I3X
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C16 | C15 | sing | 1.53Å | 1.53Å | |
| C16 | N11 | sing | 1.46Å | 1.49Å | |
| O43 | C10 | doub | 1.22Å | 1.20Å | |
| C15 | C14 | sing | 1.52Å | 1.47Å | |
| N11 | C10 | sing | 1.35Å | 1.40Å | |
| N11 | C12 | sing | 1.47Å | 1.51Å | |
| C10 | C09 | sing | 1.47Å | 1.51Å | |
| C14 | C13 | sing | 1.52Å | 1.46Å | |
| C12 | C13 | sing | 1.53Å | 1.47Å | |
| C13 | C17 | sing | 1.53Å | 1.57Å | |
| C13 | C24 | sing | 1.51Å | 1.58Å | |
| C19 | C20 | doub | 1.38Å | 1.38Å | Aromatic |
| C19 | C18 | sing | 1.38Å | 1.38Å | Aromatic |
| C09 | C08 | doub | 1.34Å | 1.33Å | |
| C08 | C07 | sing | 1.48Å | 1.54Å | |
| C17 | C18 | sing | 1.51Å | 1.55Å | |
| C20 | C21 | sing | 1.38Å | 1.37Å | Aromatic |
| C59 | O60 | sing | 1.43Å | 1.44Å | |
| C59 | C58 | sing | 1.53Å | 1.55Å | |
| C18 | C23 | doub | 1.38Å | 1.37Å | Aromatic |
| O41 | C40 | doub | 1.21Å | 1.19Å | |
| C24 | N25 | sing | 1.36Å | 1.44Å | |
| C24 | O42 | doub | 1.21Å | 1.20Å | |
| N25 | C26 | sing | 1.48Å | 1.44Å | |
| N57 | C58 | sing | 1.47Å | 1.47Å | |
| N57 | C02 | sing | 1.35Å | 1.48Å | |
| N06 | C07 | sing | 1.36Å | 1.48Å | |
| N06 | C05 | sing | 1.49Å | 1.48Å | |
| C61 | O60 | sing | 1.43Å | 1.44Å | |
| C61 | C62 | sing | 1.53Å | 1.57Å | |
| C07 | O44 | doub | 1.21Å | 1.19Å | |
| C21 | C22 | doub | 1.38Å | 1.38Å | Aromatic |
| C62 | N63 | sing | 1.47Å | 1.49Å | |
| O56 | C46 | doub | 1.21Å | 1.19Å | |
| C40 | C26 | sing | 1.51Å | 1.54Å | |
| C40 | N51 | sing | 1.36Å | 1.44Å | |
| C23 | C22 | sing | 1.38Å | 1.38Å | Aromatic |
| C03 | C04 | sing | 1.53Å | 1.53Å | |
| C03 | C02 | sing | 1.51Å | 1.50Å | |
| C03 | N45 | sing | 1.48Å | 1.45Å | |
| C26 | C27 | sing | 1.53Å | 1.46Å | |
| C04 | C05 | sing | 1.53Å | 1.56Å | |
| C02 | O01 | doub | 1.21Å | 1.20Å | |
| C27 | C28 | sing | 1.51Å | 1.54Å | |
| C29 | C28 | doub | 1.38Å | 1.37Å | Aromatic |
| C29 | C30 | sing | 1.38Å | 1.39Å | Aromatic |
| C50 | N51 | sing | 1.48Å | 1.44Å | |
| C50 | C49 | sing | 1.51Å | 1.51Å | |
| C46 | N45 | sing | 1.37Å | 1.44Å | |
| C46 | C47 | sing | 1.51Å | 1.54Å | |
| C52 | C49 | doub | 1.38Å | 1.38Å | Aromatic |
| C52 | C53 | sing | 1.38Å | 1.37Å | Aromatic |
| C28 | C39 | sing | 1.38Å | 1.37Å | Aromatic |
| C49 | C48 | sing | 1.38Å | 1.42Å | Aromatic |
| C30 | C31 | doub | 1.39Å | 1.39Å | Aromatic |
| C53 | C54 | doub | 1.38Å | 1.40Å | Aromatic |
| C48 | C47 | sing | 1.51Å | 1.54Å | |
| C48 | C55 | doub | 1.38Å | 1.38Å | Aromatic |
| C37 | C36 | doub | 1.38Å | 1.39Å | Aromatic |
| C37 | C32 | sing | 1.39Å | 1.39Å | Aromatic |
| C39 | C38 | doub | 1.38Å | 1.39Å | Aromatic |
| C54 | C55 | sing | 1.38Å | 1.38Å | Aromatic |
| C31 | C38 | sing | 1.39Å | 1.36Å | Aromatic |
| C31 | C32 | sing | 1.48Å | 1.54Å | |
| C36 | C35 | sing | 1.38Å | 1.37Å | Aromatic |
| C32 | C33 | doub | 1.39Å | 1.38Å | Aromatic |
| C35 | C34 | doub | 1.38Å | 1.39Å | Aromatic |
| C33 | C34 | sing | 1.38Å | 1.40Å | Aromatic |
| C15 | H152 | sing | 1.09Å | 1.10Å | |
| C15 | H151 | sing | 1.09Å | 1.10Å | |
| C17 | H172 | sing | 1.09Å | 1.10Å | |
| C17 | H171 | sing | 1.09Å | 1.10Å | |
| C20 | H201 | sing | 1.08Å | 1.08Å | |
| C21 | H211 | sing | 1.08Å | 1.08Å | |
| C22 | H221 | sing | 1.08Å | 1.08Å | |
| C26 | H261 | sing | 1.09Å | 1.10Å | |
| C03 | H031 | sing | 1.09Å | 1.10Å | |
| C04 | H042 | sing | 1.09Å | 1.10Å | |
| C04 | H041 | sing | 1.09Å | 1.10Å | |
| C05 | H051 | sing | 1.09Å | 1.10Å | |
| C05 | H052 | sing | 1.09Å | 1.10Å | |
| C08 | H081 | sing | 1.08Å | 1.08Å | |
| C09 | H091 | sing | 1.09Å | 1.08Å | |
| C12 | H122 | sing | 1.09Å | 1.10Å | |
| C12 | H121 | sing | 1.09Å | 1.10Å | |
| C14 | H142 | sing | 1.09Å | 1.10Å | |
| C14 | H141 | sing | 1.09Å | 1.10Å | |
| C16 | H161 | sing | 1.09Å | 1.10Å | |
| C16 | H162 | sing | 1.09Å | 1.10Å | |
| C19 | H191 | sing | 1.08Å | 1.08Å | |
| C23 | H231 | sing | 1.08Å | 1.08Å | |
| C27 | H272 | sing | 1.09Å | 1.10Å | |
| C27 | H271 | sing | 1.09Å | 1.10Å | |
| C29 | H291 | sing | 1.08Å | 1.08Å | |
| C30 | H301 | sing | 1.08Å | 1.08Å | |
| C33 | H331 | sing | 1.08Å | 1.08Å | |
| C34 | H341 | sing | 1.08Å | 1.08Å | |
| C35 | H351 | sing | 1.08Å | 1.08Å | |
| C36 | H361 | sing | 1.08Å | 1.08Å | |
| C37 | H371 | sing | 1.08Å | 1.08Å | |
| C38 | H381 | sing | 1.08Å | 1.08Å | |
| C39 | H391 | sing | 1.08Å | 1.08Å | |
| C47 | H472 | sing | 1.09Å | 1.10Å | |
| C47 | H471 | sing | 1.09Å | 1.10Å | |
| C50 | H502 | sing | 1.09Å | 1.10Å | |
| C50 | H501 | sing | 1.09Å | 1.10Å | |
| C52 | H521 | sing | 1.08Å | 1.08Å | |
| C53 | H531 | sing | 1.08Å | 1.08Å | |
| C54 | H541 | sing | 1.08Å | 1.08Å | |
| C55 | H551 | sing | 1.08Å | 1.08Å | |
| C58 | H581 | sing | 1.09Å | 1.10Å | |
| C58 | H582 | sing | 1.09Å | 1.10Å | |
| C59 | H592 | sing | 1.09Å | 1.10Å | |
| C59 | H591 | sing | 1.09Å | 1.10Å | |
| C61 | H612 | sing | 1.09Å | 1.10Å | |
| C61 | H611 | sing | 1.09Å | 1.10Å | |
| C62 | H622 | sing | 1.09Å | 1.10Å | |
| C62 | H621 | sing | 1.09Å | 1.10Å | |
| N06 | H061 | sing | 0.97Å | 1.00Å | |
| N25 | H251 | sing | 0.97Å | 1.00Å | |
| N45 | H451 | sing | 0.97Å | 1.00Å | |
| N51 | H511 | sing | 0.97Å | 1.00Å | |
| N57 | H571 | sing | 0.97Å | 1.00Å | |
| N63 | H632 | sing | 1.01Å | 1.00Å | |
| N63 | H1 | sing | 1.01Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C15 | C16 | N11 | 107.7° | 108.4° |
| C16 | C15 | C14 | 112.0° | 112.3° |
| C16 | C15 | H152 | 108.9° | 108.9° |
| C16 | C15 | H151 | 108.8° | 108.8° |
| C15 | C16 | H161 | 109.9° | 109.6° |
| C15 | C16 | H162 | 109.9° | 109.7° |
| C16 | N11 | C10 | 122.7° | 122.2° |
| C16 | N11 | C12 | 111.8° | 119.5° |
| N11 | C16 | H161 | 109.9° | 109.7° |
| N11 | C16 | H162 | 109.9° | 109.7° |
| O43 | C10 | N11 | 123.2° | 120.7° |
| O43 | C10 | C09 | 123.1° | 120.7° |
| C15 | C14 | C13 | 117.3° | 113.5° |
| C14 | C15 | H152 | 108.8° | 108.9° |
| C14 | C15 | H151 | 108.8° | 108.9° |
| C15 | C14 | H142 | 107.5° | 108.7° |
| C15 | C14 | H141 | 107.5° | 108.7° |
| C10 | N11 | C12 | 125.4° | 118.3° |
| N11 | C10 | C09 | 113.5° | 118.6° |
| N11 | C12 | C13 | 118.2° | 109.2° |
| N11 | C12 | H122 | 107.3° | 109.5° |
| N11 | C12 | H121 | 107.3° | 109.5° |
| C10 | C09 | C08 | 119.7° | 122.5° |
| C10 | C09 | H091 | 120.2° | 119.2° |
| C14 | C13 | C12 | 111.0° | 110.0° |
| C14 | C13 | C17 | 115.8° | 110.0° |
| C14 | C13 | C24 | 116.7° | 109.8° |
| C13 | C14 | H142 | 107.5° | 108.6° |
| C13 | C14 | H141 | 107.5° | 108.7° |
| C12 | C13 | C17 | 106.3° | 109.5° |
| C12 | C13 | C24 | 95.9° | 108.3° |
| C13 | C12 | H122 | 107.3° | 109.5° |
| C13 | C12 | H121 | 107.3° | 109.5° |
| C17 | C13 | C24 | 108.9° | 109.1° |
| C13 | C17 | C18 | 106.9° | 109.5° |
| C13 | C17 | H172 | 110.1° | 109.4° |
| C13 | C17 | H171 | 110.2° | 109.5° |
| C13 | C24 | N25 | 114.9° | 118.2° |
| C13 | C24 | O42 | 122.5° | 120.9° |
| C20 | C19 | C18 | 119.3° | 120.0° |
| C19 | C20 | C21 | 120.5° | 120.0° |
| C19 | C20 | H201 | 119.7° | 120.0° |
| C20 | C19 | H191 | 120.3° | 120.0° |
| C19 | C18 | C17 | 120.5° | 120.0° |
| C19 | C18 | C23 | 120.5° | 120.0° |
| C18 | C19 | H191 | 120.4° | 120.0° |
| C09 | C08 | C07 | 122.6° | 118.0° |
| C09 | C08 | H081 | 118.7° | 120.9° |
| C08 | C09 | H091 | 120.2° | 118.3° |
| C08 | C07 | N06 | 111.4° | 119.8° |
| C08 | C07 | O44 | 125.4° | 120.1° |
| C07 | C08 | H081 | 118.7° | 121.0° |
| C17 | C18 | C23 | 119.0° | 120.1° |
| C18 | C17 | H172 | 110.1° | 109.4° |
| C18 | C17 | H171 | 110.1° | 109.5° |
| C20 | C21 | C22 | 119.6° | 120.0° |
| C21 | C20 | H201 | 119.7° | 120.0° |
| C20 | C21 | H211 | 120.2° | 120.0° |
| O60 | C59 | C58 | 100.2° | 109.4° |
| C59 | O60 | C61 | 128.6° | 114.0° |
| O60 | C59 | H592 | 111.7° | 109.4° |
| O60 | C59 | H591 | 111.7° | 109.5° |
| C59 | C58 | N57 | 123.4° | 109.5° |
| C59 | C58 | H581 | 105.9° | 109.5° |
| C59 | C58 | H582 | 105.9° | 109.5° |
| C58 | C59 | H592 | 111.7° | 109.5° |
| C58 | C59 | H591 | 111.7° | 109.5° |
| C18 | C23 | C22 | 119.6° | 120.0° |
| C18 | C23 | H231 | 120.2° | 120.0° |
| O41 | C40 | C26 | 126.2° | 120.4° |
| O41 | C40 | N51 | 119.4° | 120.4° |
| N25 | C24 | O42 | 122.6° | 120.9° |
| C24 | N25 | C26 | 115.7° | 116.2° |
| C24 | N25 | H251 | 122.1° | 121.9° |
| N25 | C26 | C40 | 105.0° | 107.9° |
| N25 | C26 | C27 | 114.5° | 109.8° |
| N25 | C26 | H261 | 111.0° | 109.7° |
| C26 | N25 | H251 | 122.2° | 121.9° |
| C58 | N57 | C02 | 111.5° | 120.0° |
| N57 | C58 | H581 | 105.9° | 109.5° |
| N57 | C58 | H582 | 105.9° | 109.5° |
| C58 | N57 | H571 | 124.2° | 120.0° |
| N57 | C02 | C03 | 118.9° | 120.0° |
| N57 | C02 | O01 | 120.6° | 120.0° |
| C02 | N57 | H571 | 124.2° | 120.0° |
| C07 | N06 | C05 | 116.2° | 114.6° |
| N06 | C07 | O44 | 123.2° | 120.1° |
| C07 | N06 | H061 | 121.9° | 122.7° |
| N06 | C05 | C04 | 106.8° | 108.5° |
| N06 | C05 | H051 | 110.1° | 109.6° |
| N06 | C05 | H052 | 110.2° | 109.6° |
| C05 | N06 | H061 | 121.9° | 122.7° |
| O60 | C61 | C62 | 105.0° | 109.5° |
| O60 | C61 | H612 | 110.6° | 109.5° |
| O60 | C61 | H611 | 110.6° | 109.4° |
| C61 | C62 | N63 | 120.6° | 109.4° |
| C62 | C61 | H612 | 110.6° | 109.5° |
| C62 | C61 | H611 | 110.6° | 109.4° |
| C61 | C62 | H622 | 106.6° | 109.4° |
| C61 | C62 | H621 | 106.6° | 109.5° |
| C21 | C22 | C23 | 120.3° | 120.0° |
| C22 | C21 | H211 | 120.2° | 120.1° |
| C21 | C22 | H221 | 119.8° | 120.0° |
| N63 | C62 | H622 | 106.6° | 109.5° |
| N63 | C62 | H621 | 106.6° | 109.5° |
| C62 | N63 | H632 | 109.5° | 111.1° |
| C62 | N63 | H1 | 109.5° | 111.0° |
| O56 | C46 | N45 | 124.7° | 120.1° |
| O56 | C46 | C47 | 125.9° | 120.2° |
| C26 | C40 | N51 | 114.4° | 119.2° |
| C40 | C26 | C27 | 105.8° | 109.8° |
| C40 | C26 | H261 | 109.6° | 109.8° |
| C40 | N51 | C50 | 121.5° | 114.6° |
| C40 | N51 | H511 | 119.2° | 122.7° |
| C23 | C22 | H221 | 119.8° | 120.0° |
| C22 | C23 | H231 | 120.2° | 120.0° |
| C04 | C03 | C02 | 110.6° | 109.4° |
| C04 | C03 | N45 | 107.8° | 109.8° |
| C03 | C04 | C05 | 113.4° | 109.7° |
| C04 | C03 | H031 | 109.6° | 109.5° |
| C03 | C04 | H042 | 108.5° | 109.4° |
| C03 | C04 | H041 | 108.5° | 109.5° |
| C02 | C03 | N45 | 108.0° | 109.4° |
| C03 | C02 | O01 | 120.5° | 120.0° |
| C02 | C03 | H031 | 110.0° | 109.4° |
| C03 | N45 | C46 | 120.1° | 115.6° |
| N45 | C03 | H031 | 110.8° | 109.4° |
| C03 | N45 | H451 | 120.0° | 122.2° |
| C26 | C27 | C28 | 118.2° | 109.5° |
| C27 | C26 | H261 | 110.7° | 109.8° |
| C26 | C27 | H272 | 107.3° | 109.5° |
| C26 | C27 | H271 | 107.3° | 109.5° |
| C05 | C04 | H042 | 108.5° | 109.4° |
| C05 | C04 | H041 | 108.5° | 109.4° |
| C04 | C05 | H051 | 110.1° | 109.7° |
| C04 | C05 | H052 | 110.2° | 109.6° |
| C27 | C28 | C29 | 121.2° | 119.9° |
| C27 | C28 | C39 | 117.6° | 119.9° |
| C28 | C27 | H272 | 107.2° | 109.4° |
| C28 | C27 | H271 | 107.3° | 109.4° |
| C28 | C29 | C30 | 119.6° | 120.1° |
| C29 | C28 | C39 | 121.0° | 120.2° |
| C28 | C29 | H291 | 120.2° | 120.0° |
| C29 | C30 | C31 | 119.6° | 119.9° |
| C30 | C29 | H291 | 120.2° | 119.9° |
| C29 | C30 | H301 | 120.2° | 120.0° |
| N51 | C50 | C49 | 117.7° | 108.3° |
| N51 | C50 | H502 | 107.4° | 109.7° |
| N51 | C50 | H501 | 107.3° | 109.7° |
| C50 | N51 | H511 | 119.3° | 122.7° |
| C50 | C49 | C52 | 115.3° | 119.7° |
| C50 | C49 | C48 | 123.5° | 120.2° |
| C49 | C50 | H502 | 107.4° | 109.7° |
| C49 | C50 | H501 | 107.4° | 109.7° |
| N45 | C46 | C47 | 109.4° | 119.8° |
| C46 | N45 | H451 | 119.9° | 122.2° |
| C46 | C47 | C48 | 107.3° | 109.1° |
| C46 | C47 | H472 | 110.0° | 109.5° |
| C46 | C47 | H471 | 110.0° | 109.5° |
| C49 | C52 | C53 | 118.7° | 120.1° |
| C52 | C49 | C48 | 121.1° | 120.1° |
| C49 | C52 | H521 | 120.6° | 119.9° |
| C52 | C53 | C54 | 120.3° | 119.9° |
| C53 | C52 | H521 | 120.7° | 120.0° |
| C52 | C53 | H531 | 119.9° | 120.0° |
| C28 | C39 | C38 | 119.3° | 120.2° |
| C28 | C39 | H391 | 120.4° | 119.9° |
| C49 | C48 | C47 | 120.6° | 120.3° |
| C49 | C48 | C55 | 120.2° | 120.0° |
| C30 | C31 | C38 | 119.6° | 119.8° |
| C30 | C31 | C32 | 125.0° | 120.1° |
| C31 | C30 | H301 | 120.2° | 120.1° |
| C53 | C54 | C55 | 121.8° | 120.1° |
| C54 | C53 | H531 | 119.8° | 120.1° |
| C53 | C54 | H541 | 119.1° | 119.9° |
| C47 | C48 | C55 | 119.2° | 119.7° |
| C48 | C47 | H472 | 110.0° | 109.5° |
| C48 | C47 | H471 | 110.0° | 109.6° |
| C48 | C55 | C54 | 117.8° | 119.9° |
| C48 | C55 | H551 | 121.1° | 120.1° |
| C36 | C37 | C32 | 121.2° | 119.8° |
| C37 | C36 | C35 | 119.1° | 120.2° |
| C37 | C36 | H361 | 120.4° | 119.9° |
| C36 | C37 | H371 | 119.4° | 120.1° |
| C37 | C32 | C31 | 113.0° | 120.1° |
| C37 | C32 | C33 | 119.7° | 119.8° |
| C32 | C37 | H371 | 119.4° | 120.1° |
| C39 | C38 | C31 | 120.8° | 119.9° |
| C39 | C38 | H381 | 119.6° | 120.1° |
| C38 | C39 | H391 | 120.4° | 120.0° |
| C55 | C54 | H541 | 119.1° | 120.0° |
| C54 | C55 | H551 | 121.1° | 120.0° |
| C38 | C31 | C32 | 114.6° | 120.1° |
| C31 | C38 | H381 | 119.6° | 120.1° |
| C31 | C32 | C33 | 126.4° | 120.1° |
| C36 | C35 | C34 | 119.8° | 120.2° |
| C36 | C35 | H351 | 120.1° | 119.9° |
| C35 | C36 | H361 | 120.4° | 119.9° |
| C32 | C33 | C34 | 118.4° | 119.9° |
| C32 | C33 | H331 | 120.8° | 120.1° |
| C35 | C34 | C33 | 121.4° | 120.1° |
| C35 | C34 | H341 | 119.3° | 119.9° |
| C34 | C35 | H351 | 120.1° | 119.9° |
| C34 | C33 | H331 | 120.8° | 120.0° |
| C33 | C34 | H341 | 119.3° | 120.0° |
| H152 | C15 | H151 | 109.5° | 108.9° |
| H172 | C17 | H171 | 109.5° | 109.5° |
| H042 | C04 | H041 | 109.4° | 109.4° |
| H051 | C05 | H052 | 109.5° | 109.8° |
| H122 | C12 | H121 | 109.5° | 109.5° |
| H142 | C14 | H141 | 109.5° | 108.6° |
| H161 | C16 | H162 | 109.5° | 109.7° |
| H272 | C27 | H271 | 109.5° | 109.5° |
| H472 | C47 | H471 | 109.5° | 109.6° |
| H502 | C50 | H501 | 109.5° | 109.8° |
| H581 | C58 | H582 | 109.5° | 109.4° |
| H592 | C59 | H591 | 109.5° | 109.5° |
| H612 | C61 | H611 | 109.5° | 109.5° |
| H622 | C62 | H621 | 109.5° | 109.5° |
| H632 | N63 | H1 | 109.5° | 111.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C15 | C16 | N11 | H161 | 119.7° | 119.7° |
| C15 | C16 | N11 | H162 | 119.7° | 119.8° |
| C16 | C15 | C14 | H152 | 120.4° | 120.7° |
| C16 | C15 | C14 | H151 | 120.4° | 120.6° |
| C15 | C16 | N11 | C10 | 129.4° | 146.7° |
| C15 | C16 | N11 | C12 | 54.5° | 32.4° |
| C16 | C15 | C14 | C13 | 53.1° | 24.5° |
| C16 | C15 | H152 | H151 | 118.8° | 118.6° |
| C16 | C15 | C14 | H142 | 68.0° | 145.4° |
| C16 | C15 | C14 | H141 | 174.2° | 96.6° |
| C15 | C16 | H161 | H162 | 120.8° | 120.5° |
| C16 | N11 | C10 | O43 | 1.4° | 11.7° |
| N11 | C16 | C15 | C14 | 57.3° | 58.8° |
| C16 | N11 | C10 | C12 | 175.6° | 179.1° |
| C16 | N11 | C10 | C09 | 176.9° | 167.9° |
| C16 | N11 | C12 | C13 | 49.0° | 25.9° |
| N11 | C16 | C15 | H152 | 177.7° | 61.9° |
| N11 | C16 | C15 | H151 | 63.1° | 179.5° |
| C16 | N11 | C12 | H122 | 170.3° | 145.8° |
| C16 | N11 | C12 | H121 | 72.2° | 94.1° |
| N11 | C16 | H161 | H162 | 120.8° | 120.6° |
| O43 | C10 | N11 | C09 | 175.6° | 179.6° |
| O43 | C10 | N11 | C12 | 176.9° | 167.3° |
| O43 | C10 | C09 | C08 | 10.1° | 23.1° |
| O43 | C10 | C09 | H091 | 169.9° | 156.7° |
| C15 | C14 | C13 | H142 | 121.1° | 121.0° |
| C15 | C14 | C13 | H141 | 121.1° | 121.0° |
| C15 | C14 | C13 | C12 | 42.1° | 34.5° |
| C15 | C14 | C13 | C17 | 163.4° | 86.3° |
| C15 | C14 | C13 | C24 | 66.3° | 153.6° |
| C14 | C15 | H152 | H151 | 118.8° | 118.7° |
| C15 | C14 | H142 | H141 | 116.5° | 118.1° |
| C14 | C15 | C16 | H161 | 177.0° | 178.5° |
| C14 | C15 | C16 | H162 | 62.5° | 61.0° |
| C10 | N11 | C12 | C13 | 135.0° | 155.0° |
| N11 | C10 | C09 | C08 | 174.3° | 157.3° |
| N11 | C10 | C09 | H091 | 5.7° | 23.0° |
| C10 | N11 | C12 | H122 | 13.7° | 35.1° |
| C10 | N11 | C12 | H121 | 103.8° | 85.0° |
| C10 | N11 | C16 | H161 | 9.7° | 27.0° |
| C10 | N11 | C16 | H162 | 110.8° | 93.6° |
| C12 | N11 | C10 | C09 | 7.5° | 13.0° |
| N11 | C12 | C13 | C14 | 39.9° | 60.7° |
| N11 | C12 | C13 | H122 | 121.3° | 119.9° |
| N11 | C12 | C13 | H121 | 121.2° | 120.0° |
| N11 | C12 | C13 | C17 | 166.6° | 60.4° |
| N11 | C12 | C13 | C24 | 81.7° | 179.3° |
| N11 | C12 | H122 | H121 | 116.1° | 120.1° |
| C12 | N11 | C16 | H161 | 174.2° | 152.1° |
| C12 | N11 | C16 | H162 | 65.3° | 87.4° |
| C10 | C09 | C08 | H091 | 180.0° | 179.8° |
| C10 | C09 | C08 | C07 | 172.8° | 179.6° |
| C10 | C09 | C08 | H081 | 7.2° | 2.5° |
| C14 | C13 | C12 | C17 | 126.7° | 121.1° |
| C14 | C13 | C12 | C24 | 121.6° | 120.0° |
| C14 | C13 | C17 | C24 | 134.0° | 120.5° |
| C14 | C13 | C17 | C18 | 54.5° | 57.7° |
| C14 | C13 | C24 | N25 | 9.6° | 171.5° |
| C14 | C13 | C24 | O42 | 173.1° | 8.5° |
| C13 | C14 | C15 | H152 | 173.5° | 96.2° |
| C13 | C14 | C15 | H151 | 67.3° | 145.1° |
| C14 | C13 | C17 | H172 | 174.1° | 177.6° |
| C14 | C13 | C17 | H171 | 65.1° | 62.4° |
| C14 | C13 | C12 | H122 | 161.1° | 179.4° |
| C14 | C13 | C12 | H121 | 81.4° | 59.3° |
| C13 | C14 | H142 | H141 | 116.5° | 118.0° |
| C12 | C13 | C17 | C24 | 102.3° | 118.4° |
| C12 | C13 | C17 | C18 | 178.2° | 178.8° |
| C12 | C13 | C24 | N25 | 126.7° | 51.3° |
| C12 | C13 | C24 | O42 | 56.0° | 128.7° |
| C12 | C13 | C17 | H172 | 62.2° | 61.3° |
| C12 | C13 | C17 | H171 | 58.7° | 58.7° |
| C13 | C12 | H122 | H121 | 116.1° | 120.1° |
| C12 | C13 | C14 | H142 | 79.0° | 86.5° |
| C12 | C13 | C14 | H141 | 163.3° | 155.5° |
| C13 | C17 | C18 | C19 | 97.8° | 91.8° |
| C13 | C17 | C18 | H172 | 119.6° | 119.9° |
| C13 | C17 | C18 | H171 | 119.6° | 120.1° |
| C13 | C17 | C18 | C23 | 82.9° | 89.1° |
| C17 | C13 | C24 | N25 | 123.8° | 67.9° |
| C17 | C13 | C24 | O42 | 53.4° | 112.2° |
| C13 | C17 | H172 | H171 | 121.2° | 120.0° |
| C17 | C13 | C12 | H122 | 72.2° | 59.6° |
| C17 | C13 | C12 | H121 | 45.3° | 179.7° |
| C17 | C13 | C14 | H142 | 42.3° | 152.7° |
| C17 | C13 | C14 | H141 | 75.5° | 34.8° |
| C24 | C13 | C17 | C18 | 79.5° | 62.8° |
| C13 | C24 | N25 | O42 | 177.3° | 180.0° |
| C13 | C24 | N25 | C26 | 176.2° | 175.4° |
| C24 | C13 | C17 | H172 | 40.1° | 57.1° |
| C24 | C13 | C17 | H171 | 161.0° | 177.1° |
| C24 | C13 | C12 | H122 | 39.5° | 59.4° |
| C24 | C13 | C12 | H121 | 157.0° | 60.7° |
| C24 | C13 | C14 | H142 | 172.6° | 32.6° |
| C24 | C13 | C14 | H141 | 54.8° | 85.3° |
| C13 | C24 | N25 | H251 | 3.8° | 4.6° |
| C20 | C19 | C18 | H191 | 180.0° | 179.9° |
| C20 | C19 | C18 | C17 | 179.8° | 179.7° |
| C19 | C20 | C21 | H201 | 180.0° | 179.6° |
| C20 | C19 | C18 | C23 | 0.9° | 0.6° |
| C19 | C20 | C21 | C22 | 2.0° | 0.4° |
| C19 | C20 | C21 | H211 | 178.0° | 179.7° |
| C19 | C18 | C17 | C23 | 179.3° | 179.2° |
| C18 | C19 | C20 | C21 | 0.1° | 0.0° |
| C19 | C18 | C23 | C22 | 0.3° | 0.8° |
| C19 | C18 | C17 | H172 | 142.6° | 148.3° |
| C19 | C18 | C17 | H171 | 21.8° | 28.3° |
| C18 | C19 | C20 | H201 | 179.9° | 179.6° |
| C19 | C18 | C23 | H231 | 179.6° | 179.9° |
| C09 | C08 | C07 | H081 | 180.0° | 177.8° |
| C09 | C08 | C07 | N06 | 149.6° | 162.3° |
| C09 | C08 | C07 | O44 | 29.0° | 17.7° |
| C08 | C07 | N06 | O44 | 178.6° | 180.0° |
| C08 | C07 | N06 | C05 | 179.1° | 178.7° |
| C07 | C08 | C09 | H091 | 7.2° | 0.1° |
| C08 | C07 | N06 | H061 | 0.9° | 1.2° |
| C17 | C18 | C23 | C22 | 179.0° | 180.0° |
| C18 | C17 | H172 | H171 | 121.2° | 120.0° |
| C17 | C18 | C19 | H191 | 0.2° | 0.3° |
| C17 | C18 | C23 | H231 | 1.1° | 0.8° |
| C20 | C21 | C22 | H211 | 180.0° | 179.9° |
| C20 | C21 | C22 | C23 | 3.2° | 0.2° |
| C20 | C21 | C22 | H221 | 176.8° | 180.0° |
| C21 | C20 | C19 | H191 | 179.9° | 179.9° |
| O60 | C59 | C58 | H592 | 118.5° | 120.0° |
| O60 | C59 | C58 | H591 | 118.5° | 120.0° |
| O60 | C59 | C58 | N57 | 174.4° | 59.1° |
| C59 | O60 | C61 | C62 | 152.1° | 173.6° |
| O60 | C59 | C58 | H581 | 63.7° | 179.0° |
| O60 | C59 | C58 | H582 | 52.6° | 61.0° |
| O60 | C59 | H592 | H591 | 124.3° | 120.0° |
| C59 | O60 | C61 | H612 | 88.6° | 53.6° |
| C59 | O60 | C61 | H611 | 32.9° | 66.5° |
| C59 | C58 | N57 | H581 | 121.9° | 120.0° |
| C59 | C58 | N57 | H582 | 121.9° | 120.0° |
| C59 | C58 | N57 | C02 | 155.1° | 172.7° |
| C58 | C59 | O60 | C61 | 161.9° | 174.2° |
| C59 | C58 | H581 | H582 | 113.8° | 120.0° |
| C58 | C59 | H592 | H591 | 124.3° | 120.0° |
| C59 | C58 | N57 | H571 | 24.9° | 7.3° |
| C18 | C23 | C22 | C21 | 2.4° | 0.4° |
| C18 | C23 | C22 | H231 | 180.0° | 179.3° |
| C23 | C18 | C17 | H172 | 36.7° | 30.8° |
| C23 | C18 | C17 | H171 | 157.5° | 150.8° |
| C18 | C23 | C22 | H221 | 177.6° | 179.5° |
| C23 | C18 | C19 | H191 | 179.1° | 179.5° |
| O41 | C40 | C26 | N25 | 46.1° | 41.1° |
| O41 | C40 | C26 | N51 | 179.2° | 179.9° |
| O41 | C40 | C26 | C27 | 75.3° | 78.5° |
| O41 | C40 | N51 | C50 | 4.7° | 0.8° |
| O41 | C40 | C26 | H261 | 165.4° | 160.7° |
| O41 | C40 | N51 | H511 | 175.3° | 179.1° |
| C24 | N25 | C26 | H251 | 180.0° | 180.0° |
| C24 | N25 | C26 | C40 | 71.1° | 121.1° |
| C24 | N25 | C26 | C27 | 173.4° | 1.4° |
| C24 | N25 | C26 | H261 | 47.3° | 119.3° |
| O42 | C24 | N25 | C26 | 6.5° | 4.6° |
| O42 | C24 | N25 | H251 | 173.4° | 175.4° |
| N25 | C26 | C40 | C27 | 121.4° | 119.6° |
| N25 | C26 | C40 | H261 | 119.3° | 119.6° |
| N25 | C26 | C40 | N51 | 133.1° | 139.0° |
| N25 | C26 | C27 | H261 | 126.4° | 120.7° |
| N25 | C26 | C27 | C28 | 79.1° | 177.9° |
| N25 | C26 | C27 | H272 | 42.1° | 62.2° |
| N25 | C26 | C27 | H271 | 159.6° | 57.9° |
| C58 | N57 | C02 | H571 | 180.0° | 180.0° |
| C58 | N57 | C02 | C03 | 178.7° | 178.2° |
| C58 | N57 | C02 | O01 | 0.8° | 1.7° |
| N57 | C58 | H581 | H582 | 113.7° | 120.0° |
| N57 | C58 | C59 | H592 | 55.9° | 179.0° |
| N57 | C58 | C59 | H591 | 67.1° | 60.9° |
| N57 | C02 | C03 | C04 | 98.3° | 129.5° |
| N57 | C02 | C03 | O01 | 177.9° | 179.9° |
| N57 | C02 | C03 | N45 | 143.9° | 110.2° |
| N57 | C02 | C03 | H031 | 22.9° | 9.6° |
| C02 | N57 | C58 | H581 | 33.2° | 52.7° |
| C02 | N57 | C58 | H582 | 83.0° | 67.2° |
| C07 | N06 | C05 | H061 | 180.0° | 179.9° |
| C07 | N06 | C05 | C04 | 138.2° | 80.3° |
| C07 | N06 | C05 | H051 | 102.2° | 39.5° |
| C07 | N06 | C05 | H052 | 18.6° | 160.0° |
| N06 | C07 | C08 | H081 | 30.4° | 15.5° |
| C05 | N06 | C07 | O44 | 2.3° | 1.3° |
| N06 | C05 | C04 | C03 | 54.9° | 117.9° |
| N06 | C05 | C04 | H051 | 119.6° | 119.7° |
| N06 | C05 | C04 | H052 | 119.6° | 119.6° |
| N06 | C05 | C04 | H042 | 175.5° | 122.1° |
| N06 | C05 | C04 | H041 | 65.7° | 2.2° |
| N06 | C05 | H051 | H052 | 121.3° | 120.4° |
| O60 | C61 | C62 | H612 | 119.3° | 120.0° |
| O60 | C61 | C62 | H611 | 119.3° | 119.9° |
| O60 | C61 | C62 | N63 | 155.1° | 65.2° |
| C61 | O60 | C59 | H592 | 79.6° | 65.8° |
| C61 | O60 | C59 | H591 | 43.4° | 54.2° |
| O60 | C61 | H612 | H611 | 122.1° | 120.0° |
| O60 | C61 | C62 | H622 | 83.3° | 174.9° |
| O60 | C61 | C62 | H621 | 33.6° | 54.9° |
| C61 | C62 | N63 | H622 | 121.5° | 119.9° |
| C61 | C62 | N63 | H621 | 121.6° | 120.0° |
| C62 | C61 | H612 | H611 | 122.0° | 120.0° |
| C61 | C62 | H622 | H621 | 115.0° | 120.0° |
| C61 | C62 | N63 | H632 | 180.0° | 55.9° |
| C61 | C62 | N63 | H1 | 60.0° | 179.9° |
| O44 | C07 | C08 | H081 | 151.0° | 164.4° |
| O44 | C07 | N06 | H061 | 177.8° | 178.7° |
| C21 | C22 | C23 | H221 | 180.0° | 179.9° |
| C22 | C21 | C20 | H201 | 178.0° | 180.0° |
| C21 | C22 | C23 | H231 | 177.6° | 179.7° |
| N63 | C62 | C61 | H612 | 35.8° | 174.8° |
| N63 | C62 | C61 | H611 | 85.6° | 54.8° |
| N63 | C62 | H622 | H621 | 115.0° | 120.1° |
| C62 | N63 | H632 | H1 | 120.0° | 124.0° |
| O56 | C46 | N45 | C03 | 2.5° | 176.3° |
| O56 | C46 | N45 | C47 | 179.6° | 180.0° |
| O56 | C46 | C47 | C48 | 21.2° | 3.2° |
| O56 | C46 | C47 | H472 | 140.9° | 116.6° |
| O56 | C46 | C47 | H471 | 98.5° | 123.2° |
| O56 | C46 | N45 | H451 | 177.5° | 3.7° |
| C40 | C26 | C27 | H261 | 118.6° | 120.8° |
| C40 | C26 | C27 | C28 | 165.8° | 59.3° |
| C26 | C40 | N51 | C50 | 174.6° | 179.1° |
| C40 | C26 | C27 | H272 | 72.9° | 179.3° |
| C40 | C26 | C27 | H271 | 44.6° | 60.6° |
| C40 | C26 | N25 | H251 | 108.9° | 58.9° |
| C26 | C40 | N51 | H511 | 5.5° | 1.0° |
| N51 | C40 | C26 | C27 | 105.6° | 101.4° |
| C40 | N51 | C50 | H511 | 180.0° | 179.9° |
| C40 | N51 | C50 | C49 | 104.0° | 162.0° |
| N51 | C40 | C26 | H261 | 13.8° | 19.4° |
| C40 | N51 | C50 | H502 | 17.2° | 42.3° |
| C40 | N51 | C50 | H501 | 134.9° | 78.3° |
| C23 | C22 | C21 | H211 | 176.7° | 180.0° |
| C04 | C03 | C02 | N45 | 117.8° | 120.3° |
| C04 | C03 | C02 | H031 | 121.2° | 119.9° |
| C04 | C03 | N45 | H031 | 119.9° | 120.1° |
| C03 | C04 | C05 | H042 | 120.6° | 120.0° |
| C03 | C04 | C05 | H041 | 120.6° | 120.1° |
| C04 | C03 | C02 | O01 | 83.8° | 50.5° |
| C04 | C03 | N45 | C46 | 128.0° | 146.6° |
| C03 | C04 | H042 | H041 | 118.2° | 120.0° |
| C03 | C04 | C05 | H051 | 174.5° | 1.8° |
| C03 | C04 | C05 | H052 | 64.7° | 122.4° |
| C04 | C03 | N45 | H451 | 52.0° | 33.4° |
| C02 | C03 | N45 | H031 | 120.5° | 119.8° |
| C02 | C03 | C04 | C05 | 169.1° | 109.3° |
| C02 | C03 | N45 | C46 | 112.5° | 26.5° |
| C02 | C03 | C04 | H042 | 48.6° | 130.7° |
| C02 | C03 | C04 | H041 | 70.3° | 10.8° |
| C02 | C03 | N45 | H451 | 67.5° | 153.5° |
| C03 | C02 | N57 | H571 | 1.3° | 1.8° |
| N45 | C03 | C04 | C05 | 51.2° | 130.6° |
| N45 | C03 | C02 | O01 | 34.0° | 69.7° |
| C03 | N45 | C46 | H451 | 180.0° | 180.0° |
| C03 | N45 | C46 | C47 | 177.1° | 3.7° |
| N45 | C03 | C04 | H042 | 69.3° | 10.6° |
| N45 | C03 | C04 | H041 | 171.8° | 109.3° |
| C26 | C27 | C28 | H272 | 121.3° | 120.0° |
| C26 | C27 | C28 | H271 | 121.3° | 120.0° |
| C26 | C27 | C28 | C29 | 49.3° | 95.3° |
| C26 | C27 | C28 | C39 | 135.5° | 84.4° |
| C26 | C27 | H272 | H271 | 116.1° | 120.1° |
| C27 | C26 | N25 | H251 | 6.6° | 178.6° |
| C05 | C04 | C03 | H031 | 69.4° | 10.5° |
| C05 | C04 | H042 | H041 | 118.2° | 119.9° |
| C04 | C05 | H051 | H052 | 121.3° | 120.5° |
| C04 | C05 | N06 | H061 | 41.8° | 99.6° |
| O01 | C02 | C03 | H031 | 154.9° | 170.4° |
| O01 | C02 | N57 | H571 | 179.2° | 178.3° |
| C27 | C28 | C29 | C39 | 175.0° | 179.7° |
| C27 | C28 | C29 | C30 | 176.6° | 179.7° |
| C27 | C28 | C39 | C38 | 176.4° | 179.7° |
| C28 | C27 | C26 | H261 | 47.2° | 61.5° |
| C28 | C27 | H272 | H271 | 116.0° | 120.0° |
| C27 | C28 | C29 | H291 | 3.4° | 0.3° |
| C27 | C28 | C39 | H391 | 3.6° | 0.0° |
| C28 | C29 | C30 | H291 | 180.0° | 180.0° |
| C28 | C29 | C30 | C31 | 0.3° | 0.0° |
| C29 | C28 | C39 | C38 | 1.2° | 0.1° |
| C29 | C28 | C27 | H272 | 71.9° | 144.7° |
| C29 | C28 | C27 | H271 | 170.6° | 24.7° |
| C28 | C29 | C30 | H301 | 179.7° | 179.9° |
| C29 | C28 | C39 | H391 | 178.8° | 179.7° |
| C30 | C29 | C28 | C39 | 1.6° | 0.0° |
| C29 | C30 | C31 | H301 | 180.0° | 180.0° |
| C29 | C30 | C31 | C38 | 2.5° | 0.0° |
| C29 | C30 | C31 | C32 | 172.2° | 180.0° |
| N51 | C50 | C49 | H502 | 121.2° | 119.7° |
| N51 | C50 | C49 | H501 | 121.1° | 119.7° |
| N51 | C50 | C49 | C52 | 44.5° | 72.8° |
| N51 | C50 | C49 | C48 | 138.3° | 107.0° |
| N51 | C50 | H502 | H501 | 116.3° | 120.6° |
| C50 | C49 | C52 | C48 | 177.3° | 179.9° |
| C50 | C49 | C52 | C53 | 177.4° | 180.0° |
| C50 | C49 | C48 | C47 | 3.0° | 0.1° |
| C50 | C49 | C48 | C55 | 176.8° | 179.9° |
| C49 | C50 | H502 | H501 | 116.3° | 120.6° |
| C50 | C49 | C52 | H521 | 2.6° | 0.0° |
| C49 | C50 | N51 | H511 | 76.0° | 18.0° |
| N45 | C46 | C47 | C48 | 159.2° | 176.7° |
| C46 | N45 | C03 | H031 | 8.0° | 93.3° |
| N45 | C46 | C47 | H472 | 39.6° | 63.4° |
| N45 | C46 | C47 | H471 | 81.1° | 56.8° |
| C46 | C47 | C48 | C49 | 83.9° | 129.6° |
| C46 | C47 | C48 | H472 | 119.7° | 119.8° |
| C46 | C47 | C48 | H471 | 119.7° | 119.9° |
| C46 | C47 | C48 | C55 | 95.9° | 50.5° |
| C46 | C47 | H472 | H471 | 121.0° | 120.1° |
| C47 | C46 | N45 | H451 | 2.9° | 176.3° |
| C49 | C52 | C53 | H521 | 180.0° | 180.0° |
| C49 | C52 | C53 | C54 | 1.2° | 0.0° |
| C52 | C49 | C48 | C47 | 179.9° | 179.7° |
| C52 | C49 | C48 | C55 | 0.3° | 0.2° |
| C52 | C49 | C50 | H502 | 76.7° | 167.5° |
| C52 | C49 | C50 | H501 | 165.6° | 46.8° |
| C49 | C52 | C53 | H531 | 178.8° | 180.0° |
| C53 | C52 | C49 | C48 | 0.1° | 0.2° |
| C52 | C53 | C54 | H531 | 180.0° | 180.0° |
| C52 | C53 | C54 | C55 | 2.0° | 0.1° |
| C52 | C53 | C54 | H541 | 178.0° | 179.9° |
| C28 | C39 | C38 | H391 | 180.0° | 179.7° |
| C28 | C39 | C38 | C31 | 1.1° | 0.1° |
| C39 | C28 | C27 | H272 | 103.2° | 35.6° |
| C39 | C28 | C27 | H271 | 14.3° | 155.6° |
| C39 | C28 | C29 | H291 | 178.4° | 180.0° |
| C28 | C39 | C38 | H381 | 178.9° | 180.0° |
| C49 | C48 | C47 | C55 | 179.8° | 180.0° |
| C49 | C48 | C55 | C54 | 0.4° | 0.1° |
| C49 | C48 | C47 | H472 | 156.4° | 110.6° |
| C49 | C48 | C47 | H471 | 35.8° | 9.7° |
| C48 | C49 | C50 | H502 | 100.5° | 12.6° |
| C48 | C49 | C50 | H501 | 17.2° | 133.3° |
| C48 | C49 | C52 | H521 | 179.9° | 179.9° |
| C49 | C48 | C55 | H551 | 179.6° | 179.8° |
| C30 | C31 | C32 | C37 | 34.7° | 0.3° |
| C30 | C31 | C38 | C39 | 2.9° | 0.1° |
| C30 | C31 | C38 | C32 | 170.7° | 180.0° |
| C30 | C31 | C32 | C33 | 156.3° | 180.0° |
| C31 | C30 | C29 | H291 | 179.7° | 180.0° |
| C30 | C31 | C38 | H381 | 177.1° | 180.0° |
| C53 | C54 | C55 | C48 | 1.5° | 0.0° |
| C53 | C54 | C55 | H541 | 180.0° | 180.0° |
| C54 | C53 | C52 | H521 | 178.8° | 180.0° |
| C53 | C54 | C55 | H551 | 178.5° | 180.0° |
| C47 | C48 | C55 | C54 | 179.4° | 179.8° |
| C48 | C47 | H472 | H471 | 121.0° | 120.3° |
| C47 | C48 | C55 | H551 | 0.6° | 0.2° |
| C48 | C55 | C54 | H551 | 180.0° | 179.9° |
| C55 | C48 | C47 | H472 | 23.8° | 69.3° |
| C55 | C48 | C47 | H471 | 144.5° | 170.4° |
| C48 | C55 | C54 | H541 | 178.5° | 180.0° |
| C36 | C37 | C32 | H371 | 180.0° | 179.5° |
| C36 | C37 | C32 | C31 | 176.4° | 179.8° |
| C37 | C36 | C35 | H361 | 180.0° | 179.8° |
| C36 | C37 | C32 | C33 | 6.6° | 0.5° |
| C37 | C36 | C35 | C34 | 3.1° | 0.2° |
| C37 | C36 | C35 | H351 | 176.9° | 179.8° |
| C37 | C32 | C31 | C38 | 135.4° | 179.7° |
| C37 | C32 | C31 | C33 | 169.0° | 179.7° |
| C32 | C37 | C36 | C35 | 5.3° | 0.5° |
| C37 | C32 | C33 | C34 | 5.6° | 0.2° |
| C37 | C32 | C33 | H331 | 174.4° | 179.8° |
| C32 | C37 | C36 | H361 | 174.7° | 179.7° |
| C39 | C38 | C31 | H381 | 180.0° | 179.9° |
| C39 | C38 | C31 | C32 | 173.6° | 179.9° |
| C55 | C54 | C53 | H531 | 178.0° | 179.9° |
| C38 | C31 | C32 | C33 | 33.5° | 0.0° |
| C38 | C31 | C30 | H301 | 177.4° | 179.9° |
| C31 | C38 | C39 | H391 | 178.9° | 179.7° |
| C31 | C32 | C33 | C34 | 173.9° | 180.0° |
| C32 | C31 | C30 | H301 | 7.8° | 0.1° |
| C31 | C32 | C33 | H331 | 6.1° | 0.0° |
| C31 | C32 | C37 | H371 | 3.6° | 0.3° |
| C32 | C31 | C38 | H381 | 6.4° | 0.0° |
| C36 | C35 | C34 | H351 | 180.0° | 180.0° |
| C36 | C35 | C34 | C33 | 2.3° | 0.0° |
| C36 | C35 | C34 | H341 | 177.7° | 180.0° |
| C35 | C36 | C37 | H371 | 174.7° | 180.0° |
| C32 | C33 | C34 | C35 | 3.5° | 0.0° |
| C32 | C33 | C34 | H331 | 180.0° | 180.0° |
| C32 | C33 | C34 | H341 | 176.5° | 180.0° |
| C33 | C32 | C37 | H371 | 173.4° | 180.0° |
| C35 | C34 | C33 | H341 | 180.0° | 180.0° |
| C35 | C34 | C33 | H331 | 176.5° | 180.0° |
| C34 | C35 | C36 | H361 | 176.9° | 180.0° |
| C33 | C34 | C35 | H351 | 177.7° | 180.0° |
| H152 | C15 | C14 | H142 | 52.4° | 24.8° |
| H152 | C15 | C14 | H141 | 65.4° | 142.7° |
| H152 | C15 | C16 | H161 | 62.6° | 57.8° |
| H152 | C15 | C16 | H162 | 57.9° | 178.3° |
| H151 | C15 | C14 | H142 | 171.6° | 94.0° |
| H151 | C15 | C14 | H141 | 53.8° | 24.0° |
| H151 | C15 | C16 | H161 | 56.6° | 60.8° |
| H151 | C15 | C16 | H162 | 177.2° | 59.7° |
| H201 | C20 | C21 | H211 | 2.0° | 0.1° |
| H201 | C20 | C19 | H191 | 0.1° | 0.3° |
| H211 | C21 | C22 | H221 | 3.2° | 0.1° |
| H221 | C22 | C23 | H231 | 2.4° | 0.2° |
| H261 | C26 | C27 | H272 | 168.5° | 58.5° |
| H261 | C26 | C27 | H271 | 74.0° | 178.6° |
| H261 | C26 | N25 | H251 | 132.7° | 60.7° |
| H031 | C03 | C04 | H042 | 170.0° | 109.4° |
| H031 | C03 | C04 | H041 | 51.2° | 130.6° |
| H031 | C03 | N45 | H451 | 172.0° | 86.7° |
| H042 | C04 | C05 | H051 | 64.9° | 118.2° |
| H042 | C04 | C05 | H052 | 55.9° | 2.4° |
| H041 | C04 | C05 | H051 | 53.9° | 122.0° |
| H041 | C04 | C05 | H052 | 174.7° | 117.4° |
| H051 | C05 | N06 | H061 | 77.8° | 140.6° |
| H052 | C05 | N06 | H061 | 161.4° | 20.1° |
| H081 | C08 | C09 | H091 | 172.8° | 177.7° |
| H291 | C29 | C30 | H301 | 0.3° | 0.0° |
| H331 | C33 | C34 | H341 | 3.5° | 0.0° |
| H341 | C34 | C35 | H351 | 2.3° | 0.0° |
| H351 | C35 | C36 | H361 | 3.1° | 0.0° |
| H361 | C36 | C37 | H371 | 5.3° | 0.2° |
| H381 | C38 | C39 | H391 | 1.1° | 0.3° |
| H502 | C50 | N51 | H511 | 162.8° | 137.6° |
| H501 | C50 | N51 | H511 | 45.2° | 101.7° |
| H521 | C52 | C53 | H531 | 1.2° | 0.0° |
| H531 | C53 | C54 | H541 | 2.0° | 0.1° |
| H541 | C54 | C55 | H551 | 1.5° | 0.1° |
| H581 | C58 | C59 | H592 | 177.9° | 61.0° |
| H581 | C58 | C59 | H591 | 54.8° | 59.1° |
| H581 | C58 | N57 | H571 | 146.8° | 127.3° |
| H582 | C58 | C59 | H592 | 65.9° | 59.0° |
| H582 | C58 | C59 | H591 | 171.1° | 179.0° |
| H582 | C58 | N57 | H571 | 97.0° | 112.8° |
| H612 | C61 | C62 | H622 | 157.4° | 54.9° |
| H612 | C61 | C62 | H621 | 85.7° | 65.2° |
| H611 | C61 | C62 | H622 | 36.0° | 65.2° |
| H611 | C61 | C62 | H621 | 152.8° | 174.8° |
| H622 | C62 | N63 | H632 | 58.4° | 64.0° |
| H622 | C62 | N63 | H1 | 178.5° | 60.0° |
| H621 | C62 | N63 | H632 | 58.4° | 175.9° |
| H621 | C62 | N63 | H1 | 61.6° | 60.1° |
