A1C9W
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C02 | C01 | sing | 1.53Å | 1.55Å | |
| C03 | C02 | sing | 1.53Å | 1.54Å | |
| C05 | N04 | sing | 1.35Å | 1.47Å | |
| O06 | C05 | doub | 1.22Å | 1.18Å | |
| N07 | C05 | sing | 1.35Å | 1.47Å | |
| C08 | N07 | sing | 1.40Å | 1.47Å | |
| C09 | C08 | doub | 1.39Å | 1.39Å | Aromatic |
| C10 | C09 | sing | 1.38Å | 1.39Å | Aromatic |
| C11 | C10 | doub | 1.38Å | 1.39Å | Aromatic |
| C12 | C11 | sing | 1.40Å | 1.39Å | Aromatic |
| O14 | C13 | doub | 1.22Å | 1.18Å | |
| N15 | C13 | sing | 1.35Å | 1.46Å | |
| C16 | N15 | sing | 1.47Å | 1.49Å | |
| C17 | C16 | sing | 1.53Å | 1.47Å | |
| C18 | C17 | sing | 1.53Å | 1.48Å | |
| C19 | C18 | sing | 1.51Å | 1.53Å | |
| O20 | C19 | doub | 1.21Å | 1.18Å | |
| N21 | C19 | sing | 1.34Å | 1.49Å | |
| C22 | N21 | sing | 1.34Å | 1.50Å | |
| O23 | C22 | doub | 1.21Å | 1.18Å | |
| C13 | C12 | sing | 1.48Å | 1.54Å | |
| C24 | C12 | doub | 1.40Å | 1.39Å | Aromatic |
| F25 | C24 | sing | 1.35Å | 1.36Å | |
| N04 | C02 | sing | 1.47Å | 1.48Å | |
| C26 | C02 | sing | 1.51Å | 1.55Å | |
| C27 | C26 | doub | 1.38Å | 1.39Å | Aromatic |
| C28 | C27 | sing | 1.38Å | 1.39Å | Aromatic |
| C29 | C28 | doub | 1.38Å | 1.39Å | Aromatic |
| C31 | C30 | doub | 1.38Å | 1.39Å | Aromatic |
| C30 | C29 | sing | 1.38Å | 1.39Å | Aromatic |
| C32 | C29 | sing | 1.51Å | 1.54Å | |
| C34 | C33 | sing | 1.53Å | 1.53Å | |
| C33 | C32 | sing | 1.53Å | 1.53Å | |
| C35 | C32 | sing | 1.53Å | 1.54Å | |
| F36 | C35 | sing | 1.40Å | 1.36Å | |
| F37 | C35 | sing | 1.40Å | 1.36Å | |
| F38 | C35 | sing | 1.40Å | 1.36Å | |
| C08 | C24 | sing | 1.39Å | 1.39Å | Aromatic |
| C16 | C22 | sing | 1.51Å | 1.54Å | |
| C26 | C31 | sing | 1.38Å | 1.39Å | Aromatic |
| C32 | C34 | sing | 1.53Å | 1.53Å | |
| C10 | H101 | sing | 1.08Å | 1.08Å | |
| C17 | H171 | sing | 1.09Å | 1.10Å | |
| C17 | H172 | sing | 1.09Å | 1.10Å | |
| C28 | H281 | sing | 1.08Å | 1.08Å | |
| C01 | H013 | sing | 1.09Å | 1.10Å | |
| C01 | H011 | sing | 1.09Å | 1.10Å | |
| C01 | H012 | sing | 1.09Å | 1.10Å | |
| C03 | H032 | sing | 1.09Å | 1.10Å | |
| C03 | H031 | sing | 1.09Å | 1.10Å | |
| C03 | H033 | sing | 1.09Å | 1.10Å | |
| C09 | H091 | sing | 1.08Å | 1.08Å | |
| C11 | H111 | sing | 1.08Å | 1.08Å | |
| C16 | H161 | sing | 1.09Å | 1.10Å | |
| C18 | H182 | sing | 1.09Å | 1.10Å | |
| C18 | H181 | sing | 1.09Å | 1.10Å | |
| C27 | H271 | sing | 1.08Å | 1.08Å | |
| C30 | H301 | sing | 1.08Å | 1.08Å | |
| C31 | H311 | sing | 1.08Å | 1.08Å | |
| C33 | H331 | sing | 1.09Å | 1.10Å | |
| C33 | H332 | sing | 1.09Å | 1.10Å | |
| C34 | H341 | sing | 1.09Å | 1.10Å | |
| C34 | H342 | sing | 1.09Å | 1.10Å | |
| N04 | H041 | sing | 0.97Å | 1.00Å | |
| N07 | H071 | sing | 0.97Å | 1.00Å | |
| N15 | H151 | sing | 0.97Å | 1.00Å | |
| N21 | H211 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C01 | C02 | C03 | 109.3° | 109.5° |
| C01 | C02 | N04 | 109.7° | 109.5° |
| C01 | C02 | C26 | 109.0° | 109.5° |
| C02 | C01 | H013 | 109.5° | 109.5° |
| C02 | C01 | H011 | 109.5° | 109.5° |
| C02 | C01 | H012 | 109.5° | 109.5° |
| C03 | C02 | N04 | 108.3° | 109.5° |
| C03 | C02 | C26 | 108.2° | 109.5° |
| C02 | C03 | H032 | 109.5° | 109.5° |
| C02 | C03 | H031 | 109.5° | 109.5° |
| C02 | C03 | H033 | 109.5° | 109.5° |
| N04 | C05 | O06 | 120.1° | 120.0° |
| N04 | C05 | N07 | 118.8° | 120.0° |
| C05 | N04 | C02 | 121.5° | 120.0° |
| C05 | N04 | H041 | 119.3° | 120.1° |
| O06 | C05 | N07 | 121.1° | 120.0° |
| C05 | N07 | C08 | 122.1° | 120.0° |
| C05 | N07 | H071 | 118.9° | 120.0° |
| N07 | C08 | C09 | 122.4° | 120.0° |
| N07 | C08 | C24 | 118.0° | 120.0° |
| C08 | N07 | H071 | 119.0° | 120.0° |
| C08 | C09 | C10 | 120.0° | 120.3° |
| C09 | C08 | C24 | 119.6° | 119.9° |
| C08 | C09 | H091 | 120.0° | 119.8° |
| C09 | C10 | C11 | 120.2° | 120.3° |
| C09 | C10 | H101 | 119.9° | 119.8° |
| C10 | C09 | H091 | 120.0° | 119.9° |
| C10 | C11 | C12 | 119.6° | 120.1° |
| C11 | C10 | H101 | 119.9° | 119.9° |
| C10 | C11 | H111 | 120.2° | 119.9° |
| C11 | C12 | C13 | 121.3° | 120.2° |
| C11 | C12 | C24 | 119.9° | 119.7° |
| C12 | C11 | H111 | 120.2° | 120.0° |
| O14 | C13 | N15 | 120.2° | 120.0° |
| O14 | C13 | C12 | 120.9° | 120.0° |
| C13 | N15 | C16 | 120.6° | 120.0° |
| N15 | C13 | C12 | 118.9° | 120.0° |
| C13 | N15 | H151 | 119.7° | 120.1° |
| N15 | C16 | C17 | 108.3° | 109.5° |
| N15 | C16 | C22 | 106.0° | 109.5° |
| N15 | C16 | H161 | 109.4° | 109.5° |
| C16 | N15 | H151 | 119.7° | 120.0° |
| C16 | C17 | C18 | 111.2° | 108.6° |
| C17 | C16 | C22 | 114.6° | 109.1° |
| C16 | C17 | H171 | 109.0° | 109.6° |
| C16 | C17 | H172 | 109.0° | 109.6° |
| C17 | C16 | H161 | 109.6° | 109.5° |
| C17 | C18 | C19 | 112.4° | 109.2° |
| C18 | C17 | H171 | 109.0° | 109.6° |
| C18 | C17 | H172 | 109.1° | 109.8° |
| C17 | C18 | H182 | 108.7° | 109.5° |
| C17 | C18 | H181 | 108.7° | 109.5° |
| C18 | C19 | O20 | 123.1° | 119.3° |
| C18 | C19 | N21 | 114.8° | 121.3° |
| C19 | C18 | H182 | 108.8° | 109.5° |
| C19 | C18 | H181 | 108.7° | 109.6° |
| O20 | C19 | N21 | 122.1° | 119.4° |
| C19 | N21 | C22 | 122.3° | 122.6° |
| C19 | N21 | H211 | 118.9° | 118.7° |
| N21 | C22 | O23 | 122.0° | 119.4° |
| N21 | C22 | C16 | 115.6° | 121.3° |
| C22 | N21 | H211 | 118.8° | 118.7° |
| O23 | C22 | C16 | 122.4° | 119.3° |
| C13 | C12 | C24 | 118.8° | 120.1° |
| C12 | C24 | F25 | 120.0° | 120.1° |
| C12 | C24 | C08 | 120.7° | 119.7° |
| F25 | C24 | C08 | 119.3° | 120.1° |
| N04 | C02 | C26 | 112.4° | 109.4° |
| C02 | N04 | H041 | 119.3° | 120.0° |
| C02 | C26 | C27 | 120.9° | 120.0° |
| C02 | C26 | C31 | 119.0° | 120.0° |
| C26 | C27 | C28 | 119.8° | 120.0° |
| C27 | C26 | C31 | 120.1° | 120.0° |
| C26 | C27 | H271 | 120.1° | 120.0° |
| C27 | C28 | C29 | 120.0° | 120.0° |
| C27 | C28 | H281 | 120.0° | 120.0° |
| C28 | C27 | H271 | 120.1° | 120.0° |
| C28 | C29 | C30 | 120.2° | 120.0° |
| C28 | C29 | C32 | 119.7° | 120.0° |
| C29 | C28 | H281 | 120.0° | 120.1° |
| C31 | C30 | C29 | 119.8° | 120.0° |
| C30 | C31 | C26 | 120.1° | 120.0° |
| C31 | C30 | H301 | 120.1° | 120.0° |
| C30 | C31 | H311 | 119.9° | 120.0° |
| C30 | C29 | C32 | 120.1° | 120.0° |
| C29 | C30 | H301 | 120.1° | 120.0° |
| C29 | C32 | C33 | 129.7° | 117.5° |
| C29 | C32 | C35 | 109.1° | 115.6° |
| C29 | C32 | C34 | 129.4° | 117.5° |
| C34 | C33 | C32 | 60.3° | 60.0° |
| C33 | C34 | C32 | 59.9° | 60.0° |
| C34 | C33 | H331 | 119.9° | 117.5° |
| C34 | C33 | H332 | 120.0° | 117.5° |
| C33 | C34 | H341 | 120.0° | 117.5° |
| C33 | C34 | H342 | 120.0° | 117.5° |
| C33 | C32 | C35 | 110.2° | 117.5° |
| C33 | C32 | C34 | 59.8° | 60.0° |
| C32 | C33 | H331 | 119.9° | 117.5° |
| C32 | C33 | H332 | 119.9° | 117.5° |
| C32 | C35 | F36 | 109.7° | 109.5° |
| C32 | C35 | F37 | 109.3° | 109.5° |
| C32 | C35 | F38 | 111.6° | 109.5° |
| C35 | C32 | C34 | 110.5° | 117.5° |
| F36 | C35 | F37 | 109.3° | 109.5° |
| F36 | C35 | F38 | 108.1° | 109.5° |
| F37 | C35 | F38 | 108.8° | 109.5° |
| C22 | C16 | H161 | 108.8° | 109.6° |
| C26 | C31 | H311 | 120.0° | 120.0° |
| C32 | C34 | H341 | 120.0° | 117.5° |
| C32 | C34 | H342 | 120.0° | 117.5° |
| H171 | C17 | H172 | 109.5° | 109.7° |
| H013 | C01 | H011 | 109.5° | 109.5° |
| H013 | C01 | H012 | 109.5° | 109.4° |
| H011 | C01 | H012 | 109.5° | 109.5° |
| H032 | C03 | H031 | 109.5° | 109.5° |
| H032 | C03 | H033 | 109.5° | 109.5° |
| H031 | C03 | H033 | 109.5° | 109.4° |
| H182 | C18 | H181 | 109.5° | 109.5° |
| H331 | C33 | H332 | 109.5° | 115.5° |
| H341 | C34 | H342 | 109.5° | 115.6° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C01 | C02 | C03 | N04 | 119.4° | 120.0° |
| C01 | C02 | C03 | C26 | 118.5° | 120.0° |
| C01 | C02 | N04 | C05 | 58.3° | 59.1° |
| C01 | C02 | N04 | C26 | 121.4° | 120.0° |
| C01 | C02 | C26 | C27 | 138.9° | 84.1° |
| C01 | C02 | C26 | C31 | 41.7° | 95.6° |
| C02 | C01 | H013 | H011 | 120.0° | 120.0° |
| C02 | C01 | H013 | H012 | 120.0° | 120.0° |
| C02 | C01 | H011 | H012 | 120.0° | 120.0° |
| C01 | C02 | C03 | H032 | 180.0° | 180.0° |
| C01 | C02 | C03 | H031 | 60.0° | 60.0° |
| C01 | C02 | C03 | H033 | 60.0° | 60.0° |
| C01 | C02 | N04 | H041 | 121.6° | 120.9° |
| C03 | C02 | N04 | C05 | 177.5° | 61.0° |
| C03 | C02 | N04 | C26 | 119.4° | 120.0° |
| C03 | C02 | C26 | C27 | 102.4° | 35.9° |
| C03 | C02 | C26 | C31 | 77.0° | 144.4° |
| C03 | C02 | C01 | H013 | 180.0° | 60.0° |
| C03 | C02 | C01 | H011 | 60.0° | 60.0° |
| C03 | C02 | C01 | H012 | 60.0° | 180.0° |
| C02 | C03 | H032 | H031 | 120.0° | 120.0° |
| C02 | C03 | H032 | H033 | 120.0° | 120.1° |
| C02 | C03 | H031 | H033 | 120.0° | 120.0° |
| C03 | C02 | N04 | H041 | 2.5° | 119.0° |
| N04 | C05 | O06 | N07 | 179.7° | 180.0° |
| N04 | C05 | N07 | C08 | 179.4° | 175.6° |
| C05 | N04 | C02 | H041 | 180.0° | 180.0° |
| C05 | N04 | C02 | C26 | 63.1° | 179.1° |
| N04 | C05 | N07 | H071 | 0.6° | 4.3° |
| O06 | C05 | N07 | C08 | 0.3° | 4.3° |
| O06 | C05 | N04 | C02 | 0.8° | 0.0° |
| O06 | C05 | N04 | H041 | 179.3° | 180.0° |
| O06 | C05 | N07 | H071 | 179.7° | 175.7° |
| C05 | N07 | C08 | H071 | 180.0° | 180.0° |
| C05 | N07 | C08 | C09 | 33.6° | 28.2° |
| N07 | C05 | N04 | C02 | 179.5° | 180.0° |
| C05 | N07 | C08 | C24 | 146.8° | 152.4° |
| N07 | C05 | N04 | H041 | 0.4° | 0.0° |
| N07 | C08 | C09 | C24 | 179.7° | 179.4° |
| N07 | C08 | C09 | C10 | 180.0° | 180.0° |
| N07 | C08 | C24 | C12 | 179.9° | 180.0° |
| N07 | C08 | C24 | F25 | 0.2° | 0.2° |
| N07 | C08 | C09 | H091 | 0.0° | 0.1° |
| C08 | C09 | C10 | H091 | 180.0° | 179.9° |
| C08 | C09 | C10 | C11 | 0.1° | 0.3° |
| C09 | C08 | C24 | C12 | 0.2° | 0.5° |
| C09 | C08 | C24 | F25 | 179.9° | 179.7° |
| C08 | C09 | C10 | H101 | 179.9° | 180.0° |
| C09 | C08 | N07 | H071 | 146.4° | 151.9° |
| C09 | C10 | C11 | H101 | 180.0° | 179.7° |
| C09 | C10 | C11 | C12 | 0.3° | 0.1° |
| C10 | C09 | C08 | C24 | 0.4° | 0.6° |
| C09 | C10 | C11 | H111 | 179.7° | 179.9° |
| C10 | C11 | C12 | H111 | 180.0° | 180.0° |
| C10 | C11 | C12 | C13 | 179.8° | 180.0° |
| C10 | C11 | C12 | C24 | 0.4° | 0.0° |
| C11 | C10 | C09 | H091 | 179.9° | 179.8° |
| C11 | C12 | C13 | O14 | 3.5° | 180.0° |
| C11 | C12 | C13 | N15 | 177.0° | 0.1° |
| C11 | C12 | C13 | C24 | 179.3° | 180.0° |
| C11 | C12 | C24 | F25 | 179.7° | 179.9° |
| C11 | C12 | C24 | C08 | 0.2° | 0.3° |
| C12 | C11 | C10 | H101 | 179.7° | 179.7° |
| O14 | C13 | N15 | C12 | 179.5° | 180.0° |
| O14 | C13 | N15 | C16 | 0.1° | 0.1° |
| O14 | C13 | C12 | C24 | 175.8° | 0.0° |
| O14 | C13 | N15 | H151 | 179.8° | 180.0° |
| C13 | N15 | C16 | H151 | 180.0° | 179.9° |
| C13 | N15 | C16 | C17 | 87.1° | 155.1° |
| N15 | C13 | C12 | C24 | 3.6° | 180.0° |
| C13 | N15 | C16 | C22 | 149.4° | 85.3° |
| C13 | N15 | C16 | H161 | 32.3° | 34.9° |
| N15 | C16 | C17 | C22 | 118.1° | 119.9° |
| N15 | C16 | C17 | H161 | 119.3° | 120.1° |
| N15 | C16 | C17 | C18 | 172.8° | 175.5° |
| N15 | C16 | C22 | N21 | 139.3° | 149.0° |
| N15 | C16 | C22 | O23 | 41.1° | 31.0° |
| C16 | N15 | C13 | C12 | 179.3° | 180.0° |
| N15 | C16 | C22 | H161 | 117.5° | 120.2° |
| N15 | C16 | C17 | H171 | 67.0° | 64.8° |
| N15 | C16 | C17 | H172 | 52.5° | 55.6° |
| C16 | C17 | C18 | H171 | 120.2° | 119.7° |
| C16 | C17 | C18 | H172 | 120.2° | 119.8° |
| C16 | C17 | C18 | C19 | 62.0° | 55.6° |
| C17 | C16 | C22 | N21 | 20.0° | 29.1° |
| C17 | C16 | C22 | O23 | 160.5° | 150.9° |
| C17 | C16 | C22 | H161 | 123.1° | 119.9° |
| C16 | C17 | H171 | H172 | 119.2° | 120.4° |
| C16 | C17 | C18 | H182 | 58.4° | 64.3° |
| C16 | C17 | C18 | H181 | 177.6° | 175.6° |
| C17 | C16 | N15 | H151 | 92.8° | 25.0° |
| C17 | C18 | C19 | H182 | 120.4° | 119.9° |
| C17 | C18 | C19 | H181 | 120.4° | 120.0° |
| C17 | C18 | C19 | O20 | 145.6° | 150.9° |
| C17 | C18 | C19 | N21 | 34.0° | 29.0° |
| C18 | C17 | C16 | C22 | 54.6° | 55.6° |
| C18 | C17 | H171 | H172 | 119.2° | 120.6° |
| C18 | C17 | C16 | H161 | 68.0° | 64.3° |
| C17 | C18 | H182 | H181 | 118.7° | 120.1° |
| C18 | C19 | O20 | N21 | 179.6° | 180.0° |
| C18 | C19 | N21 | C22 | 0.0° | 0.5° |
| C19 | C18 | C17 | H171 | 177.8° | 175.3° |
| C19 | C18 | C17 | H172 | 58.2° | 64.2° |
| C19 | C18 | H182 | H181 | 118.7° | 120.2° |
| C18 | C19 | N21 | H211 | 180.0° | 179.5° |
| O20 | C19 | N21 | C22 | 179.7° | 179.5° |
| O20 | C19 | C18 | H182 | 93.9° | 89.2° |
| O20 | C19 | C18 | H181 | 25.2° | 31.0° |
| O20 | C19 | N21 | H211 | 0.3° | 0.6° |
| C19 | N21 | C22 | H211 | 180.0° | 180.0° |
| C19 | N21 | C22 | O23 | 172.3° | 179.5° |
| C19 | N21 | C22 | C16 | 7.3° | 0.5° |
| N21 | C19 | C18 | H182 | 86.5° | 90.8° |
| N21 | C19 | C18 | H181 | 154.4° | 149.0° |
| N21 | C22 | O23 | C16 | 179.6° | 180.0° |
| N21 | C22 | C16 | H161 | 103.1° | 90.8° |
| O23 | C22 | C16 | H161 | 76.5° | 89.2° |
| O23 | C22 | N21 | H211 | 7.7° | 0.5° |
| C13 | C12 | C24 | F25 | 0.4° | 0.1° |
| C13 | C12 | C24 | C08 | 179.5° | 179.7° |
| C13 | C12 | C11 | H111 | 0.3° | 0.1° |
| C12 | C13 | N15 | H151 | 0.7° | 0.1° |
| C12 | C24 | F25 | C08 | 179.9° | 179.8° |
| C24 | C12 | C11 | H111 | 179.6° | 180.0° |
| N04 | C02 | C26 | C27 | 17.1° | 155.9° |
| N04 | C02 | C26 | C31 | 163.5° | 24.4° |
| N04 | C02 | C01 | H013 | 61.4° | 180.0° |
| N04 | C02 | C01 | H011 | 178.6° | 60.0° |
| N04 | C02 | C01 | H012 | 58.6° | 60.0° |
| N04 | C02 | C03 | H032 | 60.6° | 60.0° |
| N04 | C02 | C03 | H031 | 59.4° | 60.0° |
| N04 | C02 | C03 | H033 | 179.4° | 180.0° |
| C02 | C26 | C27 | C31 | 179.4° | 179.7° |
| C02 | C26 | C27 | C28 | 179.8° | 180.0° |
| C02 | C26 | C31 | C30 | 179.9° | 180.0° |
| C26 | C02 | C01 | H013 | 62.0° | 60.0° |
| C26 | C02 | C01 | H011 | 58.0° | 180.0° |
| C26 | C02 | C01 | H012 | 178.0° | 59.9° |
| C26 | C02 | C03 | H032 | 61.5° | 60.0° |
| C26 | C02 | C03 | H031 | 178.5° | 180.0° |
| C26 | C02 | C03 | H033 | 58.5° | 60.1° |
| C02 | C26 | C27 | H271 | 0.2° | 0.1° |
| C02 | C26 | C31 | H311 | 0.1° | 0.0° |
| C26 | C02 | N04 | H041 | 117.0° | 0.9° |
| C26 | C27 | C28 | H271 | 180.0° | 179.9° |
| C26 | C27 | C28 | C29 | 0.3° | 0.0° |
| C27 | C26 | C31 | C30 | 0.5° | 0.2° |
| C26 | C27 | C28 | H281 | 179.8° | 180.0° |
| C27 | C26 | C31 | H311 | 179.5° | 179.7° |
| C27 | C28 | C29 | H281 | 180.0° | 180.0° |
| C27 | C28 | C29 | C30 | 0.1° | 0.3° |
| C27 | C28 | C29 | C32 | 179.9° | 180.0° |
| C28 | C27 | C26 | C31 | 0.4° | 0.3° |
| C28 | C29 | C30 | C31 | 0.1° | 0.3° |
| C28 | C29 | C30 | C32 | 180.0° | 179.7° |
| C28 | C29 | C32 | C33 | 38.6° | 131.1° |
| C28 | C29 | C32 | C35 | 100.9° | 83.2° |
| C28 | C29 | C32 | C34 | 119.2° | 62.5° |
| C29 | C28 | C27 | H271 | 179.8° | 179.9° |
| C28 | C29 | C30 | H301 | 179.9° | 180.0° |
| C31 | C30 | C29 | H301 | 180.0° | 179.7° |
| C31 | C30 | C29 | C32 | 179.9° | 179.9° |
| C30 | C31 | C26 | H311 | 180.0° | 179.9° |
| C30 | C29 | C32 | C33 | 141.3° | 48.6° |
| C30 | C29 | C32 | C35 | 79.1° | 97.1° |
| C29 | C30 | C31 | C26 | 0.3° | 0.1° |
| C30 | C29 | C32 | C34 | 60.8° | 117.2° |
| C30 | C29 | C28 | H281 | 179.9° | 179.7° |
| C29 | C30 | C31 | H311 | 179.7° | 180.0° |
| C29 | C32 | C34 | C33 | 118.5° | 107.5° |
| C29 | C32 | C33 | C35 | 139.3° | 145.0° |
| C29 | C32 | C35 | C34 | 147.9° | 145.7° |
| C29 | C32 | C35 | F36 | 59.9° | 60.4° |
| C29 | C32 | C35 | F37 | 59.9° | 179.6° |
| C29 | C32 | C35 | F38 | 179.8° | 59.6° |
| C32 | C29 | C28 | H281 | 0.1° | 0.0° |
| C32 | C29 | C30 | H301 | 0.1° | 0.3° |
| C29 | C32 | C33 | H331 | 132.4° | 0.0° |
| C29 | C32 | C33 | H332 | 8.5° | 145.0° |
| C29 | C32 | C34 | H341 | 9.1° | 145.0° |
| C29 | C32 | C34 | H342 | 132.0° | 0.0° |
| C34 | C33 | C32 | H331 | 109.5° | 107.5° |
| C34 | C33 | C32 | H332 | 109.6° | 107.5° |
| C34 | C33 | C32 | C35 | 102.6° | 107.5° |
| C33 | C34 | C32 | H341 | 109.4° | 107.5° |
| C33 | C34 | C32 | H342 | 109.5° | 107.5° |
| C34 | C33 | H331 | H332 | 144.6° | 145.7° |
| C33 | C34 | H341 | H342 | 144.8° | 145.7° |
| C33 | C32 | C35 | F36 | 152.2° | 153.9° |
| C33 | C32 | C35 | F37 | 88.0° | 33.9° |
| C33 | C32 | C35 | F38 | 32.4° | 86.1° |
| C32 | C33 | H331 | H332 | 144.6° | 145.7° |
| C32 | C35 | F36 | F37 | 119.9° | 120.0° |
| C32 | C35 | F36 | F38 | 121.9° | 120.0° |
| C32 | C35 | F37 | F38 | 122.0° | 120.0° |
| C35 | C32 | C33 | H331 | 6.9° | 145.0° |
| C35 | C32 | C33 | H332 | 147.8° | 0.0° |
| C35 | C32 | C34 | H341 | 148.6° | 0.0° |
| C35 | C32 | C34 | H342 | 7.5° | 145.0° |
| F36 | C35 | F37 | F38 | 117.9° | 120.0° |
| F36 | C35 | C32 | C34 | 88.0° | 85.3° |
| F37 | C35 | C32 | C34 | 152.2° | 34.7° |
| F38 | C35 | C32 | C34 | 31.9° | 154.7° |
| C24 | C08 | C09 | H091 | 179.6° | 179.5° |
| C24 | C08 | N07 | H071 | 33.3° | 27.6° |
| C22 | C16 | C17 | H171 | 174.9° | 175.3° |
| C22 | C16 | C17 | H172 | 65.6° | 64.3° |
| C22 | C16 | N15 | H151 | 30.6° | 94.6° |
| C16 | C22 | N21 | H211 | 172.7° | 179.4° |
| C31 | C26 | C27 | H271 | 179.6° | 179.8° |
| C26 | C31 | C30 | H301 | 179.7° | 179.7° |
| C32 | C34 | H341 | H342 | 144.8° | 145.7° |
| H101 | C10 | C09 | H091 | 0.1° | 0.1° |
| H101 | C10 | C11 | H111 | 0.3° | 0.2° |
| H171 | C17 | C16 | H161 | 52.3° | 55.4° |
| H171 | C17 | C18 | H182 | 61.8° | 55.4° |
| H171 | C17 | C18 | H181 | 57.3° | 64.7° |
| H172 | C17 | C16 | H161 | 171.8° | 175.7° |
| H172 | C17 | C18 | H182 | 178.7° | 175.9° |
| H172 | C17 | C18 | H181 | 62.2° | 55.8° |
| H281 | C28 | C27 | H271 | 0.2° | 0.0° |
| H013 | C01 | H011 | H012 | 120.0° | 120.0° |
| H032 | C03 | H031 | H033 | 120.0° | 120.0° |
| H161 | C16 | N15 | H151 | 147.7° | 145.1° |
| H301 | C30 | C31 | H311 | 0.3° | 0.4° |
| H331 | C33 | C34 | H341 | 141.0° | 145.0° |
| H331 | C33 | C34 | H342 | 0.1° | 0.0° |
| H332 | C33 | C34 | H341 | 0.1° | 0.0° |
| H332 | C33 | C34 | H342 | 141.0° | 145.0° |
