Y15
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C04 | O07 | sing | 1.43Å | 1.42Å | |
| C04 | C05 | sing | 1.53Å | 1.54Å | |
| O07 | C03 | sing | 1.43Å | 1.42Å | |
| C05 | N08 | sing | 1.47Å | 1.47Å | |
| C03 | C02 | sing | 1.53Å | 1.53Å | |
| C14 | C13 | sing | 1.53Å | 1.53Å | |
| C14 | C15 | sing | 1.53Å | 1.52Å | |
| C13 | C12 | sing | 1.53Å | 1.54Å | |
| N08 | C02 | sing | 1.47Å | 1.47Å | |
| N08 | C01 | sing | 1.35Å | 1.38Å | |
| C12 | C11 | sing | 1.53Å | 1.54Å | |
| C12 | C17 | sing | 1.53Å | 1.53Å | |
| C15 | C16 | sing | 1.53Å | 1.53Å | |
| N09 | C01 | sing | 1.35Å | 1.34Å | |
| N09 | C10 | sing | 1.47Å | 1.48Å | |
| C11 | C10 | sing | 1.53Å | 1.54Å | |
| C16 | C17 | sing | 1.53Å | 1.54Å | |
| C01 | O06 | doub | 1.22Å | 1.24Å | |
| O19 | C18 | doub | 1.21Å | 1.23Å | |
| C10 | C18 | sing | 1.51Å | 1.55Å | |
| C18 | N22 | sing | 1.35Å | 1.34Å | |
| N22 | C33 | sing | 1.47Å | 1.48Å | |
| C31 | N32 | trip | 1.14Å | 1.33Å | |
| C31 | C33 | sing | 1.47Å | 1.50Å | |
| C21 | C33 | sing | 1.53Å | 1.54Å | |
| C33 | C20 | sing | 1.53Å | 1.52Å | |
| C20 | O23 | sing | 1.43Å | 1.42Å | |
| O23 | C24 | sing | 1.43Å | 1.43Å | |
| C24 | C25 | sing | 1.51Å | 1.50Å | |
| C30 | C25 | doub | 1.38Å | 1.39Å | Aromatic |
| C30 | C29 | sing | 1.38Å | 1.38Å | Aromatic |
| C25 | C26 | sing | 1.38Å | 1.39Å | Aromatic |
| C29 | C28 | doub | 1.38Å | 1.39Å | Aromatic |
| C26 | C27 | doub | 1.38Å | 1.38Å | Aromatic |
| C28 | C27 | sing | 1.38Å | 1.38Å | Aromatic |
| C02 | H021 | sing | 1.09Å | 1.10Å | |
| C02 | H022 | sing | 1.09Å | 1.10Å | |
| C03 | H031 | sing | 1.09Å | 1.10Å | |
| C03 | H032 | sing | 1.09Å | 1.10Å | |
| C04 | H041 | sing | 1.09Å | 1.10Å | |
| C04 | H042 | sing | 1.09Å | 1.10Å | |
| C05 | H051 | sing | 1.09Å | 1.10Å | |
| C05 | H052 | sing | 1.09Å | 1.10Å | |
| N09 | HN09 | sing | 0.97Å | 1.00Å | |
| C10 | H10 | sing | 1.09Å | 1.10Å | |
| C11 | H111 | sing | 1.09Å | 1.10Å | |
| C11 | H112 | sing | 1.09Å | 1.10Å | |
| C12 | H12 | sing | 1.09Å | 1.10Å | |
| C13 | H131 | sing | 1.09Å | 1.10Å | |
| C13 | H132 | sing | 1.09Å | 1.10Å | |
| C14 | H141 | sing | 1.09Å | 1.10Å | |
| C14 | H142 | sing | 1.09Å | 1.10Å | |
| C15 | H151 | sing | 1.09Å | 1.10Å | |
| C15 | H152 | sing | 1.09Å | 1.10Å | |
| C16 | H161 | sing | 1.09Å | 1.10Å | |
| C16 | H162 | sing | 1.09Å | 1.10Å | |
| C17 | H171 | sing | 1.09Å | 1.10Å | |
| C17 | H172 | sing | 1.09Å | 1.10Å | |
| C20 | H201 | sing | 1.09Å | 1.10Å | |
| C20 | H202 | sing | 1.09Å | 1.10Å | |
| C21 | H211 | sing | 1.09Å | 1.10Å | |
| C21 | H212 | sing | 1.09Å | 1.10Å | |
| C21 | H213 | sing | 1.09Å | 1.10Å | |
| N22 | HN22 | sing | 0.97Å | 1.00Å | |
| C24 | H241 | sing | 1.09Å | 1.10Å | |
| C24 | H242 | sing | 1.09Å | 1.10Å | |
| C26 | H26 | sing | 1.08Å | 1.08Å | |
| C27 | H27 | sing | 1.08Å | 1.08Å | |
| C28 | H28 | sing | 1.08Å | 1.08Å | |
| C29 | H29 | sing | 1.08Å | 1.08Å | |
| C30 | H30 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O07 | C04 | C05 | 110.7° | 109.3° |
| C04 | O07 | C03 | 111.5° | 114.2° |
| O07 | C04 | H041 | 109.1° | 109.5° |
| O07 | C04 | H042 | 108.8° | 109.5° |
| C04 | C05 | N08 | 112.2° | 108.4° |
| C05 | C04 | H041 | 109.0° | 109.6° |
| C05 | C04 | H042 | 108.8° | 109.5° |
| C04 | C05 | H051 | 108.6° | 109.7° |
| C04 | C05 | H052 | 108.0° | 109.7° |
| O07 | C03 | C02 | 109.9° | 109.2° |
| O07 | C03 | H031 | 109.4° | 109.5° |
| O07 | C03 | H032 | 109.3° | 109.5° |
| C05 | N08 | C02 | 117.2° | 118.0° |
| C05 | N08 | C01 | 124.2° | 121.0° |
| N08 | C05 | H051 | 108.5° | 109.7° |
| N08 | C05 | H052 | 107.9° | 109.6° |
| C03 | C02 | N08 | 113.7° | 108.4° |
| C03 | C02 | H021 | 108.1° | 109.7° |
| C03 | C02 | H022 | 107.2° | 109.7° |
| C02 | C03 | H031 | 109.3° | 109.5° |
| C02 | C03 | H032 | 109.2° | 109.5° |
| C13 | C14 | C15 | 111.5° | 109.5° |
| C14 | C13 | C12 | 112.9° | 109.5° |
| C14 | C13 | H131 | 108.4° | 109.5° |
| C14 | C13 | H132 | 107.5° | 109.5° |
| C13 | C14 | H141 | 108.8° | 109.4° |
| C13 | C14 | H142 | 108.3° | 109.5° |
| C14 | C15 | C16 | 111.8° | 109.5° |
| C15 | C14 | H141 | 108.8° | 109.4° |
| C15 | C14 | H142 | 108.4° | 109.5° |
| C14 | C15 | H151 | 108.7° | 109.4° |
| C14 | C15 | H152 | 108.2° | 109.5° |
| C13 | C12 | C11 | 111.5° | 109.5° |
| C13 | C12 | C17 | 107.2° | 109.5° |
| C13 | C12 | H12 | 110.1° | 109.4° |
| C12 | C13 | H131 | 108.4° | 109.5° |
| C12 | C13 | H132 | 107.5° | 109.4° |
| C02 | N08 | C01 | 118.6° | 121.0° |
| N08 | C02 | H021 | 108.1° | 109.6° |
| N08 | C02 | H022 | 107.1° | 109.7° |
| N08 | C01 | N09 | 117.8° | 120.0° |
| N08 | C01 | O06 | 122.0° | 120.0° |
| C11 | C12 | C17 | 110.7° | 109.5° |
| C12 | C11 | C10 | 116.2° | 109.5° |
| C12 | C11 | H111 | 107.3° | 109.5° |
| C12 | C11 | H112 | 105.7° | 109.5° |
| C11 | C12 | H12 | 106.6° | 109.5° |
| C12 | C17 | C16 | 112.1° | 109.5° |
| C17 | C12 | H12 | 110.8° | 109.5° |
| C12 | C17 | H171 | 108.6° | 109.5° |
| C12 | C17 | H172 | 108.0° | 109.4° |
| C15 | C16 | C17 | 111.1° | 109.5° |
| C16 | C15 | H151 | 108.7° | 109.5° |
| C16 | C15 | H152 | 108.2° | 109.4° |
| C15 | C16 | H161 | 108.9° | 109.5° |
| C15 | C16 | H162 | 108.6° | 109.5° |
| C01 | N09 | C10 | 120.4° | 120.0° |
| N09 | C01 | O06 | 120.1° | 120.0° |
| C01 | N09 | HN09 | 119.8° | 120.0° |
| N09 | C10 | C11 | 110.8° | 109.5° |
| N09 | C10 | C18 | 110.4° | 109.5° |
| C10 | N09 | HN09 | 119.8° | 120.0° |
| N09 | C10 | H10 | 108.2° | 109.5° |
| C11 | C10 | C18 | 110.3° | 109.5° |
| C11 | C10 | H10 | 108.3° | 109.4° |
| C10 | C11 | H111 | 107.3° | 109.5° |
| C10 | C11 | H112 | 105.7° | 109.4° |
| C17 | C16 | H161 | 109.0° | 109.5° |
| C17 | C16 | H162 | 108.6° | 109.4° |
| C16 | C17 | H171 | 108.6° | 109.5° |
| C16 | C17 | H172 | 108.0° | 109.5° |
| O19 | C18 | C10 | 120.7° | 120.0° |
| O19 | C18 | N22 | 122.6° | 120.0° |
| C10 | C18 | N22 | 116.7° | 120.0° |
| C18 | C10 | H10 | 108.8° | 109.5° |
| C18 | N22 | C33 | 123.9° | 119.9° |
| C18 | N22 | HN22 | 118.1° | 120.0° |
| N22 | C33 | C31 | 114.6° | 109.5° |
| N22 | C33 | C21 | 110.4° | 109.5° |
| N22 | C33 | C20 | 110.3° | 109.5° |
| C33 | N22 | HN22 | 118.1° | 120.0° |
| N32 | C31 | C33 | 126.3° | 180.0° |
| C31 | C33 | C21 | 107.5° | 109.5° |
| C31 | C33 | C20 | 106.6° | 109.4° |
| C21 | C33 | C20 | 107.2° | 109.5° |
| C33 | C21 | H211 | 109.5° | 109.5° |
| C33 | C21 | H212 | 109.4° | 109.5° |
| C33 | C21 | H213 | 109.4° | 109.5° |
| C33 | C20 | O23 | 110.1° | 109.5° |
| C33 | C20 | H201 | 109.3° | 109.5° |
| C33 | C20 | H202 | 109.1° | 109.4° |
| C20 | O23 | C24 | 111.5° | 114.0° |
| O23 | C20 | H201 | 109.3° | 109.5° |
| O23 | C20 | H202 | 109.1° | 109.5° |
| O23 | C24 | C25 | 109.8° | 109.5° |
| O23 | C24 | H241 | 109.4° | 109.5° |
| O23 | C24 | H242 | 109.3° | 109.5° |
| C24 | C25 | C30 | 120.7° | 120.0° |
| C24 | C25 | C26 | 120.3° | 120.0° |
| C25 | C24 | H241 | 109.4° | 109.5° |
| C25 | C24 | H242 | 109.3° | 109.4° |
| C25 | C30 | C29 | 120.8° | 120.0° |
| C30 | C25 | C26 | 118.9° | 120.0° |
| C25 | C30 | H30 | 119.6° | 119.9° |
| C30 | C29 | C28 | 119.6° | 120.0° |
| C30 | C29 | H29 | 120.2° | 119.9° |
| C29 | C30 | H30 | 119.6° | 120.1° |
| C25 | C26 | C27 | 120.7° | 120.0° |
| C25 | C26 | H26 | 119.7° | 120.0° |
| C29 | C28 | C27 | 119.9° | 120.0° |
| C29 | C28 | H28 | 120.0° | 120.0° |
| C28 | C29 | H29 | 120.2° | 120.1° |
| C26 | C27 | C28 | 120.0° | 120.0° |
| C27 | C26 | H26 | 119.7° | 120.0° |
| C26 | C27 | H27 | 120.0° | 120.0° |
| C28 | C27 | H27 | 120.0° | 120.0° |
| C27 | C28 | H28 | 120.0° | 120.0° |
| H021 | C02 | H022 | 112.8° | 109.7° |
| H031 | C03 | H032 | 109.8° | 109.5° |
| H041 | C04 | H042 | 110.4° | 109.5° |
| H051 | C05 | H052 | 111.6° | 109.7° |
| H111 | C11 | H112 | 115.0° | 109.5° |
| H131 | C13 | H132 | 112.2° | 109.5° |
| H141 | C14 | H142 | 111.0° | 109.5° |
| H151 | C15 | H152 | 111.3° | 109.5° |
| H161 | C16 | H162 | 110.7° | 109.4° |
| H171 | C17 | H172 | 111.5° | 109.5° |
| H201 | C20 | H202 | 110.0° | 109.4° |
| H211 | C21 | H212 | 109.5° | 109.4° |
| H211 | C21 | H213 | 109.4° | 109.4° |
| H212 | C21 | H213 | 109.5° | 109.5° |
| H241 | C24 | H242 | 109.7° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O07 | C04 | C05 | H041 | 120.0° | 120.0° |
| O07 | C04 | C05 | H042 | 119.5° | 119.9° |
| O07 | C04 | C05 | N08 | 48.3° | 52.2° |
| C04 | O07 | C03 | C02 | 63.4° | 62.5° |
| C04 | O07 | C03 | H031 | 56.6° | 57.4° |
| C04 | O07 | C03 | H032 | 176.8° | 177.5° |
| O07 | C04 | H041 | H042 | 119.5° | 120.1° |
| O07 | C04 | C05 | H051 | 71.7° | 172.0° |
| O07 | C04 | C05 | H052 | 167.1° | 67.4° |
| C05 | C04 | O07 | C03 | 63.8° | 62.5° |
| C04 | C05 | N08 | H051 | 120.0° | 119.8° |
| C04 | C05 | N08 | H052 | 118.8° | 119.7° |
| C04 | C05 | N08 | C02 | 36.3° | 50.5° |
| C04 | C05 | N08 | C01 | 145.7° | 129.5° |
| C05 | C04 | H041 | H042 | 119.4° | 120.1° |
| C04 | C05 | H051 | H052 | 118.9° | 120.5° |
| O07 | C03 | C02 | H031 | 120.0° | 119.9° |
| O07 | C03 | C02 | H032 | 119.8° | 120.0° |
| O07 | C03 | C02 | N08 | 48.6° | 52.3° |
| O07 | C03 | C02 | H021 | 168.6° | 67.4° |
| O07 | C03 | C02 | H022 | 69.5° | 172.1° |
| O07 | C03 | H031 | H032 | 119.9° | 120.1° |
| C03 | O07 | C04 | H041 | 176.2° | 177.5° |
| C03 | O07 | C04 | H042 | 55.7° | 57.4° |
| C05 | N08 | C02 | C03 | 36.9° | 50.5° |
| C05 | N08 | C02 | C01 | 178.1° | 179.9° |
| C05 | N08 | C01 | N09 | 12.0° | 175.3° |
| C05 | N08 | C01 | O06 | 167.0° | 5.0° |
| C05 | N08 | C02 | H021 | 156.9° | 69.3° |
| C05 | N08 | C02 | H022 | 81.2° | 170.3° |
| N08 | C05 | C04 | H041 | 168.3° | 172.2° |
| N08 | C05 | C04 | H042 | 71.2° | 67.7° |
| N08 | C05 | H051 | H052 | 118.8° | 120.5° |
| C03 | C02 | N08 | H021 | 120.0° | 119.8° |
| C03 | C02 | N08 | H022 | 118.2° | 119.8° |
| C03 | C02 | N08 | C01 | 144.9° | 129.4° |
| C03 | C02 | H021 | H022 | 118.3° | 120.5° |
| C02 | C03 | H031 | H032 | 119.8° | 120.1° |
| C13 | C14 | C15 | H141 | 120.0° | 119.9° |
| C13 | C14 | C15 | H142 | 119.1° | 120.0° |
| C14 | C13 | C12 | H131 | 120.0° | 120.0° |
| C14 | C13 | C12 | H132 | 118.5° | 120.0° |
| C14 | C13 | C12 | C11 | 179.2° | 180.0° |
| C14 | C13 | C12 | C17 | 57.8° | 60.0° |
| C13 | C14 | C15 | C16 | 51.6° | 60.0° |
| C14 | C13 | C12 | H12 | 62.8° | 60.0° |
| C14 | C13 | H131 | H132 | 118.6° | 120.0° |
| C13 | C14 | H141 | H142 | 119.2° | 120.0° |
| C13 | C14 | C15 | H151 | 171.5° | 180.0° |
| C13 | C14 | C15 | H152 | 67.5° | 60.0° |
| C15 | C14 | C13 | C12 | 55.6° | 59.9° |
| C14 | C15 | C16 | H151 | 120.0° | 120.0° |
| C14 | C15 | C16 | H152 | 119.0° | 120.0° |
| C14 | C15 | C16 | C17 | 52.6° | 60.0° |
| C15 | C14 | C13 | H131 | 64.5° | 180.0° |
| C15 | C14 | C13 | H132 | 174.0° | 60.0° |
| C15 | C14 | H141 | H142 | 119.2° | 120.0° |
| C14 | C15 | H151 | H152 | 119.1° | 120.0° |
| C14 | C15 | C16 | H161 | 67.4° | 60.0° |
| C14 | C15 | C16 | H162 | 171.9° | 180.0° |
| C13 | C12 | C11 | C17 | 119.3° | 120.0° |
| C13 | C12 | C11 | H12 | 120.1° | 120.0° |
| C13 | C12 | C17 | H12 | 120.2° | 120.0° |
| C13 | C12 | C11 | C10 | 174.7° | 65.6° |
| C13 | C12 | C17 | C16 | 58.7° | 60.0° |
| C13 | C12 | C11 | H111 | 54.7° | 54.4° |
| C13 | C12 | C11 | H112 | 68.4° | 174.5° |
| C12 | C13 | H131 | H132 | 118.6° | 120.0° |
| C12 | C13 | C14 | H141 | 64.5° | 60.0° |
| C12 | C13 | C14 | H142 | 174.7° | 180.0° |
| C13 | C12 | C17 | H171 | 61.3° | 60.0° |
| C13 | C12 | C17 | H172 | 177.6° | 180.0° |
| C02 | N08 | C01 | N09 | 170.0° | 4.8° |
| C02 | N08 | C01 | O06 | 11.0° | 174.9° |
| N08 | C02 | H021 | H022 | 118.3° | 120.5° |
| N08 | C02 | C03 | H031 | 71.4° | 67.6° |
| N08 | C02 | C03 | H032 | 168.5° | 172.3° |
| C02 | N08 | C05 | H051 | 83.7° | 170.3° |
| C02 | N08 | C05 | H052 | 155.1° | 69.2° |
| N08 | C01 | N09 | O06 | 179.0° | 179.7° |
| N08 | C01 | N09 | C10 | 178.3° | 175.3° |
| C01 | N08 | C02 | H021 | 24.9° | 110.8° |
| C01 | N08 | C02 | H022 | 96.9° | 9.6° |
| C01 | N08 | C05 | H051 | 94.3° | 9.7° |
| C01 | N08 | C05 | H052 | 26.8° | 110.8° |
| N08 | C01 | N09 | HN09 | 1.7° | 4.7° |
| C11 | C12 | C17 | H12 | 118.0° | 120.0° |
| C12 | C11 | C10 | N09 | 55.6° | 175.1° |
| C12 | C11 | C10 | H111 | 120.0° | 120.0° |
| C12 | C11 | C10 | H112 | 116.9° | 119.9° |
| C11 | C12 | C17 | C16 | 179.5° | 180.0° |
| C12 | C11 | C10 | C18 | 178.1° | 64.9° |
| C12 | C11 | C10 | H10 | 62.9° | 55.1° |
| C12 | C11 | H111 | H112 | 117.2° | 120.0° |
| C11 | C12 | C13 | H131 | 59.1° | 60.0° |
| C11 | C12 | C13 | H132 | 62.4° | 60.0° |
| C11 | C12 | C17 | H171 | 60.5° | 60.0° |
| C11 | C12 | C17 | H172 | 60.6° | 60.1° |
| C12 | C17 | C16 | C15 | 57.5° | 60.0° |
| C17 | C12 | C11 | C10 | 55.4° | 174.4° |
| C12 | C17 | C16 | H171 | 120.0° | 120.0° |
| C12 | C17 | C16 | H172 | 118.9° | 119.9° |
| C17 | C12 | C11 | H111 | 64.6° | 65.6° |
| C17 | C12 | C11 | H112 | 172.3° | 54.5° |
| C17 | C12 | C13 | H131 | 62.2° | 180.0° |
| C17 | C12 | C13 | H132 | 176.3° | 60.0° |
| C12 | C17 | C16 | H161 | 62.5° | 60.0° |
| C12 | C17 | C16 | H162 | 176.9° | 179.9° |
| C12 | C17 | H171 | H172 | 118.9° | 120.0° |
| C15 | C16 | C17 | H161 | 120.0° | 120.0° |
| C15 | C16 | C17 | H162 | 119.3° | 120.0° |
| C16 | C15 | C14 | H141 | 68.5° | 60.0° |
| C16 | C15 | C14 | H142 | 170.7° | 180.0° |
| C16 | C15 | H151 | H152 | 119.0° | 120.0° |
| C15 | C16 | H161 | H162 | 119.3° | 120.1° |
| C15 | C16 | C17 | H171 | 62.5° | 60.0° |
| C15 | C16 | C17 | H172 | 176.4° | 179.9° |
| C01 | N09 | C10 | HN09 | 180.0° | 180.0° |
| C01 | N09 | C10 | C11 | 173.1° | 89.0° |
| C01 | N09 | C10 | C18 | 64.5° | 150.9° |
| C01 | N09 | C10 | H10 | 54.5° | 30.9° |
| N09 | C10 | C11 | C18 | 122.5° | 120.0° |
| N09 | C10 | C11 | H10 | 118.6° | 120.0° |
| C10 | N09 | C01 | O06 | 2.7° | 5.0° |
| N09 | C10 | C18 | O19 | 48.7° | 18.4° |
| N09 | C10 | C18 | H10 | 118.6° | 120.0° |
| N09 | C10 | C18 | N22 | 132.1° | 161.6° |
| N09 | C10 | C11 | H111 | 175.6° | 55.1° |
| N09 | C10 | C11 | H112 | 61.2° | 65.0° |
| C11 | C10 | C18 | O19 | 74.1° | 101.7° |
| C11 | C10 | C18 | H10 | 118.7° | 120.0° |
| C11 | C10 | C18 | N22 | 105.1° | 78.3° |
| C11 | C10 | N09 | HN09 | 6.9° | 91.0° |
| C10 | C11 | H111 | H112 | 117.2° | 120.0° |
| C10 | C11 | C12 | H12 | 65.2° | 54.3° |
| C16 | C17 | C12 | H12 | 61.5° | 60.0° |
| C17 | C16 | C15 | H151 | 172.6° | 180.0° |
| C17 | C16 | C15 | H152 | 66.4° | 60.0° |
| C17 | C16 | H161 | H162 | 119.4° | 119.9° |
| C16 | C17 | H171 | H172 | 118.9° | 120.0° |
| O06 | C01 | N09 | HN09 | 177.3° | 175.0° |
| O19 | C18 | C10 | N22 | 179.2° | 180.0° |
| O19 | C18 | N22 | C33 | 3.8° | 4.5° |
| O19 | C18 | C10 | H10 | 167.2° | 138.3° |
| O19 | C18 | N22 | HN22 | 176.2° | 175.5° |
| C10 | C18 | N22 | C33 | 176.9° | 175.5° |
| C18 | C10 | N09 | HN09 | 115.5° | 29.1° |
| C18 | C10 | C11 | H111 | 61.9° | 175.1° |
| C18 | C10 | C11 | H112 | 61.3° | 55.1° |
| C10 | C18 | N22 | HN22 | 3.0° | 4.5° |
| C18 | N22 | C33 | HN22 | 180.0° | 180.0° |
| C18 | N22 | C33 | C31 | 59.8° | 60.0° |
| C18 | N22 | C33 | C21 | 61.8° | 60.0° |
| C18 | N22 | C33 | C20 | 180.0° | 180.0° |
| N22 | C18 | C10 | H10 | 13.5° | 41.6° |
| N22 | C33 | C31 | N32 | 177.4° | 62.1° |
| N22 | C33 | C31 | C21 | 123.1° | 120.1° |
| N22 | C33 | C31 | C20 | 122.3° | 120.0° |
| N22 | C33 | C21 | C20 | 120.1° | 120.0° |
| N22 | C33 | C20 | O23 | 48.4° | 180.0° |
| N22 | C33 | C20 | H201 | 71.6° | 59.9° |
| N22 | C33 | C20 | H202 | 168.1° | 60.0° |
| N22 | C33 | C21 | H211 | 127.0° | 60.0° |
| N22 | C33 | C21 | H212 | 113.0° | 180.0° |
| N22 | C33 | C21 | H213 | 7.0° | 60.0° |
| N32 | C31 | C33 | C21 | 59.5° | 58.0° |
| N32 | C31 | C33 | C20 | 55.1° | 177.9° |
| C31 | C33 | C21 | C20 | 114.3° | 119.9° |
| C31 | C33 | C20 | O23 | 173.3° | 60.0° |
| C31 | C33 | C20 | H201 | 53.3° | 60.1° |
| C31 | C33 | C20 | H202 | 66.9° | 180.0° |
| C31 | C33 | C21 | H211 | 107.4° | 180.0° |
| C31 | C33 | C21 | H212 | 12.6° | 59.9° |
| C31 | C33 | C21 | H213 | 132.6° | 60.1° |
| C31 | C33 | N22 | HN22 | 120.3° | 120.0° |
| C21 | C33 | C20 | O23 | 71.8° | 60.0° |
| C21 | C33 | C20 | H201 | 168.2° | 180.0° |
| C21 | C33 | C20 | H202 | 47.9° | 60.0° |
| C33 | C21 | H211 | H212 | 120.0° | 120.1° |
| C33 | C21 | H211 | H213 | 120.0° | 120.0° |
| C33 | C21 | H212 | H213 | 120.0° | 120.0° |
| C21 | C33 | N22 | HN22 | 118.2° | 120.0° |
| C33 | C20 | O23 | H201 | 120.0° | 120.0° |
| C33 | C20 | O23 | H202 | 119.7° | 120.0° |
| C33 | C20 | O23 | C24 | 142.4° | 180.0° |
| C33 | C20 | H201 | H202 | 119.7° | 119.9° |
| C20 | C33 | C21 | H211 | 6.9° | 60.0° |
| C20 | C33 | C21 | H212 | 126.9° | 60.0° |
| C20 | C33 | C21 | H213 | 113.1° | 180.0° |
| C20 | C33 | N22 | HN22 | 0.0° | 0.0° |
| C20 | O23 | C24 | C25 | 63.2° | 180.0° |
| O23 | C20 | H201 | H202 | 119.8° | 120.0° |
| C20 | O23 | C24 | H241 | 56.8° | 60.0° |
| C20 | O23 | C24 | H242 | 176.9° | 60.0° |
| O23 | C24 | C25 | H241 | 120.0° | 120.0° |
| O23 | C24 | C25 | H242 | 119.9° | 120.0° |
| O23 | C24 | C25 | C30 | 34.4° | 90.3° |
| O23 | C24 | C25 | C26 | 145.5° | 90.0° |
| C24 | O23 | C20 | H201 | 97.6° | 60.0° |
| C24 | O23 | C20 | H202 | 22.7° | 60.0° |
| O23 | C24 | H241 | H242 | 119.9° | 120.0° |
| C24 | C25 | C30 | C26 | 180.0° | 179.6° |
| C24 | C25 | C30 | C29 | 179.7° | 179.7° |
| C24 | C25 | C26 | C27 | 179.7° | 180.0° |
| C25 | C24 | H241 | H242 | 119.9° | 120.0° |
| C24 | C25 | C26 | H26 | 0.3° | 0.1° |
| C24 | C25 | C30 | H30 | 0.3° | 0.1° |
| C25 | C30 | C29 | H30 | 180.0° | 179.7° |
| C25 | C30 | C29 | C28 | 0.2° | 0.6° |
| C30 | C25 | C26 | C27 | 0.3° | 0.3° |
| C30 | C25 | C24 | H241 | 154.4° | 149.7° |
| C30 | C25 | C24 | H242 | 85.4° | 29.7° |
| C30 | C25 | C26 | H26 | 179.7° | 179.8° |
| C25 | C30 | C29 | H29 | 179.8° | 179.7° |
| C29 | C30 | C25 | C26 | 0.4° | 0.6° |
| C30 | C29 | C28 | H29 | 180.0° | 179.8° |
| C30 | C29 | C28 | C27 | 0.0° | 0.2° |
| C30 | C29 | C28 | H28 | 180.0° | 179.8° |
| C25 | C26 | C27 | H26 | 180.0° | 179.9° |
| C25 | C26 | C27 | C28 | 0.2° | 0.0° |
| C26 | C25 | C24 | H241 | 25.5° | 29.9° |
| C26 | C25 | C24 | H242 | 94.6° | 150.0° |
| C25 | C26 | C27 | H27 | 179.8° | 179.9° |
| C26 | C25 | C30 | H30 | 179.6° | 179.7° |
| C29 | C28 | C27 | C26 | 0.0° | 0.1° |
| C29 | C28 | C27 | H28 | 180.0° | 180.0° |
| C29 | C28 | C27 | H27 | 180.0° | 179.9° |
| C28 | C29 | C30 | H30 | 179.8° | 179.8° |
| C26 | C27 | C28 | H27 | 180.0° | 179.9° |
| C26 | C27 | C28 | H28 | 180.0° | 180.0° |
| C28 | C27 | C26 | H26 | 179.8° | 179.9° |
| C27 | C28 | C29 | H29 | 180.0° | 180.0° |
| H021 | C02 | C03 | H031 | 48.6° | 172.7° |
| H021 | C02 | C03 | H032 | 71.5° | 52.6° |
| H022 | C02 | C03 | H031 | 170.4° | 52.1° |
| H022 | C02 | C03 | H032 | 50.3° | 68.0° |
| H041 | C04 | C05 | H051 | 48.3° | 68.0° |
| H041 | C04 | C05 | H052 | 72.9° | 52.6° |
| H042 | C04 | C05 | H051 | 168.8° | 52.1° |
| H042 | C04 | C05 | H052 | 47.6° | 172.7° |
| HN09 | N09 | C10 | H10 | 125.5° | 149.1° |
| H10 | C10 | C11 | H111 | 57.0° | 64.9° |
| H10 | C10 | C11 | H112 | 179.8° | 175.1° |
| H111 | C11 | C12 | H12 | 174.8° | 174.4° |
| H112 | C11 | C12 | H12 | 51.7° | 65.6° |
| H12 | C12 | C13 | H131 | 177.2° | 60.0° |
| H12 | C12 | C13 | H132 | 55.7° | 180.0° |
| H12 | C12 | C17 | H171 | 178.5° | NaN° |
| H12 | C12 | C17 | H172 | 57.4° | 60.0° |
| H131 | C13 | C14 | H141 | 175.5° | 60.0° |
| H131 | C13 | C14 | H142 | 54.7° | 60.0° |
| H132 | C13 | C14 | H141 | 54.0° | 180.0° |
| H132 | C13 | C14 | H142 | 66.8° | 60.0° |
| H141 | C14 | C15 | H151 | 51.5° | 60.1° |
| H141 | C14 | C15 | H152 | 172.5° | 179.9° |
| H142 | C14 | C15 | H151 | 69.3° | 60.0° |
| H142 | C14 | C15 | H152 | 51.7° | 60.0° |
| H151 | C15 | C16 | H161 | 52.6° | 60.0° |
| H151 | C15 | C16 | H162 | 68.1° | 60.0° |
| H152 | C15 | C16 | H161 | 173.6° | 180.0° |
| H152 | C15 | C16 | H162 | 52.9° | 60.0° |
| H161 | C16 | C17 | H171 | 177.5° | 179.9° |
| H161 | C16 | C17 | H172 | 56.4° | 59.9° |
| H162 | C16 | C17 | H171 | 56.8° | 60.0° |
| H162 | C16 | C17 | H172 | 64.3° | 60.0° |
| H211 | C21 | H212 | H213 | 120.0° | 119.9° |
| H26 | C26 | C27 | H27 | 0.2° | 0.0° |
| H27 | C27 | C28 | H28 | 0.0° | 0.1° |
| H28 | C28 | C29 | H29 | 0.0° | 0.0° |
| H29 | C29 | C30 | H30 | 0.2° | 0.0° |
