61 | N67 | 130.2° | 132.7° |
| N62 | C61 | C60 | 109.7° | 107.3° |
| C61 | N62 | H2 | 125.5° | 124.7° |
| C43 | C44 | S45 | 111.8° | 109.5° |
| C44 | C43 | H431 | 108.8° | 109.5° |
| C44 | C43 | H432 | 108.8° | 109.4° |
| C43 | C44 | H442 | 108.9° | 109.4° |
| C43 | C44 | H441 | 108.9° | 109.4° |
| C20 | N21 | C22 | 110.2° | 110.6° |
| N21 | C20 | N26 | 129.8° | 132.7° |
| N21 | C20 | C19 | 109.1° | 107.3° |
| C20 | N21 | H1 | 124.9° | 124.7° |
| N21 | C22 | C17 | 108.2° | 109.8° |
| N21 | C22 | H221 | 125.9° | 125.1° |
| C22 | N21 | H1 | 124.9° | 124.7° |
| C20 | N26 | C25 | 121.1° | 121.8° |
| N26 | C20 | C19 | 121.2° | 120.0° |
| N26 | C25 | C24 | 120.7° | 121.4° |
| N26 | C25 | H251 | 119.7° | 119.3° |
| C44 | S45 | O47 | 107.7° | 110.5° |
| C44 | S45 | N46 | 113.8° | 104.5° |
| C44 | S45 | O48 | 113.0° | 110.5° |
| S45 | C44 | H442 | 108.9° | 109.5° |
| S45 | C44 | H441 | 108.9° | 109.5° |
| C63 | C58 | C60 | 106.5° | 106.4° |
| C63 | C58 | C57 | 127.1° | 126.8° |
| C58 | C63 | H631 | 125.4° | 125.1° |
| C61 | N67 | C66 | 121.3° | 121.9° |
| N67 | C61 | C60 | 120.1° | 120.0° |
| N67 | C66 | C65 | 121.5° | 121.4° |
| N67 | C66 | H661 | 119.2° | 119.3° |
| C61 | C60 | C58 | 105.8° | 106.0° |
| C61 | C60 | C64 | 120.9° | 119.7° |
| C02 | C03 | S04 | 115.4° | 109.5° |
| C03 | C02 | H021 | 109.2° | 109.4° |
| C03 | C02 | H022 | 109.2° | 109.4° |
| C02 | C03 | H032 | 108.0° | 109.4° |
| C02 | C03 | H031 | 108.0° | 109.4° |
| C20 | C19 | C17 | 105.0° | 106.1° |
| C20 | C19 | C23 | 119.0° | 119.8° |
| C22 | C17 | C19 | 107.5° | 106.3° |
| C22 | C17 | C16 | 123.4° | 126.8° |
| C17 | C22 | H221 | 125.9° | 125.2° |
| C50 | C51 | C52 | 119.5° | 120.2° |
| C51 | C50 | C49 | 118.8° | 120.3° |
| C51 | C50 | H501 | 120.6° | 119.8° |
| C50 | C51 | H511 | 120.3° | 119.9° |
| C51 | C52 | F56 | 120.0° | 120.0° |
| C51 | C52 | C53 | 120.5° | 120.0° |
| C52 | C51 | H511 | 120.2° | 119.9° |
| C25 | C24 | C23 | 119.8° | 119.1° |
| C25 | C24 | C27 | 120.7° | 120.4° |
| C24 | C25 | H251 | 119.6° | 119.3° |
| F56 | C52 | C53 | 119.5° | 120.0° |
| C66 | C65 | C64 | 120.1° | 119.1° |
| C66 | C65 | C68 | 118.3° | 120.5° |
| C65 | C66 | H661 | 119.2° | 119.3° |
| C03 | S04 | N05 | 103.9° | 104.4° |
| C03 | S04 | O06 | 118.9° | 110.5° |
| C03 | S04 | O07 | 112.3° | 110.6° |
| S04 | C03 | H032 | 108.0° | 109.5° |
| S04 | C03 | H031 | 108.0° | 109.5° |
| C50 | C49 | C54 | 121.7° | 120.1° |
| C50 | C49 | N46 | 122.4° | 120.0° |
| C49 | C50 | H501 | 120.6° | 119.9° |
| C52 | C53 | C54 | 119.9° | 119.7° |
| C52 | C53 | C57 | 121.4° | 120.1° |
| C60 | C58 | C57 | 126.4° | 126.8° |
| C58 | C60 | C64 | 133.3° | 134.3° |
| C58 | C57 | C53 | 116.6° | 120.0° |
| C58 | C57 | O59 | 121.5° | 120.0° |
| C60 | C64 | C65 | 116.1° | 118.0° |
| C60 | C64 | H641 | 122.0° | 121.0° |
| C17 | C19 | C23 | 136.0° | 134.2° |
| C19 | C17 | C16 | 129.2° | 126.9° |
| C19 | C23 | C24 | 118.3° | 117.9° |
| C19 | C23 | H231 | 120.8° | 121.1° |
| C17 | C16 | C12 | 118.3° | 120.0° |
| C17 | C16 | O18 | 123.6° | 120.0° |
| F15 | C11 | C10 | 117.4° | 120.0° |
| F15 | C11 | C12 | 121.4° | 120.0° |
| O47 | S45 | N46 | 108.4° | 104.3° |
| O47 | S45 | O48 | 104.3° | 121.0° |
| N46 | S45 | O48 | 109.1° | 104.3° |
| S45 | N46 | C49 | 118.4° | 120.0° |
| S45 | N46 | H461 | 107.2° | 120.0° |
| C54 | C49 | N46 | 115.9° | 120.0° |
| C49 | C54 | C53 | 119.7° | 119.7° |
| C49 | C54 | F55 | 119.0° | 120.1° |
| C49 | N46 | H461 | 107.2° | 120.0° |
| C54 | C53 | C57 | 118.7° | 120.2° |
| C53 | C54 | F55 | 121.3° | 120.2° |
| C53 | C57 | O59 | 121.8° | 120.0° |
| C11 | C10 | C09 | 118.7° | 120.3° |
| C10 | C11 | C12 | 121.2° | 119.9° |
| C11 | C10 | H101 | 120.6° | 119.8° |
| C10 | C09 | C08 | 119.9° | 120.3° |
| C09 | C10 | H101 | 120.6° | 119.9° |
| C10 | C09 | H091 | 120.0° | 119.8° |
| C11 | C12 | C16 | 124.2° | 120.2° |
| C11 | C12 | C13 | 119.6° | 119.7° |
| C23 | C24 | C27 | 119.5° | 120.5° |
| C24 | C23 | H231 | 120.9° | 121.0° |
| C24 | C27 | C32 | 119.8° | 120.1° |
| C24 | C27 | C28 | 119.3° | 120.1° |
| C64 | C65 | C68 | 121.6° | 120.5° |
| C65 | C64 | H641 | 121.9° | 121.0° |
| C65 | C68 | C73 | 120.6° | 120.1° |
| C65 | C68 | C69 | 118.4° | 120.1° |
| C09 | C08 | C13 | 121.4° | 120.0° |
| C09 | C08 | N05 | 121.6° | 120.0° |
| C08 | C09 | H091 | 120.0° | 119.9° |
| C16 | C12 | C13 | 116.2° | 120.1° |
| C12 | C16 | O18 | 118.0° | 120.0° |
| C12 | C13 | C08 | 119.2° | 119.7° |
| C12 | C13 | F14 | 120.2° | 120.1° |
| C27 | C32 | C31 | 119.4° | 119.9° |
| C32 | C27 | C28 | 120.8° | 119.8° |
| C27 | C32 | H321 | 120.3° | 120.1° |
| C32 | C31 | C30 | 120.3° | 120.1° |
| C32 | C31 | H311 | 119.9° | 119.9° |
| C31 | C32 | H321 | 120.3° | 120.0° |
| N05 | S04 | O06 | 110.2° | 104.2° |
| N05 | S04 | O07 | 108.6° | 104.3° |
| S04 | N05 | C08 | 117.7° | 120.0° |
| S04 | N05 | H051 | 107.4° | 120.0° |
| O06 | S04 | O07 | 102.7° | 121.0° |
| C13 | C08 | N05 | 117.0° | 120.0° |
| C08 | C13 | F14 | 120.6° | 120.1° |
| C08 | N05 | H051 | 107.4° | 120.1° |
| C68 | C73 | C72 | 118.9° | 119.9° |
| C73 | C68 | C69 | 121.0° | 119.8° |
| C68 | C73 | H731 | 120.5° | 120.1° |
| C73 | C72 | C71 | 120.4° | 120.1° |
| C73 | C72 | H721 | 119.8° | 119.9° |
| C72 | C73 | H731 | 120.5° | 120.1° |
| C27 | C28 | C29 | 119.6° | 119.9° |
| C27 | C28 | H281 | 120.2° | 120.1° |
| C68 | C69 | C70 | 120.0° | 119.8° |
| C68 | C69 | H691 | 120.0° | 120.1° |
| C31 | C30 | C29 | 119.6° | 120.2° |
| C31 | C30 | C33 | 120.8° | 119.9° |
| C30 | C31 | H311 | 119.9° | 119.9° |
| C72 | C71 | C70 | 119.9° | 120.2° |
| C72 | C71 | C41 | 121.6° | 119.9° |
| C71 | C72 | H721 | 119.8° | 120.0° |
| C28 | C29 | C30 | 120.3° | 120.1° |
| C29 | C28 | H281 | 120.2° | 120.0° |
| C28 | C29 | H291 | 119.9° | 120.0° |
| O74 | C35 | C36 | 120.5° | 120.0° |
| O74 | C35 | N34 | 119.0° | 120.0° |
| C69 | C70 | C71 | 119.8° | 120.2° |
| C70 | C69 | H691 | 120.0° | 120.1° |
| C69 | C70 | H701 | 120.1° | 119.9° |
| C36 | O37 | C38 | 112.0° | 114.0° |
| O37 | C36 | C35 | 104.7° | 109.5° |
| O37 | C36 | H361 | 110.6° | 109.5° |
| O37 | C36 | H362 | 110.7° | 109.5° |
| O37 | C38 | C39 | 105.3° | 109.5° |
| O37 | C38 | H382 | 110.5° | 109.5° |
| O37 | C38 | H381 | 110.5° | 109.4° |
| C29 | C30 | C33 | 119.6° | 119.9° |
| C30 | C29 | H291 | 119.8° | 119.9° |
| C30 | C33 | N34 | 108.5° | 109.5° |
| C30 | C33 | H332 | 109.7° | 109.5° |
| C30 | C33 | H331 | 109.7° | 109.5° |
| O75 | C39 | C38 | 120.9° | 120.0° |
| O75 | C39 | N40 | 118.5° | 120.0° |
| C70 | C71 | C41 | 118.5° | 119.9° |
| C71 | C70 | H701 | 120.1° | 119.9° |
| C71 | C41 | N40 | 105.7° | 109.4° |
| C71 | C41 | H411 | 110.4° | 109.5° |
| C71 | C41 | H412 | 110.4° | 109.4° |
| C36 | C35 | N34 | 120.5° | 120.0° |
| C35 | C36 | H361 | 110.6° | 109.4° |
| C35 | C36 | H362 | 110.7° | 109.5° |
| C35 | N34 | C33 | 117.8° | 120.0° |
| C35 | N34 | H341 | 121.1° | 120.0° |
| C38 | C39 | N40 | 120.6° | 120.0° |
| C39 | C38 | H382 | 110.5° | 109.5° |
| C39 | C38 | H381 | 110.5° | 109.5° |
| C39 | N40 | C41 | 118.0° | 120.0° |
| C39 | N40 | H401 | 121.0° | 120.0° |
| N34 | C33 | H332 | 109.7° | 109.5° |
| N34 | C33 | H331 | 109.7° | 109.4° |
| C33 | N34 | H341 | 121.1° | 120.0° |
| C41 | N40 | H401 | 121.0° | 120.0° |
| N40 | C41 | H411 | 110.4° | 109.5° |
| N40 | C41 | H412 | 110.4° | 109.5° |
| H012 | C01 | H011 | 109.5° | 109.5° |
| H012 | C01 | H013 | 109.5° | 109.4° |
| H011 | C01 | H013 | 109.5° | 109.6° |
| H021 | C02 | H022 | 109.5° | 109.5° |
| H032 | C03 | H031 | 109.5° | 109.5° |
| H332 | C33 | H331 | 109.5° | 109.5° |
| H361 | C36 | H362 | 109.5° | 109.4° |
| H382 | C38 | H381 | 109.5° | 109.4° |
| H411 | C41 | H412 | 109.5° | 109.5° |
| H421 | C42 | H423 | 109.5° | 109.5° |
| H421 | C42 | H422 | 109.4° | 109.4° |
| H423 | C42 | H422 | 109.5° | 109.4° |
| H431 | C43 | H432 | 109.5° | 109.4° |
| H442 | C44 | H441 | 109.5° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C42 | C43 | C44 | H431 | 120.4° | 120.1° |
| C42 | C43 | C44 | H432 | 120.4° | 120.1° |
| C42 | C43 | C44 | S45 | 162.8° | 180.0° |
| C43 | C42 | H421 | H423 | 120.0° | 120.0° |
| C43 | C42 | H421 | H422 | 120.0° | 120.0° |
| C43 | C42 | H423 | H422 | 120.0° | 120.0° |
| C42 | C43 | H431 | H432 | 118.8° | 120.0° |
| C42 | C43 | C44 | H442 | 42.4° | 60.0° |
| C42 | C43 | C44 | H441 | 76.8° | 59.9° |
| C01 | C02 | C03 | H021 | 120.2° | 120.0° |
| C01 | C02 | C03 | H022 | 120.1° | 120.0° |
| C01 | C02 | C03 | S04 | 155.6° | 180.0° |
| C02 | C01 | H012 | H011 | 120.0° | 120.0° |
| C02 | C01 | H012 | H013 | 120.0° | 119.9° |
| C02 | C01 | H011 | H013 | 120.0° | 120.1° |
| C01 | C02 | H021 | H022 | 119.5° | 120.0° |
| C01 | C02 | C03 | H032 | 83.6° | 60.0° |
| C01 | C02 | C03 | H031 | 34.7° | 60.0° |
| C63 | N62 | C61 | H2 | 180.0° | 179.6° |
| N62 | C63 | C58 | H631 | 180.0° | 179.6° |
| C63 | N62 | C61 | N67 | 179.9° | 179.8° |
| C63 | N62 | C61 | C60 | 0.5° | 0.2° |
| N62 | C63 | C58 | C60 | 0.3° | 0.4° |
| N62 | C63 | C58 | C57 | 179.5° | 179.8° |
| C61 | N62 | C63 | C58 | 0.1° | 0.4° |
| N62 | C61 | N67 | C60 | 179.3° | 180.0° |
| N62 | C61 | N67 | C66 | 178.2° | 180.0° |
| N62 | C61 | C60 | C58 | 0.6° | 0.0° |
| N62 | C61 | C60 | C64 | 178.6° | 180.0° |
| C61 | N62 | C63 | H631 | 179.9° | 179.9° |
| C43 | C44 | S45 | H442 | 120.3° | 120.0° |
| C43 | C44 | S45 | H441 | 120.4° | 120.0° |
| C43 | C44 | S45 | O47 | 157.4° | 68.3° |
| C43 | C44 | S45 | N46 | 82.4° | 180.0° |
| C43 | C44 | S45 | O48 | 42.7° | 68.4° |
| C44 | C43 | C42 | H421 | 180.0° | 60.0° |
| C44 | C43 | C42 | H423 | 60.0° | 60.0° |
| C44 | C43 | C42 | H422 | 60.0° | 180.0° |
| C44 | C43 | H431 | H432 | 118.9° | 119.9° |
| C43 | C44 | H442 | H441 | 118.9° | 119.9° |
| C20 | N21 | C22 | H1 | 180.0° | 179.9° |
| N21 | C20 | N26 | C19 | 180.0° | 179.8° |
| N21 | C20 | N26 | C25 | 179.9° | 179.9° |
| C20 | N21 | C22 | C17 | 0.4° | 0.1° |
| N21 | C20 | C19 | C17 | 0.3° | 0.2° |
| N21 | C20 | C19 | C23 | 179.5° | 180.0° |
| C20 | N21 | C22 | H221 | 179.6° | 179.8° |
| C22 | N21 | C20 | N26 | 179.6° | 179.8° |
| C22 | N21 | C20 | C19 | 0.5° | 0.1° |
| N21 | C22 | C17 | H221 | 180.0° | 179.9° |
| N21 | C22 | C17 | C19 | 0.2° | 0.2° |
| N21 | C22 | C17 | C16 | 180.0° | 179.9° |
| C20 | N26 | C25 | C24 | 0.6° | 0.4° |
| N26 | C20 | C19 | C17 | 179.7° | 180.0° |
| N26 | C20 | C19 | C23 | 0.5° | 0.2° |
| N26 | C20 | N21 | H1 | 0.4° | 0.3° |
| C20 | N26 | C25 | H251 | 179.4° | 179.8° |
| C25 | N26 | C20 | C19 | 0.0° | 0.4° |
| N26 | C25 | C24 | H251 | 180.0° | 179.8° |
| N26 | C25 | C24 | C23 | 0.6° | 0.2° |
| N26 | C25 | C24 | C27 | 180.0° | 179.8° |
| C44 | S45 | O47 | N46 | 123.5° | 111.8° |
| C44 | S45 | O47 | O48 | 120.3° | 131.5° |
| C44 | S45 | N46 | O48 | 127.2° | 116.0° |
| C44 | S45 | N46 | C49 | 58.7° | 60.0° |
| S45 | C44 | C43 | H431 | 76.8° | 59.9° |
| S45 | C44 | C43 | H432 | 42.4° | 60.0° |
| S45 | C44 | H442 | H441 | 118.9° | 120.0° |
| C44 | S45 | N46 | H461 | 62.6° | 120.0° |
| C63 | C58 | C60 | C61 | 0.5° | 0.2° |
| C63 | C58 | C60 | C57 | 179.2° | 179.8° |
| C63 | C58 | C60 | C64 | 178.6° | 179.8° |
| C63 | C58 | C57 | C53 | 9.0° | 4.8° |
| C63 | C58 | C57 | O59 | 170.6° | 175.3° |
| C58 | C63 | N62 | H2 | 179.9° | 180.0° |
| C61 | N67 | C66 | C65 | 0.7° | 0.1° |
| N67 | C61 | C60 | C58 | 179.9° | 180.0° |
| N67 | C61 | C60 | C64 | 0.8° | 0.0° |
| N67 | C61 | N62 | H2 | 0.1° | 0.1° |
| C61 | N67 | C66 | H661 | 179.3° | 180.0° |
| C66 | N67 | C61 | C60 | 1.1° | 0.1° |
| N67 | C66 | C65 | H661 | 180.0° | 180.0° |
| N67 | C66 | C65 | C64 | 0.1° | 0.0° |
| N67 | C66 | C65 | C68 | 179.1° | 179.9° |
| C61 | C60 | C58 | C64 | 179.1° | 180.0° |
| C61 | C60 | C58 | C57 | 179.8° | 180.0° |
| C61 | C60 | C64 | C65 | 0.2° | 0.1° |
| C60 | C61 | N62 | H2 | 179.5° | 179.8° |
| C61 | C60 | C64 | H641 | 179.7° | 179.9° |
| C02 | C03 | S04 | H032 | 120.8° | 120.0° |
| C02 | C03 | S04 | H031 | 120.8° | 120.0° |
| C02 | C03 | S04 | N05 | 139.5° | 180.0° |
| C02 | C03 | S04 | O06 | 16.6° | 68.4° |
| C02 | C03 | S04 | O07 | 103.3° | 68.4° |
| C03 | C02 | C01 | H012 | 180.0° | 60.1° |
| C03 | C02 | C01 | H011 | 60.0° | 59.9° |
| C03 | C02 | C01 | H013 | 60.0° | 180.0° |
| C03 | C02 | H021 | H022 | 119.5° | 120.0° |
| C02 | C03 | H032 | H031 | 117.3° | 120.0° |
| C20 | C19 | C17 | C22 | 0.1° | 0.2° |
| C20 | C19 | C17 | C23 | 179.0° | 179.8° |
| C20 | C19 | C17 | C16 | 179.8° | 180.0° |
| C20 | C19 | C23 | C24 | 0.5° | 0.0° |
| C19 | C20 | N21 | H1 | 179.6° | 179.9° |
| C20 | C19 | C23 | H231 | 179.5° | 180.0° |
| C22 | C17 | C19 | C16 | 179.9° | 179.7° |
| C22 | C17 | C19 | C23 | 179.1° | 180.0° |
| C22 | C17 | C16 | C12 | 9.4° | 5.1° |
| C22 | C17 | C16 | O18 | 169.0° | 175.0° |
| C17 | C22 | N21 | H1 | 179.7° | 179.8° |
| C50 | C51 | C52 | H511 | 180.0° | 179.9° |
| C50 | C51 | C52 | F56 | 179.9° | 180.0° |
| C51 | C50 | C49 | H501 | 180.0° | 179.9° |
| C50 | C51 | C52 | C53 | 0.1° | 0.0° |
| C51 | C50 | C49 | C54 | 0.3° | 0.1° |
| C51 | C50 | C49 | N46 | 179.6° | 179.7° |
| C51 | C52 | F56 | C53 | 179.9° | 180.0° |
| C52 | C51 | C50 | C49 | 0.4° | 0.1° |
| C51 | C52 | C53 | C54 | 0.9° | 0.0° |
| C51 | C52 | C53 | C57 | 179.7° | 179.9° |
| C52 | C51 | C50 | H501 | 179.6° | 180.0° |
| C25 | C24 | C23 | C19 | 0.1° | 0.0° |
| C25 | C24 | C23 | C27 | 179.4° | 180.0° |
| C25 | C24 | C27 | C32 | 27.5° | 180.0° |
| C25 | C24 | C27 | C28 | 152.5° | 0.0° |
| C25 | C24 | C23 | H231 | 179.9° | 180.0° |
| F56 | C52 | C53 | C54 | 179.1° | 180.0° |
| F56 | C52 | C53 | C57 | 0.4° | 0.0° |
| F56 | C52 | C51 | H511 | 0.1° | 0.1° |
| C66 | C65 | C64 | C60 | 0.1° | 0.1° |
| C66 | C65 | C64 | C68 | 179.2° | 179.9° |
| C66 | C65 | C68 | C73 | 38.9° | 179.7° |
| C66 | C65 | C68 | C69 | 140.6° | 0.1° |
| C66 | C65 | C64 | H641 | 179.9° | 179.9° |
| C03 | S04 | N05 | O06 | 128.5° | 116.1° |
| C03 | S04 | N05 | O07 | 119.7° | 116.1° |
| C03 | S04 | O06 | O07 | 124.7° | 131.6° |
| C03 | S04 | N05 | C08 | 56.9° | 59.9° |
| S04 | C03 | C02 | H021 | 35.4° | 60.0° |
| S04 | C03 | C02 | H022 | 84.3° | 60.0° |
| S04 | C03 | H032 | H031 | 117.3° | 120.1° |
| C03 | S04 | N05 | H051 | 64.2° | 120.0° |
| C50 | C49 | N46 | S45 | 5.9° | 35.4° |
| C50 | C49 | C54 | N46 | 179.3° | 179.8° |
| C50 | C49 | C54 | C53 | 1.3° | 0.1° |
| C50 | C49 | C54 | F55 | 179.4° | 179.8° |
| C50 | C49 | N46 | H461 | 127.2° | 144.6° |
| C49 | C50 | C51 | H511 | 179.6° | 180.0° |
| C52 | C53 | C57 | C58 | 72.4° | 85.3° |
| C52 | C53 | C54 | C49 | 1.6° | 0.0° |
| C52 | C53 | C54 | C57 | 178.8° | 180.0° |
| C52 | C53 | C54 | F55 | 179.7° | 179.7° |
| C52 | C53 | C57 | O59 | 108.0° | 94.7° |
| C53 | C52 | C51 | H511 | 179.9° | 179.9° |
| C60 | C58 | C57 | C53 | 170.1° | 174.9° |
| C58 | C60 | C64 | C65 | 179.2° | 180.0° |
| C60 | C58 | C57 | O59 | 10.3° | 5.0° |
| C60 | C58 | C63 | H631 | 179.8° | 179.9° |
| C58 | C60 | C64 | H641 | 0.7° | 0.1° |
| C57 | C58 | C60 | C64 | 0.7° | 0.0° |
| C58 | C57 | C53 | C54 | 106.3° | 94.7° |
| C58 | C57 | C53 | O59 | 179.6° | 179.9° |
| C57 | C58 | C63 | H631 | 0.5° | 0.3° |
| C60 | C64 | C65 | H641 | 180.0° | 179.9° |
| C60 | C64 | C65 | C68 | 179.3° | 180.0° |
| C17 | C19 | C23 | C24 | 179.3° | 179.8° |
| C19 | C17 | C16 | C12 | 170.4° | 175.2° |
| C19 | C17 | C16 | O18 | 11.1° | 4.7° |
| C19 | C17 | C22 | H221 | 179.9° | 179.7° |
| C17 | C19 | C23 | H231 | 0.7° | 0.2° |
| C23 | C19 | C17 | C16 | 0.8° | 0.2° |
| C19 | C23 | C24 | H231 | 180.0° | 180.0° |
| C19 | C23 | C24 | C27 | 179.4° | 180.0° |
| C17 | C16 | C12 | C11 | 68.9° | 94.6° |
| C17 | C16 | C12 | O18 | 178.6° | 179.9° |
| C17 | C16 | C12 | C13 | 112.1° | 85.3° |
| C16 | C17 | C22 | H221 | 0.0° | 0.0° |
| F15 | C11 | C10 | C12 | 179.1° | 180.0° |
| F15 | C11 | C10 | C09 | 179.2° | 180.0° |
| F15 | C11 | C12 | C16 | 1.8° | 0.0° |
| F15 | C11 | C12 | C13 | 179.2° | 179.9° |
| F15 | C11 | C10 | H101 | 0.8° | 0.3° |
| O47 | S45 | N46 | O48 | 113.0° | 127.9° |
| O47 | S45 | N46 | C49 | 61.1° | 56.0° |
| O47 | S45 | C44 | H442 | 37.0° | 171.7° |
| O47 | S45 | C44 | H441 | 82.2° | 51.7° |
| O47 | S45 | N46 | H461 | 177.6° | 124.0° |
| S45 | N46 | C49 | C54 | 173.5° | 144.8° |
| S45 | N46 | C49 | H461 | 121.3° | 180.0° |
| N46 | S45 | C44 | H442 | 157.2° | 60.0° |
| N46 | S45 | C44 | H441 | 37.9° | 60.0° |
| O48 | S45 | N46 | C49 | 174.1° | 176.1° |
| O48 | S45 | C44 | H442 | 77.6° | 51.6° |
| O48 | S45 | C44 | H441 | 163.1° | 171.6° |
| O48 | S45 | N46 | H461 | 64.6° | 3.9° |
| C49 | C54 | C53 | F55 | 178.1° | 179.7° |
| C49 | C54 | C53 | C57 | 179.6° | 179.9° |
| C54 | C49 | N46 | H461 | 52.2° | 35.2° |
| C54 | C49 | C50 | H501 | 179.8° | 180.0° |
| N46 | C49 | C54 | C53 | 179.4° | 179.7° |
| N46 | C49 | C54 | F55 | 1.2° | 0.0° |
| N46 | C49 | C50 | H501 | 0.5° | 0.2° |
| C54 | C53 | C57 | O59 | 73.3° | 85.2° |
| C57 | C53 | C54 | F55 | 1.5° | 0.2° |
| C11 | C10 | C09 | H101 | 180.0° | 179.7° |
| C11 | C10 | C09 | C08 | 0.4° | 0.0° |
| C10 | C11 | C12 | C16 | 179.2° | 180.0° |
| C10 | C11 | C12 | C13 | 0.2° | 0.1° |
| C11 | C10 | C09 | H091 | 179.6° | 180.0° |
| C09 | C10 | C11 | C12 | 0.1° | 0.0° |
| C10 | C09 | C08 | H091 | 180.0° | 180.0° |
| C10 | C09 | C08 | C13 | 0.9° | 0.0° |
| C10 | C09 | C08 | N05 | 179.5° | 179.9° |
| C11 | C12 | C16 | C13 | 179.0° | 180.0° |
| C11 | C12 | C13 | C08 | 0.3° | 0.1° |
| C11 | C12 | C16 | O18 | 112.5° | 85.3° |
| C11 | C12 | C13 | F14 | 179.7° | 180.0° |
| C12 | C11 | C10 | H101 | 179.9° | 179.7° |
| C23 | C24 | C27 | C32 | 153.1° | 0.1° |
| C23 | C24 | C27 | C28 | 26.8° | 180.0° |
| C23 | C24 | C25 | H251 | 179.4° | 180.0° |
| C24 | C27 | C32 | C28 | 180.0° | 179.9° |
| C24 | C27 | C32 | C31 | 179.7° | 179.4° |
| C24 | C27 | C28 | C29 | 179.7° | 179.9° |
| C24 | C27 | C28 | H281 | 0.3° | 0.4° |
| C27 | C24 | C23 | H231 | 0.5° | 0.0° |
| C27 | C24 | C25 | H251 | 0.0° | 0.0° |
| C24 | C27 | C32 | H321 | 0.3° | 0.0° |
| C64 | C65 | C68 | C73 | 141.9° | 0.4° |
| C64 | C65 | C68 | C69 | 38.6° | 180.0° |
| C64 | C65 | C66 | H661 | 179.9° | 179.9° |
| C65 | C68 | C73 | C69 | 179.5° | 179.7° |
| C65 | C68 | C73 | C72 | 179.9° | 179.8° |
| C65 | C68 | C69 | C70 | 179.8° | 180.0° |
| C68 | C65 | C64 | H641 | 0.7° | 0.1° |
| C68 | C65 | C66 | H661 | 0.9° | 0.0° |
| C65 | C68 | C69 | H691 | 0.2° | 0.1° |
| C65 | C68 | C73 | H731 | 0.1° | 0.1° |
| C09 | C08 | C13 | C12 | 0.9° | 0.1° |
| C09 | C08 | N05 | S04 | 10.5° | 35.4° |
| C09 | C08 | C13 | N05 | 179.6° | 179.9° |
| C09 | C08 | C13 | F14 | 179.7° | 179.9° |
| C08 | C09 | C10 | H101 | 179.6° | 179.7° |
| C09 | C08 | N05 | H051 | 131.6° | 144.6° |
| C16 | C12 | C13 | C08 | 178.8° | 180.0° |
| C16 | C12 | C13 | F14 | 0.7° | 0.1° |
| C12 | C13 | C08 | F14 | 179.5° | 179.9° |
| C12 | C13 | C08 | N05 | 179.6° | 179.9° |
| C13 | C12 | C16 | O18 | 66.5° | 94.8° |
| C27 | C32 | C31 | H321 | 180.0° | 179.4° |
| C27 | C32 | C31 | C30 | 0.8° | 0.9° |
| C32 | C27 | C28 | C29 | 0.3° | 0.0° |
| C32 | C27 | C28 | H281 | 179.7° | 179.7° |
| C27 | C32 | C31 | H311 | 179.2° | 179.8° |
| C31 | C32 | C27 | C28 | 0.3° | 0.6° |
| C32 | C31 | C30 | H311 | 180.0° | 179.3° |
| C32 | C31 | C30 | C29 | 1.4° | 0.7° |
| C32 | C31 | C30 | C33 | 180.0° | 179.4° |
| N05 | S04 | O06 | O07 | 115.6° | 116.7° |
| S04 | N05 | C08 | C13 | 169.1° | 144.6° |
| S04 | N05 | C08 | H051 | 121.2° | 179.9° |
| N05 | S04 | C03 | H032 | 99.7° | 60.0° |
| N05 | S04 | C03 | H031 | 18.7° | 60.0° |
| O06 | S04 | N05 | C08 | 174.6° | 56.2° |
| O06 | S04 | C03 | H032 | 137.4° | 171.6° |
| O06 | S04 | C03 | H031 | 104.3° | 51.6° |
| O06 | S04 | N05 | H051 | 64.2° | 123.9° |
| O07 | S04 | N05 | C08 | 62.8° | 176.0° |
| O07 | S04 | C03 | H032 | 17.5° | 51.6° |
| O07 | S04 | C03 | H031 | 135.8° | 171.6° |
| O07 | S04 | N05 | H051 | 176.0° | 3.9° |
| C13 | C08 | N05 | H051 | 47.9° | 35.3° |
| C13 | C08 | C09 | H091 | 179.0° | 179.9° |
| N05 | C08 | C13 | F14 | 0.1° | 0.0° |
| N05 | C08 | C09 | H091 | 0.5° | 0.1° |
| C68 | C73 | C72 | H731 | 180.0° | 179.8° |
| C68 | C73 | C72 | C71 | 1.1° | 0.5° |
| C73 | C68 | C69 | C70 | 0.3° | 0.3° |
| C73 | C68 | C69 | H691 | 179.7° | 179.8° |
| C68 | C73 | C72 | H721 | 178.9° | 179.8° |
| C72 | C73 | C68 | C69 | 0.6° | 0.5° |
| C73 | C72 | C71 | H721 | 180.0° | 179.7° |
| C73 | C72 | C71 | C70 | 1.4° | 0.3° |
| C73 | C72 | C71 | C41 | 179.3° | 179.8° |
| C27 | C28 | C29 | H281 | 180.0° | 179.7° |
| C27 | C28 | C29 | C30 | 0.9° | 0.3° |
| C27 | C28 | C29 | H291 | 179.1° | 179.7° |
| C28 | C27 | C32 | H321 | 179.7° | 180.0° |
| C68 | C69 | C70 | H691 | 180.0° | 179.9° |
| C68 | C69 | C70 | C71 | 0.6° | 0.1° |
| C68 | C69 | C70 | H701 | 179.4° | 180.0° |
| C69 | C68 | C73 | H731 | 179.5° | 179.7° |
| C31 | C30 | C29 | C28 | 1.4° | 0.1° |
| C31 | C30 | C29 | C33 | 178.6° | 179.9° |
| C31 | C30 | C33 | N34 | 64.2° | 90.0° |
| C31 | C30 | C29 | H291 | 178.6° | 180.0° |
| C30 | C31 | C32 | H321 | 179.2° | 179.7° |
| C31 | C30 | C33 | H332 | 55.6° | 30.0° |
| C31 | C30 | C33 | H331 | 175.9° | 150.1° |
| C72 | C71 | C70 | C69 | 1.1° | 0.1° |
| C72 | C71 | C70 | C41 | 179.4° | 179.9° |
| C72 | C71 | C41 | N40 | 57.4° | 90.1° |
| C72 | C71 | C41 | H411 | 62.0° | 150.0° |
| C72 | C71 | C41 | H412 | 176.8° | 29.9° |
| C72 | C71 | C70 | H701 | 178.9° | 180.0° |
| C71 | C72 | C73 | H731 | 178.9° | 179.7° |
| C28 | C29 | C30 | H291 | 180.0° | 179.9° |
| C28 | C29 | C30 | C33 | 180.0° | 180.0° |
| O74 | C35 | C36 | O37 | 12.2° | 0.0° |
| O74 | C35 | C36 | N34 | 179.0° | 180.0° |
| O74 | C35 | N34 | C33 | 1.1° | 0.0° |
| O74 | C35 | N34 | H341 | 179.0° | 179.9° |
| O74 | C35 | C36 | H361 | 107.0° | 120.1° |
| O74 | C35 | C36 | H362 | 131.5° | 120.0° |
| C69 | C70 | C71 | H701 | 180.0° | 179.9° |
| C69 | C70 | C71 | C41 | 179.5° | 180.0° |
| O37 | C36 | C35 | H361 | 119.2° | 120.0° |
| O37 | C36 | C35 | H362 | 119.3° | 120.1° |
| O37 | C36 | C35 | N34 | 168.8° | 180.0° |
| C36 | O37 | C38 | C39 | 96.8° | 180.0° |
| O37 | C36 | H361 | H362 | 122.2° | 120.0° |
| C36 | O37 | C38 | H382 | 143.9° | 59.9° |
| C36 | O37 | C38 | H381 | 22.6° | 60.0° |
| O37 | C38 | C39 | O75 | 0.3° | 0.0° |
| C38 | O37 | C36 | C35 | 104.0° | 180.0° |
| O37 | C38 | C39 | H382 | 119.3° | 120.0° |
| O37 | C38 | C39 | H381 | 119.3° | 120.0° |
| O37 | C38 | C39 | N40 | 179.8° | 180.0° |
| C38 | O37 | C36 | H361 | 136.8° | 60.0° |
| C38 | O37 | C36 | H362 | 15.3° | 60.0° |
| O37 | C38 | H382 | H381 | 121.9° | 119.9° |
| C29 | C30 | C33 | N34 | 114.4° | 90.0° |
| C30 | C29 | C28 | H281 | 179.1° | 179.9° |
| C29 | C30 | C31 | H311 | 178.7° | 179.9° |
| C29 | C30 | C33 | H332 | 125.8° | 150.0° |
| C29 | C30 | C33 | H331 | 5.5° | 30.0° |
| C30 | C33 | N34 | C35 | 91.1° | 180.0° |
| C30 | C33 | N34 | H332 | 119.8° | 120.0° |
| C30 | C33 | N34 | H331 | 119.8° | 120.0° |
| C33 | C30 | C29 | H291 | 0.0° | 0.0° |
| C33 | C30 | C31 | H311 | 0.0° | 0.1° |
| C30 | C33 | H332 | H331 | 120.5° | 120.0° |
| C30 | C33 | N34 | H341 | 88.9° | 0.1° |
| O75 | C39 | C38 | N40 | 179.9° | 180.0° |
| O75 | C39 | N40 | C41 | 1.8° | 0.0° |
| O75 | C39 | C38 | H382 | 119.6° | 120.0° |
| O75 | C39 | C38 | H381 | 119.1° | 120.0° |
| O75 | C39 | N40 | H401 | 178.2° | 179.9° |
| C70 | C71 | C41 | N40 | 122.0° | 90.0° |
| C70 | C71 | C41 | H411 | 118.6° | 30.0° |
| C70 | C71 | C41 | H412 | 2.6° | 150.0° |
| C71 | C70 | C69 | H691 | 179.4° | 180.0° |
| C70 | C71 | C72 | H721 | 178.6° | 180.0° |
| C71 | C41 | N40 | C39 | 94.5° | 180.0° |
| C71 | C41 | N40 | H411 | 119.4° | 120.0° |
| C71 | C41 | N40 | H412 | 119.4° | 120.0° |
| C71 | C41 | N40 | H401 | 85.5° | 0.1° |
| C71 | C41 | H411 | H412 | 121.7° | 120.0° |
| C41 | C71 | C70 | H701 | 0.5° | 0.1° |
| C41 | C71 | C72 | H721 | 0.7° | 0.1° |
| C36 | C35 | N34 | C33 | 178.0° | 180.0° |
| C36 | C35 | N34 | H341 | 2.0° | 0.0° |
| C35 | C36 | H361 | H362 | 122.2° | 120.0° |
| C35 | N34 | C33 | H341 | 180.0° | 179.9° |
| C35 | N34 | C33 | H332 | 28.7° | 60.0° |
| C35 | N34 | C33 | H331 | 149.1° | 60.0° |
| N34 | C35 | C36 | H361 | 72.0° | 60.0° |
| N34 | C35 | C36 | H362 | 49.5° | 59.9° |
| C38 | C39 | N40 | C41 | 178.3° | 180.0° |
| C39 | C38 | H382 | H381 | 121.9° | 120.0° |
| C38 | C39 | N40 | H401 | 1.7° | 0.1° |
| C39 | N40 | C41 | H401 | 180.0° | 179.9° |
| N40 | C39 | C38 | H382 | 60.5° | 60.0° |
| N40 | C39 | C38 | H381 | 60.9° | 60.0° |
| C39 | N40 | C41 | H411 | 24.9° | 60.0° |
| C39 | N40 | C41 | H412 | 146.1° | 60.0° |
| N34 | C33 | H332 | H331 | 120.5° | 120.0° |
| N40 | C41 | H411 | H412 | 121.7° | 120.1° |
| H101 | C10 | C09 | H091 | 0.5° | 0.3° |
| H221 | C22 | N21 | H1 | 0.3° | 0.3° |
| H281 | C28 | C29 | H291 | 0.8° | 0.0° |
| H012 | C01 | H011 | H013 | 120.0° | 120.0° |
| H012 | C01 | C02 | H021 | 59.9° | 60.0° |
| H012 | C01 | C02 | H022 | 59.8° | 180.0° |
| H011 | C01 | C02 | H021 | 60.2° | 179.9° |
| H011 | C01 | C02 | H022 | 179.9° | 60.0° |
| H013 | C01 | C02 | H021 | 179.9° | 59.9° |
| H013 | C01 | C02 | H022 | 60.2° | 60.1° |
| H021 | C02 | C03 | H032 | 156.3° | 180.0° |
| H021 | C02 | C03 | H031 | 85.4° | 60.0° |
| H022 | C02 | C03 | H032 | 36.6° | 60.0° |
| H022 | C02 | C03 | H031 | 154.9° | 180.0° |
| H311 | C31 | C32 | H321 | 0.8° | 0.4° |
| H332 | C33 | N34 | H341 | 151.3° | 119.9° |
| H331 | C33 | N34 | H341 | 31.0° | 120.0° |
| H401 | N40 | C41 | H411 | 155.0° | 120.1° |
| H401 | N40 | C41 | H412 | 33.9° | 119.9° |
| H421 | C42 | H423 | H422 | 120.0° | 119.9° |
| H421 | C42 | C43 | H431 | 59.6° | 60.0° |
| H421 | C42 | C43 | H432 | 59.6° | 180.0° |
| H423 | C42 | C43 | H431 | 60.4° | 179.9° |
| H423 | C42 | C43 | H432 | 179.6° | 60.0° |
| H422 | C42 | C43 | H431 | 179.6° | 60.0° |
| H422 | C42 | C43 | H432 | 60.4° | 60.0° |
| H431 | C43 | C44 | H442 | 162.8° | 180.0° |
| H431 | C43 | C44 | H441 | 43.5° | 60.1° |
| H432 | C43 | C44 | H442 | 77.9° | 60.1° |
| H432 | C43 | C44 | H441 | 162.8° | 180.0° |
| H501 | C50 | C51 | H511 | 0.4° | 0.1° |
| H2 | N62 | C63 | H631 | 0.1° | 0.4° |
| H691 | C69 | C70 | H701 | 0.6° | 0.1° |
| H721 | C72 | C73 | H731 | 1.1° | 0.0° |
